A0A077YWX2_TRITR Loading...

Gal-bind lectin domain containing protein AlphaSync Fragmented

AlphaFold DB , UniProt , Accession A0A077YWX2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 3,198 aa.

						>A0A077YWX2_TRITR|A0A077YWX2
MGYYLLQLKKEQFISIQLGGFCNPQTNHSKKSHTMSNLYRACDVLFVIANCHNQFVFRYSLKTRNVFSPHERQSVAEENLVKRPPLKITLPLGTTEWSTELEELAAKLAVECIDEPYESQDGAAAIYVAKDKQGVKEVIAQLSEMAKKYNYDNNQCEQDDSAVCENYKQAIRLVGRRKIRLQNGNMQNSSELRGHSAHLRIREEDKVRLLEIFSKQAGQPYATGSQCTFCSATANCKDKLCCGEANPLTTNSSCGEKPTNLIPLYRLVHYNRNDTVLTTSTKTRDQLMKKVYEDKGIFGYIAENNNTTDCHYLTPLTALKRPTVDYYVYVAADEFKTVYESNGWDVVGELGYVVPSEGHCSASLKAYQFQRSTLNQFYYTVDSMQAAEMLKKKAKQDAAHNGEQPRTLPISGRSNSHSMSGGLLPFKIPFKHTGPSQNVVLELSLKAGASKIIIDLNSDCTVVWRLEGNFRTKLLFIDLNLWEKAPLHARTEGKLDNGVWKKQAQMGTNDAPIDGKQMNITAVLDDDLVQFYINGHKVSPKYSLPKSEVKVITAGGNVESYEISIQSPSSKIDEDELVQKSITTDNIETDTEEMPPRTIDELWTFSSLINGQWTNRVNFRYRIPLTSGKEFLLNTTVQNGLAQMSLNGEKISPQYKLPGKIVKNVTVTGDVKKCTVNVVHMKRIIKLHEYDPETVEEPATVPTTEQAWNEQEKYKGPAKSSVMLRSIQATVKLVKRPRYFYMRVKMENDKEWKLEAHLDDKEWTFSQLINQEWKQRLPFAYELPKRYYNNVTLTVLAQDKMAQVLVNGKAISPKYQIPGLRVKNVTVAGDIASAVVRVAHVKRVARPTYVIQGQGETDTDDAKQQPQEETRKRVDLRRLQEKEWTSKTLTNRVWEQQEDSFKSKLPLDDERTFNLLAKVKDRKMQLWLNGRKLPLTYTLPAERAKKIIIGGEVEAFIVNALHERIPPTPSELVSVDPKKKRRTDPFVRTTIQKGLLTEKEGADRPPEFSLLPRTEGTQILPKTATTNVALKKNAQNFRVDVKMGPSATLRLDAPLRRPWTLSRIVDGNEEKITQFKPNLRMTDLKNIPLTFTIENGFVQLSVNGRNISKKFPLPGNQMETIEVSGDVDNYSVDTEYPEKKQVPSSEKGKDIEDKDTEKNKDDADASKQLSRPFKEGPLHHIRATVQLQPDASEFYMIIHMDNNIAWKINVNLKTKEWTPSTLINNVWEQQEDTFKSTLRLNDKRTFNLLAKVKNRKMQLWLNGKKLSPIYTLPGERAKKIVINGDVQAYNIDAFHKRTLPKPTGADSVDPQKKRKVDPLVRTTIKSETLTDKENPERPAEFSPWSSNEGSQVLPRTATTNVALKKNARNFRVDVKMGPRATLRLHAPLRRPWTLSRIIDGNEEKITQFKPNLRVTDLKNIPLTFTMDNGFAQLSVNGTNISKKFPLPGNRVEKVDVNGDVDSYSVDMEYPEAEQPVISEEETEGLRFPDENEIEDTNTKTSEKNEDDVKPLSYPPKRGPLRLIHATVQMQPDPSKFYMIVRMDNNTAWRINTNMKTQRWTPETLVNNVWVQQKISFKSPLPLNDKRAFNLLAKVTDREVELWVNKRKISPKYTLPGTRAEKVVIGGDVEAFVVNTLHDRTLPTPIEAGSADPKKKRRKDPYVRRTIRSGPLEDDGDLGRYPEFSPWSNSGETRMLPKTATANIALKKNPKGFRVDLNMGRGATLRLEAPLKRPWKLSQIVDGNEEKSTEFKPNLQVIDLNNIPLTFTIDSGFVQLSVNGRNIGKKFPLPGNRLETIGVSGDVDSYSIDTEYPKADERVTSEKDTEHWRLPEKEIDIENTDTEITEDDEDAVKEWKPSTVIDNVWEQQDSFQSKPYIGSEKTFNFVANVKDGTVQYLPQLNTKRAVELPKKTTVNVALRKNAQNFRVDVKMGPRATLRLDASLRRPWKLSQIIDGNGEKVTQFKPNVRVTNLRKIRLTFTMDNGVVQLSVKGRNISKKFPLPGNHVEAIEVTGDVYGYSVDTDLPVSDQTGPSETNVKSDAENGELLETRKVVRTTNDGADGENEGDAKGHPPKMSPKYESALRKIITKIKLKPDTKSFVLRMQQESGKAWQLDVDLPTQIWRVSSLSGGTWKKHPSFKNYVPLAAGQEFDLTGNIINGLIQFDKKKRPYTLADAELTLRPNGRHIYIRIPMEKNTEWMITADAKTNEWTCSSMINGERLREVSYQSNHPLQYGKKFPLLIFVKAGVGQVGPDMEKAYTDKYALPGRSVKGIMITGDVDVHYLSAVNYPRDSMDSVVLPSWKPTIHTEDIVTEIKDHWEESNDYKNALAKRIQYITEAMPDSPSAGMIFMTMKVNPNAKKFHIVAEMDEKKIGWILDAQLPELHWVLRTVIDGKFKTVGNYTSKTPMRQDGKILLLTQIHNGHLKFIIDTVAVPLKCKLPATIVRNVIALGDVESFEPTIVYWKNSKSPQRYDDGSFGQTKIRPEELIINAGSPSSAIGRAKLTEILEVSKAPPKKGQQEKLRDMQSIHATVRLEPNAESFAVHIKLDDETEWKAVVNVLTLRWTISSFVNGRWIESLAFKSRQPLIQGATFKLIIIIDIYTAQILINGQVISPKCPLLGESAKQVTISGDVDVRAIRTVYWNILTGPEDPLQAFGQQQKSPRSVIEKVYGEIMREKQEYFYSKPRGILNSRRPEELKWLINIPMKLLPWADKFGVSIKMDLHVLWQLVANVKTNEWILSSYINGTEKNKVSFKNPVPLTTGKLFRLTISIGSGESEVMLNNKKVSPVYAVPGRSLGRVVVTGDVIAQEIRSTQLRREPLITTKGDYLYGYVLKWETLKKIYDTPVDDKKRKRSLKVEGEYVDITESKILLFTRVLLKKTRKAFTVDFIMKVSVTNPLGTTSMEASIQGIKNTIDKVSQVLLNVAEYRLPYSVSLRDINGVQYLYLRLKFKPGAKAISLKLFSGHKVIYNDQVQTTNKLRSKAHVDRAVIDGDVILYKMVAGTEKSIMDHVPKKERKIFLYYNQLSKMKKQGEAMTLLEIILYVLKREHGKKINLEPIALPYYVPFKRNVVANFAMLKLAFKQNAGTFSIDFMIDNEMVLRVQGTLAKNSLNAENKHALRLKENRVDTMLIKETENKPFDVLVILYRSRIYITYGEALRVYEVFGERRLVNGIKISGDVNLYETSPGVIEKVKRKRRGT
					

Structure and PAE viewers are unavailable as this is a multi-fragment structure.

Download 10 Fragment Structures AlphaSync Parameters PDBs Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.4	Very low	29.4	Very low	252 Å²	252	153.5 Å²	153.5	100%	1.241	74%	0.74	S	S	*	*				0	123.2	0	-61.1	175.8	-178.5	0	0	108.2
2	G	34.9	Very low	29.1	Very low	61 Å²	61	153.3 Å²	153.3	63%	0.629	74%	0.737	S	S	*	*			cis	171.7	140.4	-9.1	0	0	0	0	0	111.4
3	Y	28.9	Very low	28.7	Very low	196 Å²	196	154.1 Å²	154.1	77%	0.769	74%	0.736	S	S	*	*			trans	65	140.9	155.1	-71.8	-115.8	0	0	0	118.5
4	Y	31.3	Very low	28.5	Very low	164 Å²	164	152.9 Å²	152.9	64%	0.643	73%	0.734	S	S	*	*			cis	-160.5	146.2	-12	-123.8	-150.4	0	0	0	105.7
5	L	30.7	Very low	28.2	Very low	123 Å²	123	148.7 Å²	148.7	64%	0.644	73%	0.727	S	S	*	*				55.7	141.4	88.8	-68	-175.5	0	0	0	114
6	L	29.8	Very low	28.3	Very low	117 Å²	117	148.5 Å²	148.5	61%	0.613	73%	0.728	S	S	*	*			cis	-168.5	164	19.6	-112.8	158	0	0	0	112.4
7	Q	28	Very low	28.1	Very low	147 Å²	147	149.1 Å²	149.1	69%	0.687	73%	0.729	S	S	*	*			trans	43.2	145.6	144.7	-80.2	170.9	1.2	0	0	122.4
8	L	27.2	Very low	28.1	Very low	159 Å²	159	149.3 Å²	149.3	83%	0.832	73%	0.733	S	S	*	*				62.3	92	53.4	-83.9	170	0	0	0	115.9
9	K	28	Very low	28.1	Very low	180 Å²	180	145.5 Å²	145.5	78%	0.783	74%	0.736	S	S	*	*			trans	-173.8	133.9	142.8	-100.9	165.3	-176.3	-173.8	0	107.1
10	K	25.8	Very low	28.2	Very low	163 Å²	163	141.7 Å²	141.7	71%	0.709	74%	0.735	S	S	*	*				54.3	133.2	87.5	-75.7	169.3	155	-109.8	0	111
11	E	26.7	Very low	28.2	Very low	126 Å²	126	144.4 Å²	144.4	59%	0.589	74%	0.741	S	S	*	*			cis	-163.4	140.3	24.1	-123	137.4	-151.3	0	0	108.3
12	Q	25.8	Very low	27.9	Very low	151 Å²	151	137.2 Å²	137.2	71%	0.706	72%	0.715	S	S	*	*				74.5	131.9	105.4	-82.9	-168	-19	0	0	119
13	F	23.8	Very low	27.6	Very low	164 Å²	164	141.4 Å²	141.4	72%	0.719	72%	0.722	S	S	*	*			trans	82.7	141.2	142.6	-83.6	-127.6	0	0	0	122
14	I	26.2	Very low	27.9	Very low	138 Å²	138	136.4 Å²	136.4	71%	0.708	71%	0.714	S	S	*	*			trans	64	108	146	-70	173.6	0	0	0	116.3
15	S	24	Very low	27.7	Very low	90 Å²	90	136.5 Å²	136.5	63%	0.629	72%	0.72	S	S	*	*				99.1	164.7	54.3	85.9	0	0	0	0	112.6
16	I	29.1	Very low	27.6	Very low	145 Å²	145	135.1 Å²	135.1	74%	0.744	72%	0.717	S	S	*	*			trans	69.6	98.9	174.9	-59.7	157.3	0	0	0	113.2
17	Q	25.9	Very low	27.5	Very low	159 Å²	159	135.2 Å²	135.2	74%	0.743	72%	0.718	S	S	*	*				83.4	132.3	71.5	-99.7	-158.3	-25.9	0	0	115.6
18	L	27.5	Very low	27.5	Very low	153 Å²	153	136.2 Å²	136.2	80%	0.801	72%	0.723	S	S	*	*			trans	69.5	116.9	146.3	-62.6	168	0	0	0	120.1
19	G	28.5	Very low	27.6	Very low	77 Å²	77	132.7 Å²	132.7	79%	0.794	71%	0.711	S	S	*	*				124.5	154.2	112.7	0	0	0	0	0	116.9
20	G	30.1	Very low	27.9	Very low	69 Å²	69	132.1 Å²	132.1	71%	0.711	71%	0.709	S	S	*	*			trans	89.8	71.4	165.7	0	0	0	0	0	114.8
21	F	27.3	Very low	28.2	Very low	199 Å²	199	133.4 Å²	133.4	87%	0.873	71%	0.714	S	S	*	*				59.3	112	87.1	-94	-100.5	0	0	0	116.9
22	C	26	Very low	28.5	Very low	101 Å²	101	131.4 Å²	131.4	68%	0.682	71%	0.714	S	S	*	*				70.8	112.8	127.9	-81.4	0	0	0	0	123.2
23	N	30	Very low	29	Very low	148 Å²	148	132.3 Å²	132.3	79%	0.791	72%	0.718	S	S	*	*				83.9	171.2	114.6	-135.8	29.6	0	0	0	116
24	P	35.4	Very low	29.5	Very low	92 Å²	92	129.9 Å²	129.9	60%	0.597	72%	0.717	S	S	*	*				-127.7	-155.1	-90	40.4	-24.3	0	0	0	111.9
25	Q	27.1	Very low	29.6	Very low	165 Å²	165	131.3 Å²	131.3	77%	0.771	72%	0.723	S	S	*	*			trans	74.5	159.6	170.1	-52.4	-140.4	8.9	0	0	115.6
26	T	27.3	Very low	30	Very low	95 Å²	95	130.6 Å²	130.6	58%	0.583	72%	0.718	S	S	*	*			cis	-155.3	170.9	-38.4	35.5	0	0	0	0	106.5
27	N	27.3	Very low	30.1	Very low	118 Å²	118	130.1 Å²	130.1	63%	0.631	72%	0.717	S	S	*	*			trans	69.1	131.1	140.6	-77.3	-14.6	0	0	0	122.7
28	H	29	Very low	30.3	Very low	169 Å²	169	128.2 Å²	128.2	78%	0.782	71%	0.711	S	S	*	*			trans	68.7	148.4	143.4	-60.9	-32.6	0	0	0	118.2
29	S	29.2	Very low	30.5	Very low	84 Å²	84	129.2 Å²	129.2	59%	0.587	71%	0.705	S	S	*	*			cis	-165.9	164.7	-12	53.2	0	0	0	0	106.7
30	K	33.2	Very low	30.7	Very low	169 Å²	169	135 Å²	135	74%	0.735	70%	0.703	S	S	*	*				173.6	143.6	69.5	-116	147.8	-168.8	174.2	0	109.7
31	K	33.6	Very low	30.7	Very low	190 Å²	190	135.6 Å²	135.6	83%	0.826	70%	0.701	S	S	*	*			trans	68.5	140.2	139.4	-71.8	178.9	179.8	-165.4	0	119.6
32	S	32.8	Very low	30.9	Very low	84 Å²	84	131.2 Å²	131.2	59%	0.587	70%	0.695	S	S	*	*			cis	-167.8	157.8	1.1	55.8	0	0	0	0	115.6
33	H	35.9	Very low	31.1	Very low	169 Å²	169	132.5 Å²	132.5	78%	0.782	69%	0.694	S	S	*	*			trans	66.5	139.6	153.5	-60.7	-51.9	0	0	0	117.8
34	T	33.7	Very low	31.2	Very low	114 Å²	114	131.4 Å²	131.4	70%	0.699	69%	0.693	S	S	*	*			cis	-160.3	153.5	-1.9	4	0	0	0	0	110.6
35	M	29.6	Very low	31	Very low	167 Å²	167	133.1 Å²	133.1	82%	0.823	70%	0.696	S	S	*	*			trans	28.8	141.1	145.3	-64.3	-161.2	84	0	0	121.5
36	S	32.2	Very low	31	Very low	76 Å²	76	132.7 Å²	132.7	53%	0.531	69%	0.692	S	S	.	*			cis	-174.8	160	-1.4	58.3	0	0	0	0	111.4
37	N	29.9	Very low	31.1	Very low	135 Å²	135	134 Å²	134	72%	0.722	70%	0.7	S	S	*	*			trans	66.5	145.7	145.1	-62.4	-9.1	0	0	0	118.4
38	L	30.2	Very low	31.2	Very low	118 Å²	118	134.5 Å²	134.5	62%	0.618	70%	0.701	S	S	*	*			cis	-159.2	136.4	0.2	-144.4	90.9	0	0	0	110
39	Y	31.7	Very low	31.1	Very low	175 Å²	175	130.2 Å²	130.2	69%	0.686	70%	0.695	S	S	*	*			trans	64.5	149.5	155.6	-69.8	-161.2	0	0	0	119.3
40	R	32.8	Very low	31.1	Very low	197 Å²	197	132.8 Å²	132.8	74%	0.743	70%	0.702	S	S	*	*			cis	-156.4	132.7	-14.4	-106.6	174.5	179.2	178.8	-2.2	105.2
41	A	30.9	Very low	30.9	Very low	82 Å²	82	131 Å²	131	68%	0.678	71%	0.709	S	S	*	*				58.1	133.2	81.1	0	0	0	0	0	113
42	C	31.4	Very low	30.7	Very low	108 Å²	108	129.2 Å²	129.2	73%	0.73	70%	0.704	S	S	*	*			cis	-138	147.4	21.2	-55.9	0	0	0	0	110.8
43	D	29.6	Very low	30.4	Very low	127 Å²	127	132 Å²	132	68%	0.679	71%	0.712	S	S	*	*				59	144.8	85.6	-42.5	-61.7	0	0	0	114
44	V	33	Very low	30.1	Very low	125 Å²	125	131.6 Å²	131.6	76%	0.758	71%	0.711	S	S	*	*			cis	-149.8	133.5	34.2	173.9	0	0	0	0	107.6
45	L	30.1	Very low	29.6	Very low	128 Å²	128	133.7 Å²	133.7	67%	0.67	71%	0.71	S	S	*	*				78.6	151.7	57.1	-95.4	170.8	0	0	0	116.4
46	F	27.9	Very low	29.5	Very low	157 Å²	157	131.7 Å²	131.7	69%	0.689	71%	0.707	S	S	*	*			trans	67.5	147.4	170.1	-71.5	-74.9	0	0	0	117.6	I48	F46-I48 HydrophobicContact CD1-CD1 3.65Å; F46-I48 HydrophobicContact CE1-CD1 3.69Å
47	V	29.5	Very low	29.1	Very low	123 Å²	123	135.4 Å²	135.4	75%	0.745	71%	0.714	S	S	*	*			cis	-141.8	124.5	12.8	175.4	0	0	0	0	106.6
48	I	28.7	Very low	29	Very low	127 Å²	127	140.1 Å²	140.1	65%	0.651	72%	0.722	S	S	*	*				74.8	136.3	72.2	-67	172.6	0	0	0	115.7	F46	F46-I48 HydrophobicContact CD1-CD1 3.65Å; F46-I48 HydrophobicContact CE1-CD1 3.69Å
49	A	27.9	Very low	28.7	Very low	80 Å²	80	143.6 Å²	143.6	66%	0.661	73%	0.728	S	S	*	*			trans	67.4	152.6	159.2	0	0	0	0	0	119.3
50	N	29.2	Very low	28.3	Very low	138 Å²	138	139.9 Å²	139.9	74%	0.738	73%	0.728	S	S	*	*			cis	173.5	132.5	-26.5	-105.2	-41	0	0	0	105.1
51	C	29.4	Very low	28	Very low	130 Å²	130	137.1 Å²	137.1	88%	0.878	73%	0.727	S	S	*	*			trans	159	86.8	166.2	-95.3	0	0	0	0	105.1
52	H	28	Very low	27.9	Very low	153 Å²	153	142.5 Å²	142.5	71%	0.708	74%	0.735	S	S	*	*			cis	61.9	123.1	40.5	-118.9	111.4	0	0	0	114.2
53	N	28	Very low	27.7	Very low	142 Å²	142	141.2 Å²	141.2	76%	0.759	72%	0.724	S	S	*	*			trans	69.8	134.3	-178.8	-57.7	-29.9	0	0	0	114
54	Q	27.7	Very low	27.8	Very low	162 Å²	162	144.1 Å²	144.1	76%	0.757	73%	0.725	S	S	*	*			cis	-146.1	153.2	28.8	-85.1	-164.6	-2.1	0	0	115.1
55	F	24.6	Very low	28.3	Very low	157 Å²	157	143.1 Å²	143.1	69%	0.689	72%	0.716	S	S	*	*			trans	49.5	119.5	143.8	-74	-111.3	0	0	0	119.3	F57	F55-F57 HydrophobicContact CD1-CD2 4.4Å; F55-F57 HydrophobicContact CD1-CE2 4.46Å
56	V	27.4	Very low	28.9	Very low	125 Å²	125	141.1 Å²	141.1	76%	0.758	71%	0.709	S	S	*	*				52.5	96.8	52.9	-170.8	0	0	0	0	113.6
57	F	23.9	Very low	29.8	Very low	155 Å²	155	135 Å²	135	68%	0.68	68%	0.682	S	S	*	*			trans	-155.8	133	132.4	-113.9	-75.5	0	0	0	111.9	F55 Y59	F55-F57 HydrophobicContact CD1-CD2 4.4Å; F55-F57 HydrophobicContact CD1-CE2 4.46Å; F57-Y59 HydrophobicContact CB-CD2 4.49Å; F57-Y59 HydrophobicContact CB-CE2 4.46Å; F57-Y59 HydrophobicContact CD1-CD2 4.26Å; F57-Y59 AromaticContact CD1-CE2 3.56Å; F57-Y59 HydrophobicContact CD1-CE2 3.56Å; F57-Y59 HydrophobicContact CE1-CE2 4.16Å; F57-Y59 HydrophobicContact CG-CE2 4.2Å
58	R	26.7	Very low	30.7	Very low	233 Å²	233	130.8 Å²	130.8	88%	0.879	66%	0.658	S	S	*	*			trans	-73.5	128.8	165.6	-65.2	169.4	172.4	170.8	-2.9	108.2
59	Y	23.8	Very low	31.8	Very low	192 Å²	192	129.3 Å²	129.3	75%	0.753	66%	0.657	S	S	*	*			trans	-140.8	133.8	150.5	-84.2	-68.9	0	0	0	113.4	F57 L61	F57-Y59 HydrophobicContact CB-CD2 4.49Å; F57-Y59 HydrophobicContact CB-CE2 4.46Å; F57-Y59 HydrophobicContact CD1-CD2 4.26Å; F57-Y59 AromaticContact CD1-CE2 3.56Å; F57-Y59 HydrophobicContact CD1-CE2 3.56Å; F57-Y59 HydrophobicContact CE1-CE2 4.16Å; F57-Y59 HydrophobicContact CG-CE2 4.2Å; Y59-L61 PolarHBondContact O-N 3.39Å
60	S	24.2	Very low	32.9	Very low	97 Å²	97	132.1 Å²	132.1	68%	0.678	66%	0.656	S	S	*	*			trans	-69.2	108.2	166.5	140.7	0	0	0	0	108.5	K62	S60-K62 PolarHBondContact O-N 3.25Å
61	L	27	Very low	34.1	Very low	139 Å²	139	128.2 Å²	128.2	73%	0.728	63%	0.633	S	S	*	*			trans	-79.6	74.8	166	-73.1	176.7	0	0	0	110.6	Y59 T63	Y59-L61 PolarHBondContact O-N 3.39Å; L61-T63 HydrophobicContact CD2-CG2 3.68Å; L61-T63 PolarHBondContact O-N 3.44Å; L61-T63 VanDerWaalsContact O-N 3.09Å
62	K	27.6	Very low	35.3	Very low	195 Å²	195	124.9 Å²	124.9	85%	0.848	60%	0.602	S	S	*	*			trans	-70.4	76.2	148.5	-81.7	-173.8	174.2	-177.2	0	107.5	S60	S60-K62 PolarHBondContact O-N 3.25Å
63	T	26.7	Very low	36.4	Very low	81 Å²	81	123 Å²	123	50%	0.497	59%	0.593	S	S	.	*			trans	-135.1	140.4	-179.1	53.5	0	0	0	0	112.1	L61 N65	L61-T63 HydrophobicContact CD2-CG2 3.68Å; L61-T63 PolarHBondContact O-N 3.44Å; L61-T63 VanDerWaalsContact O-N 3.09Å; T63-N65 PolarHBondContact O-N 3.05Å
64	R	32.4	Very low	37.4	Very low	188 Å²	188	118 Å²	118	71%	0.709	57%	0.569	S	S	*	*			trans	-68.7	93.3	-172.2	-59.9	175.3	-175.3	163.3	-0.2	111.6	E71	R64-E71 WeakPolarHBondContact CD-OE1 3.48Å; R64-E71 IonicContact CZ-OE1 2.83Å; R64-E71 IonicContact NE-OE1 2.82Å; R64-E71 IonicContact NH1-OE1 3.29Å; R64-E71 PolarHBondContact NH1-OE1 3.33Å; R64-E71 IonicContact NH1-OE2 3.86Å
65	N	43.3	Very low	38.5	Very low	103 Å²	103	110.6 Å²	110.6	55%	0.551	54%	0.535	S	S	*	.			trans	-93.2	-1.7	169.5	-69.5	9.8	0	0	0	113.1	T63 Q182	T63-N65 PolarHBondContact O-N 3.05Å; N65-Q182 PolarHBondContact O-NE2 3.29Å
66	V	42.9	Very low	39.5	Very low	87 Å²	87	104.5 Å²	104.5	53%	0.527	51%	0.514	S	S	.	.	S	Bend	trans	-114	128.8	171.1	175.2	0	0	0	0	105.1	S68 E102	V66-S68 PolarHBondContact O-N 3.44Å; V66-E102 WeakPolarHBondContact CG1-OE1 3.36Å
67	F	46.2	Very low	40.5	Very low	29 Å²	29	103 Å²	103	13%	0.127	50%	0.498	C	S	.	.			trans	-61.3	126.5	176.2	-83.2	-105.6	0	0	0	108.1	E71 R72 V75 W97 E102 L181	F67-E71 HydrophobicContact CB-CB 4.26Å; F67-E71 HydrophobicContact CD1-CB 3.56Å; F67-E71 HydrophobicContact CE1-CB 4.34Å; F67-E71 HydrophobicContact CG-CB 4.34Å; F67-R72 HydrophobicContact CB-CB 4.41Å; F67-R72 HydrophobicContact CB-CG 3.41Å; F67-R72 VanDerWaalsContact CB-CG 3.41Å; F67-R72 VanDerWaalsContact O-CZ 3.28Å; F67-R72 PolarHBondContact O-NE 2.87Å; F67-R72 VanDerWaalsContact O-NE 3.13Å; F67-V75 HydrophobicContact CD1-CG2 3.9Å; F67-V75 HydrophobicContact CE1-CG2 3.39Å; F67-V75 HydrophobicContact CZ-CG2 4.15Å; F67-W97 HydrophobicContact CB-CH2 3.94Å; F67-W97 HydrophobicContact CB-CZ2 3.94Å; F67-W97 HydrophobicContact CD1-CH2 4.25Å; F67-W97 AromaticContact CD2-CH2 3.48Å; F67-W97 HydrophobicContact CD2-CH2 3.48Å; F67-W97 VanDerWaalsContact CD2-CH2 3.48Å; F67-W97 AromaticContact CD2-CZ2 3.87Å; F67-W97 HydrophobicContact CD2-CZ2 3.87Å; F67-W97 HydrophobicContact CE2-CH2 4.03Å; F67-W97 AromaticContact CG-CH2 3.63Å; F67-W97 HydrophobicContact CG-CH2 3.63Å; F67-W97 HydrophobicContact CG-CZ2 4.06Å; F67-W97 HydrophobicContact CG-CZ3 4.4Å; F67-E102 PolarHBondContact N-OE1 2.87Å; F67-L181 HydrophobicContact CE2-CB 4.42Å; F67-L181 WeakPolarHBondContact CE2-O 3.44Å; F67-L181 HydrophobicContact CZ-CB 4.23Å
68	S	49.6	Very low	41.6	Very low	33 Å²	33	98.8 Å²	98.8	23%	0.231	48%	0.481	C	S	.	.			trans	-60.3	157.8	170.5	64.5	0	0	0	0	109.8	V66 H70 E71 R72	V66-S68 PolarHBondContact O-N 3.44Å; S68-H70 PolarHBondContact O-N 3.41Å; S68-H70 VanDerWaalsContact O-N 3.08Å; S68-E71 WeakPolarHBondContact CB-OE2 3.17Å; S68-E71 PolarHBondContact N-OE2 3.29Å; S68-E71 PolarHBondContact O-N 3.47Å; S68-E71 VanDerWaalsContact OG-CG 3.26Å; S68-E71 WeakPolarHBondContact OG-CG 3.43Å; S68-E71 PolarHBondContact OG-N 3.43Å; S68-E71 PolarHBondContact OG-OE2 2.78Å; S68-R72 WeakPolarHBondContact O-CG 3.42Å; S68-R72 PolarHBondContact O-N 3.1Å
69	P	51.4	Low	42.4	Very low	97 Å²	97	88.9 Å²	88.9	63%	0.63	45%	0.446	S	S	*	.	H	α-helix	trans	-50.3	-38.2	178.1	-28.8	36.2	0	0	0	113.3	Q73	P69-Q73 VanDerWaalsContact O-CB 3.29Å; P69-Q73 WeakPolarHBondContact O-CB 3.25Å; P69-Q73 PolarHBondContact O-N 3.34Å
70	H	50.5	Low	43.1	Very low	139 Å²	139	83.2 Å²	83.2	64%	0.644	43%	0.428	S	S	*	.	H	α-helix	trans	-67.7	-44.6	174.2	-169.8	-46.7	0	0	0	112.8	S68 Q73 S74	S68-H70 PolarHBondContact O-N 3.41Å; S68-H70 VanDerWaalsContact O-N 3.08Å; H70-Q73 PolarHBondContact O-N 3.21Å; H70-S74 PolarHBondContact ND1-OG 3.15Å; H70-S74 PolarHBondContact O-N 3.24Å; H70-S74 PolarHBondContact O-OG 3.06Å
71	E	54.8	Low	43.5	Very low	55 Å²	55	83.9 Å²	83.9	26%	0.257	43%	0.428	S	S	.	.	H	α-helix	trans	-69.1	-34.2	178.3	-63.2	154	147.6	0	0	111.2	R64 F67 S68 Q73 S74 V75	R64-E71 WeakPolarHBondContact CD-OE1 3.48Å; R64-E71 IonicContact CZ-OE1 2.83Å; R64-E71 IonicContact NE-OE1 2.82Å; R64-E71 IonicContact NH1-OE1 3.29Å; R64-E71 PolarHBondContact NH1-OE1 3.33Å; R64-E71 IonicContact NH1-OE2 3.86Å; F67-E71 HydrophobicContact CB-CB 4.26Å; F67-E71 HydrophobicContact CD1-CB 3.56Å; F67-E71 HydrophobicContact CE1-CB 4.34Å; F67-E71 HydrophobicContact CG-CB 4.34Å; S68-E71 WeakPolarHBondContact CB-OE2 3.17Å; S68-E71 PolarHBondContact N-OE2 3.29Å; S68-E71 PolarHBondContact O-N 3.47Å; S68-E71 VanDerWaalsContact OG-CG 3.26Å; S68-E71 WeakPolarHBondContact OG-CG 3.43Å; S68-E71 PolarHBondContact OG-N 3.43Å; S68-E71 PolarHBondContact OG-OE2 2.78Å; E71-Q73 VanDerWaalsContact C-N 3.33Å; E71-S74 PolarHBondContact O-N 2.93Å; E71-V75 WeakPolarHBondContact O-CG2 3.47Å; E71-V75 PolarHBondContact O-N 3.46Å
72	R	55.7	Low	43.8	Very low	61 Å²	61	84.2 Å²	84.2	23%	0.23	42%	0.423	C	S	.	.	H	α-helix	trans	-60.5	-44.8	171.2	-68	-179.8	178	140.5	-3.4	111	F67 S68 V75 A76 W97 E102	F67-R72 HydrophobicContact CB-CB 4.41Å; F67-R72 HydrophobicContact CB-CG 3.41Å; F67-R72 VanDerWaalsContact CB-CG 3.41Å; F67-R72 VanDerWaalsContact O-CZ 3.28Å; F67-R72 PolarHBondContact O-NE 2.87Å; F67-R72 VanDerWaalsContact O-NE 3.13Å; S68-R72 WeakPolarHBondContact O-CG 3.42Å; S68-R72 PolarHBondContact O-N 3.1Å; R72-V75 PolarHBondContact O-N 2.81Å; R72-A76 WeakPolarHBondContact O-CB 3.33Å; R72-A76 PolarHBondContact O-N 3.26Å; R72-W97 HydrophobicContact CB-CD2 4.05Å; R72-W97 HydrophobicContact CB-CE3 4Å; R72-W97 HydrophobicContact CB-CG 4.34Å; R72-W97 HydrophobicContact CG-CD2 3.65Å; R72-W97 HydrophobicContact CG-CE3 3.97Å; R72-W97 HydrophobicContact CG-CG 4.02Å; R72-W97 HydrophobicContact CG-CH2 4.39Å; R72-W97 HydrophobicContact CG-CZ2 4.1Å; R72-W97 HydrophobicContact CG-CZ3 4.32Å; R72-W97 VanDerWaalsContact NE-NE1 3.19Å; R72-E102 IonicContact CZ-OE2 3.46Å; R72-E102 IonicContact NE-OE2 3.32Å; R72-E102 PolarHBondContact NE-OE2 2.85Å; R72-E102 IonicContact NH2-OE1 2.68Å; R72-E102 IonicContact NH2-OE2 3.8Å; R72-E102 PolarHBondContact NH2-OE2 2.83Å
73	Q	50.3	Low	44.5	Very low	112 Å²	112	79.5 Å²	79.5	52%	0.523	40%	0.4	S	S	.	.	H	α-helix	trans	-66.2	-45.9	178.1	-178.9	162.4	-4.4	0	0	111.2	P69 H70 E71 V75 A76 E77	P69-Q73 VanDerWaalsContact O-CB 3.29Å; P69-Q73 WeakPolarHBondContact O-CB 3.25Å; P69-Q73 PolarHBondContact O-N 3.34Å; H70-Q73 PolarHBondContact O-N 3.21Å; E71-Q73 VanDerWaalsContact C-N 3.33Å; Q73-V75 VanDerWaalsContact C-N 3.3Å; Q73-V75 PolarHBondContact O-N 2.79Å; Q73-A76 CarbonylContact O-C 3.56Å; Q73-A76 WeakPolarHBondContact O-CB 3.29Å; Q73-A76 PolarHBondContact O-N 3.22Å; Q73-A76 VanDerWaalsContact O-N 3.09Å; Q73-E77 HydrophobicContact CG-CG 4.33Å; Q73-E77 WeakPolarHBondContact CG-OE1 3.41Å; Q73-E77 PolarHBondContact NE2-OE1 2.84Å; Q73-E77 WeakPolarHBondContact O-CB 3.37Å; Q73-E77 VanDerWaalsContact O-CG 3.28Å; Q73-E77 WeakPolarHBondContact O-CG 3.31Å; Q73-E77 PolarHBondContact O-N 2.96Å
74	S	49.9	Very low	44.7	Very low	37 Å²	37	78.8 Å²	78.8	26%	0.259	40%	0.397	S	S	.	.	H	α-helix	trans	-62.5	-32.1	174.6	-55.9	0	0	0	0	113.3	H70 E71 E78	H70-S74 PolarHBondContact ND1-OG 3.15Å; H70-S74 PolarHBondContact O-N 3.24Å; H70-S74 PolarHBondContact O-OG 3.06Å; E71-S74 PolarHBondContact O-N 2.93Å; S74-E78 WeakPolarHBondContact O-CB 3.32Å; S74-E78 WeakPolarHBondContact O-CG 3.5Å; S74-E78 PolarHBondContact O-N 2.8Å
75	V	50.2	Low	44.7	Very low	7 Å²	7	76.2 Å²	76.2	4%	0.042	41%	0.405	C	S	.	.	H	α-helix	trans	-71.4	-39	171.5	169.1	0	0	0	0	112.1	F67 E71 R72 Q73 E77 N79 W97 V135 L181	F67-V75 HydrophobicContact CD1-CG2 3.9Å; F67-V75 HydrophobicContact CE1-CG2 3.39Å; F67-V75 HydrophobicContact CZ-CG2 4.15Å; E71-V75 WeakPolarHBondContact O-CG2 3.47Å; E71-V75 PolarHBondContact O-N 3.46Å; R72-V75 PolarHBondContact O-N 2.81Å; Q73-V75 VanDerWaalsContact C-N 3.3Å; Q73-V75 PolarHBondContact O-N 2.79Å; V75-E77 VanDerWaalsContact C-N 3.28Å; V75-N79 WeakPolarHBondContact O-CB 3.33Å; V75-N79 PolarHBondContact O-N 3.21Å; V75-N79 PolarHBondContact O-ND2 2.62Å; V75-W97 HydrophobicContact CB-CZ3 4.35Å; V75-W97 HydrophobicContact CG1-CZ3 4.09Å; V75-V135 HydrophobicContact CG2-CG1 4.28Å; V75-V135 HydrophobicContact CG2-CG2 4.01Å; V75-L181 HydrophobicContact CG1-CD1 3.76Å; V75-L181 HydrophobicContact CG1-CG 4.32Å; V75-L181 HydrophobicContact CG2-CD1 4.4Å
76	A	46.2	Very low	44.2	Very low	29 Å²	29	75.7 Å²	75.7	24%	0.24	40%	0.401	C	S	.	.	H	α-helix	trans	-65.5	-34.4	174.1	0	0	0	0	0	111.7	R72 Q73 L80	R72-A76 WeakPolarHBondContact O-CB 3.33Å; R72-A76 PolarHBondContact O-N 3.26Å; Q73-A76 CarbonylContact O-C 3.56Å; Q73-A76 WeakPolarHBondContact O-CB 3.29Å; Q73-A76 PolarHBondContact O-N 3.22Å; Q73-A76 VanDerWaalsContact O-N 3.09Å; A76-L80 WeakPolarHBondContact O-CG 3.45Å
77	E	47.1	Very low	43.9	Very low	93 Å²	93	79.5 Å²	79.5	44%	0.435	41%	0.411	S	S	.	.	H	α-helix	trans	-81.7	-44.2	-179.6	-71	166.3	176.6	0	0	113	Q73 V75 N79 L80	Q73-E77 HydrophobicContact CG-CG 4.33Å; Q73-E77 WeakPolarHBondContact CG-OE1 3.41Å; Q73-E77 PolarHBondContact NE2-OE1 2.84Å; Q73-E77 WeakPolarHBondContact O-CB 3.37Å; Q73-E77 VanDerWaalsContact O-CG 3.28Å; Q73-E77 WeakPolarHBondContact O-CG 3.31Å; Q73-E77 PolarHBondContact O-N 2.96Å; V75-E77 VanDerWaalsContact C-N 3.28Å; E77-N79 VanDerWaalsContact C-N 3.3Å; E77-N79 PolarHBondContact O-N 2.84Å; E77-L80 WeakPolarHBondContact O-CB 3.31Å; E77-L80 PolarHBondContact O-N 3.06Å
78	E	46.8	Very low	43.3	Very low	67 Å²	67	79.4 Å²	79.4	31%	0.313	41%	0.411	S	S	.	.	H	α-helix	trans	-69.7	-25.9	-179.5	-73.2	-164.9	158.1	0	0	113.3	S74 L80 V81 K136	S74-E78 WeakPolarHBondContact O-CB 3.32Å; S74-E78 WeakPolarHBondContact O-CG 3.5Å; S74-E78 PolarHBondContact O-N 2.8Å; E78-L80 PolarHBondContact O-N 3.33Å; E78-V81 PolarHBondContact O-N 3.16Å; E78-K136 WeakPolarHBondContact OE1-CE 3.39Å; E78-K136 IonicContact OE1-NZ 2.68Å; E78-K136 PolarHBondContact OE1-NZ 3.11Å; E78-K136 WeakPolarHBondContact OE2-CE 3.46Å
79	N	43.8	Very low	42.4	Very low	26 Å²	26	77.9 Å²	77.9	14%	0.139	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-14.9	170.1	-86.4	-66.5	0	0	0	113.6	V75 E77 I179	V75-N79 WeakPolarHBondContact O-CB 3.33Å; V75-N79 PolarHBondContact O-N 3.21Å; V75-N79 PolarHBondContact O-ND2 2.62Å; E77-N79 VanDerWaalsContact C-N 3.3Å; E77-N79 PolarHBondContact O-N 2.84Å; N79-I179 HydrophobicContact CB-CD1 4.49Å
80	L	38.1	Very low	41.6	Very low	72 Å²	72	73.9 Å²	73.9	38%	0.377	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-17	179	-62.7	167.6	0	0	0	113.6	A76 E77 E78 L240	A76-L80 WeakPolarHBondContact O-CG 3.45Å; E77-L80 WeakPolarHBondContact O-CB 3.31Å; E77-L80 PolarHBondContact O-N 3.06Å; E78-L80 PolarHBondContact O-N 3.33Å; L80-L240 HydrophobicContact CD2-CD1 3.35Å
81	V	34.2	Very low	40.8	Very low	112 Å²	112	70.6 Å²	70.6	68%	0.679	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.5	-13.6	-158.9	177.8	0	0	0	0	115.2	E78	E78-V81 PolarHBondContact O-N 3.16Å
82	K	32.7	Very low	39.7	Very low	146 Å²	146	72.2 Å²	72.2	64%	0.635	38%	0.375	S	S	*	.			trans	-136.7	95.2	-175.6	-66.4	-172.8	179.3	-176.1	0	114.6
83	R	40.9	Very low	38.6	Very low	95 Å²	95	70.2 Å²	70.2	36%	0.358	37%	0.373	S	S	.	.			trans	-140.7	154.7	161.4	-75.2	-166.4	176.5	161.6	1.7	113.5	I171	R83-I171 VanDerWaalsContact NH1-CD1 3.32Å
84	P	31.6	Very low	37.8	Very low	67 Å²	67	68.5 Å²	68.5	44%	0.435	37%	0.37	S	S	.	.			trans	-75.8	177.4	-166.3	-14.4	32.3	0	0	0	114.4	L86	P84-L86 VanDerWaalsContact C-N 3.35Å; P84-L86 PolarHBondContact O-N 3.21Å
85	P	32.8	Very low	37.6	Very low	133 Å²	133	69 Å²	69	86%	0.864	37%	0.372	S	S	*	.	S	Bend	trans	-76.5	77.7	-170.7	33.3	-36.6	0	0	0	112.6
86	L	33.1	Very low	37.2	Very low	93 Å²	93	74.4 Å²	74.4	49%	0.487	40%	0.397	S	S	.	.			trans	-128.8	140	-178.4	-70.5	167.8	0	0	0	111.8	P84 I88	P84-L86 VanDerWaalsContact C-N 3.35Å; P84-L86 PolarHBondContact O-N 3.21Å; L86-I88 VanDerWaalsContact C-N 3.27Å; L86-I88 HydrophobicContact CB-CD1 3.64Å; L86-I88 HydrophobicContact CB-CG1 3.68Å; L86-I88 HydrophobicContact CD1-CD1 4.28Å; L86-I88 PolarHBondContact O-N 2.93Å
87	K	35.3	Very low	37.4	Very low	167 Å²	167	75.6 Å²	75.6	73%	0.726	40%	0.395	S	S	*	.			trans	-76.6	75	175.9	-66.4	179.2	-179.8	176.6	0	110
88	I	34.8	Very low	37.8	Very low	26 Å²	26	71.4 Å²	71.4	13%	0.133	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	139.4	-173.6	-61.3	169.7	0	0	0	110.2	L86 L90 Y221	L86-I88 VanDerWaalsContact C-N 3.27Å; L86-I88 HydrophobicContact CB-CD1 3.64Å; L86-I88 HydrophobicContact CB-CG1 3.68Å; L86-I88 HydrophobicContact CD1-CD1 4.28Å; L86-I88 PolarHBondContact O-N 2.93Å; I88-L90 HydrophobicContact CG2-CD1 4.07Å; I88-L90 HydrophobicContact CG2-CG 3.9Å; I88-Y221 HydrophobicContact CG1-CD2 4.27Å; I88-Y221 HydrophobicContact CG1-CE2 4.02Å; I88-Y221 HydrophobicContact CG2-CD2 3.94Å; I88-Y221 HydrophobicContact CG2-CG 4.02Å
89	T	31.1	Very low	38.2	Very low	2 Å²	2	71.9 Å²	71.9	1%	0.012	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	122.3	169.2	-34.3	0	0	0	0	109.6	A222 S225 F229	T89-A222 PolarHBondContact N-O 3.46Å; T89-A222 VanDerWaalsContact N-O 3.13Å; T89-S225 PolarHBondContact OG1-O 2.84Å; T89-F229 HydrophobicContact CG2-CB 3.9Å; T89-F229 HydrophobicContact CG2-CD2 3.63Å; T89-F229 HydrophobicContact CG2-CG 4.19Å
90	L	34.1	Very low	38.6	Very low	13 Å²	13	76.9 Å²	76.9	7%	0.068	41%	0.406	C	S	.	.			trans	-116.1	130.9	-176.2	-81.7	159.1	0	0	0	110.9	I88 I171 V174 L240 C241	I88-L90 HydrophobicContact CG2-CD1 4.07Å; I88-L90 HydrophobicContact CG2-CG 3.9Å; L90-I171 HydrophobicContact CD2-CG2 4.29Å; L90-V174 HydrophobicContact CD1-CG1 4.11Å; L90-L240 HydrophobicContact CB-CD2 3.92Å; L90-L240 HydrophobicContact CD1-CD2 3.5Å; L90-L240 VanDerWaalsContact CD1-CD2 3.5Å; L90-L240 HydrophobicContact CG-CD2 4.34Å; L90-C241 PolarHBondContact O-SG 3.39Å
91	P	32.8	Very low	39.4	Very low	70 Å²	70	75.3 Å²	75.3	46%	0.455	40%	0.398	S	S	.	.			trans	-67.6	143.8	178.7	-18.8	31.8	0	0	0	113.4	G175	P91-G175 CarbonylContact O-C 3.59Å; P91-G175 WeakPolarHBondContact O-CA 3.26Å
92	L	32.2	Very low	40.6	Very low	89 Å²	89	70.6 Å²	70.6	47%	0.466	37%	0.369	S	S	.	.			trans	25.4	98.6	159.6	-78	151.9	0	0	0	118.6	C241	L92-C241 CarbonylContact C-O 3.13Å; L92-C241 WeakPolarHBondContact CA-O 3.4Å
93	G	32.3	Very low	41.6	Very low	18 Å²	18	67.8 Å²	67.8	19%	0.186	36%	0.358	C	S	.	.	B	Isolated β-bridge	trans	-112.3	117.6	171.5	0	0	0	0	0	114.3	C241 C242	G93-C241 PolarHBondContact N-O 3.49Å; G93-C242 WeakPolarHBondContact O-CA 3.47Å
94	T	33.9	Very low	42.4	Very low	76 Å²	76	65 Å²	65	47%	0.466	35%	0.349	S	S	.	.				-118.1	126.9	121.3	45	0	0	0	0	106.2	E96 R177	T94-E96 PolarHBondContact O-N 3.27Å; T94-R177 WeakPolarHBondContact O-CA 3.28Å
95	T	45	Very low	43.6	Very low	47 Å²	47	61.8 Å²	61.8	29%	0.288	33%	0.329	S	S	.	.			trans	-86.3	87.8	179.3	30.9	0	0	0	0	109.6	I179	T95-I179 HydrophobicContact CG2-CD1 3.85Å; T95-I179 HydrophobicContact CG2-CG1 4.43Å
96	E	43.3	Very low	44.8	Very low	122 Å²	122	56.8 Å²	56.8	57%	0.57	30%	0.299	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.4	131.1	178.3	-72.4	-179.5	-175.8	0	0	111.6	T94 S98 R177	T94-E96 PolarHBondContact O-N 3.27Å; E96-S98 PolarHBondContact O-N 3.31Å; E96-R177 PolarHBondContact N-O 3.49Å
97	W	50.1	Low	46	Very low	53 Å²	53	57.8 Å²	57.8	20%	0.201	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	121.1	172.3	-174.7	-82.8	0	0	0	110.4	F67 R72 V75 E102 R180	F67-W97 HydrophobicContact CB-CH2 3.94Å; F67-W97 HydrophobicContact CB-CZ2 3.94Å; F67-W97 HydrophobicContact CD1-CH2 4.25Å; F67-W97 AromaticContact CD2-CH2 3.48Å; F67-W97 HydrophobicContact CD2-CH2 3.48Å; F67-W97 VanDerWaalsContact CD2-CH2 3.48Å; F67-W97 AromaticContact CD2-CZ2 3.87Å; F67-W97 HydrophobicContact CD2-CZ2 3.87Å; F67-W97 HydrophobicContact CE2-CH2 4.03Å; F67-W97 AromaticContact CG-CH2 3.63Å; F67-W97 HydrophobicContact CG-CH2 3.63Å; F67-W97 HydrophobicContact CG-CZ2 4.06Å; F67-W97 HydrophobicContact CG-CZ3 4.4Å; R72-W97 HydrophobicContact CB-CD2 4.05Å; R72-W97 HydrophobicContact CB-CE3 4Å; R72-W97 HydrophobicContact CB-CG 4.34Å; R72-W97 HydrophobicContact CG-CD2 3.65Å; R72-W97 HydrophobicContact CG-CE3 3.97Å; R72-W97 HydrophobicContact CG-CG 4.02Å; R72-W97 HydrophobicContact CG-CH2 4.39Å; R72-W97 HydrophobicContact CG-CZ2 4.1Å; R72-W97 HydrophobicContact CG-CZ3 4.32Å; R72-W97 VanDerWaalsContact NE-NE1 3.19Å; V75-W97 HydrophobicContact CB-CZ3 4.35Å; V75-W97 HydrophobicContact CG1-CZ3 4.09Å; W97-E102 HydrophobicContact CZ2-CG 3.96Å; W97-E102 PolarHBondContact NE1-OE2 2.86Å; W97-R180 HydrophobicContact CH2-CG 4.17Å; W97-R180 HydrophobicContact CZ2-CG 3.92Å
98	S	55.9	Low	47.1	Very low	6 Å²	6	49.9 Å²	49.9	4%	0.042	27%	0.265	C	S	.	.			trans	-101.3	105.5	-172.3	178.5	0	0	0	0	112.3	E96 E100 L101 E102 K178	E96-S98 PolarHBondContact O-N 3.31Å; S98-E100 VanDerWaalsContact C-N 3.32Å; S98-E100 PolarHBondContact O-N 2.81Å; S98-L101 CarbonylContact O-C 3.52Å; S98-L101 PolarHBondContact O-N 3.25Å; S98-L101 VanDerWaalsContact O-N 3.12Å; S98-E102 PolarHBondContact O-N 3.32Å; S98-K178 VanDerWaalsContact CB-CD 3.47Å; S98-K178 WeakPolarHBondContact OG-CD 3.31Å; S98-K178 WeakPolarHBondContact OG-CE 3.39Å; S98-K178 PolarHBondContact OG-NZ 3.01Å
99	T	55	Low	48.1	Very low	77 Å²	77	49.8 Å²	49.8	47%	0.472	27%	0.268	S	S	.	.	H	α-helix	trans	-61	-32.9	-179.1	49.8	0	0	0	0	114.3	L101 E102 E103	T99-L101 VanDerWaalsContact C-N 3.35Å; T99-L101 PolarHBondContact O-N 2.93Å; T99-E102 CarbonylContact O-C 3.51Å; T99-E102 WeakPolarHBondContact O-CA 3.4Å; T99-E102 VanDerWaalsContact O-CB 3.24Å; T99-E102 WeakPolarHBondContact O-CB 3.28Å; T99-E102 PolarHBondContact O-N 2.84Å; T99-E103 PolarHBondContact O-N 2.93Å
100	E	51.7	Low	49.3	Very low	131 Å²	131	55.4 Å²	55.4	61%	0.612	30%	0.302	S	S	*	.	H	α-helix	trans	-64.9	-40.3	175.7	-57.3	162.9	136	0	0	111.6	S98 E102 E103 L104 K178	S98-E100 VanDerWaalsContact C-N 3.32Å; S98-E100 PolarHBondContact O-N 2.81Å; E100-E102 VanDerWaalsContact C-N 3.26Å; E100-E103 PolarHBondContact O-N 2.9Å; E100-L104 PolarHBondContact O-N 2.85Å; E100-L104 VanDerWaalsContact O-N 3.12Å; E100-K178 IonicContact OE2-NZ 3.52Å; E100-K178 PolarHBondContact OE2-NZ 2.8Å
101	L	54	Low	50.4	Low	38 Å²	38	59.6 Å²	59.6	20%	0.199	32%	0.321	C	S	.	.	H	α-helix	trans	-73.5	-23.9	170.5	-62.1	179.2	0	0	0	110.4	S98 T99 E103 A105 K178 R180 I212	S98-L101 CarbonylContact O-C 3.52Å; S98-L101 PolarHBondContact O-N 3.25Å; S98-L101 VanDerWaalsContact O-N 3.12Å; T99-L101 VanDerWaalsContact C-N 3.35Å; T99-L101 PolarHBondContact O-N 2.93Å; L101-E103 VanDerWaalsContact C-N 3.31Å; L101-A105 PolarHBondContact O-N 2.88Å; L101-K178 HydrophobicContact CD1-CB 4.09Å; L101-K178 HydrophobicContact CD1-CD 3.95Å; L101-R180 VanDerWaalsContact O-CZ 3.23Å; L101-R180 PolarHBondContact O-NE 3.26Å; L101-R180 PolarHBondContact O-NH1 2.95Å; L101-I212 HydrophobicContact CB-CD1 4.32Å; L101-I212 HydrophobicContact CD2-CB 4.49Å; L101-I212 HydrophobicContact CD2-CD1 3.86Å; L101-I212 HydrophobicContact CD2-CG2 4.25Å
102	E	59.3	Low	51.3	Low	14 Å²	14	59.4 Å²	59.4	7%	0.065	32%	0.321	C	S	.	.	H	α-helix	trans	-69.4	-22.3	170.1	-150.7	-176.1	-178.2	0	0	113.8	V66 F67 R72 W97 S98 T99 E100 A106 R180	V66-E102 WeakPolarHBondContact CG1-OE1 3.36Å; F67-E102 PolarHBondContact N-OE1 2.87Å; R72-E102 IonicContact CZ-OE2 3.46Å; R72-E102 IonicContact NE-OE2 3.32Å; R72-E102 PolarHBondContact NE-OE2 2.85Å; R72-E102 IonicContact NH2-OE1 2.68Å; R72-E102 IonicContact NH2-OE2 3.8Å; R72-E102 PolarHBondContact NH2-OE2 2.83Å; W97-E102 HydrophobicContact CZ2-CG 3.96Å; W97-E102 PolarHBondContact NE1-OE2 2.86Å; S98-E102 PolarHBondContact O-N 3.32Å; T99-E102 CarbonylContact O-C 3.51Å; T99-E102 WeakPolarHBondContact O-CA 3.4Å; T99-E102 VanDerWaalsContact O-CB 3.24Å; T99-E102 WeakPolarHBondContact O-CB 3.28Å; T99-E102 PolarHBondContact O-N 2.84Å; E100-E102 VanDerWaalsContact C-N 3.26Å; E102-A106 WeakPolarHBondContact O-CB 3.11Å; E102-R180 HydrophobicContact CB-CG 4.49Å; E102-R180 HydrophobicContact CG-CG 4.48Å; E102-R180 VanDerWaalsContact CG-NH2 3.27Å; E102-R180 VanDerWaalsContact O-CZ 3.25Å; E102-R180 PolarHBondContact O-NH1 2.86Å; E102-R180 PolarHBondContact O-NH2 3.28Å; E102-R180 VanDerWaalsContact O-NH2 3.14Å
103	E	55.3	Low	52.2	Low	87 Å²	87	57.4 Å²	57.4	41%	0.407	31%	0.31	S	S	.	.	H	α-helix	trans	-89.6	-42.7	173.5	-70.8	165.5	-176.5	0	0	111	T99 E100 L101 A106 K107 T491	T99-E103 PolarHBondContact O-N 2.93Å; E100-E103 PolarHBondContact O-N 2.9Å; L101-E103 VanDerWaalsContact C-N 3.31Å; E103-A106 WeakPolarHBondContact O-CB 3.29Å; E103-A106 PolarHBondContact O-N 2.91Å; E103-K107 PolarHBondContact O-N 3.24Å; E103-T491 HydrophobicContact CG-CG2 4.26Å; E103-T491 WeakPolarHBondContact OE1-CG2 3.27Å
104	L	57	Low	53.1	Low	35 Å²	35	62.2 Å²	62.2	18%	0.183	33%	0.331	C	S	.	.	H	α-helix	trans	-63.2	-51.9	-176.3	-179.4	53.6	0	0	0	113.7	E100 A106 K107 L108 Y117 I212	E100-L104 PolarHBondContact O-N 2.85Å; E100-L104 VanDerWaalsContact O-N 3.12Å; L104-A106 PolarHBondContact O-N 2.77Å; L104-K107 WeakPolarHBondContact O-CB 3.28Å; L104-K107 PolarHBondContact O-N 2.88Å; L104-L108 HydrophobicContact CD1-CD1 4.08Å; L104-L108 HydrophobicContact CD1-CG 4.25Å; L104-L108 HydrophobicContact CG-CD1 4.14Å; L104-L108 WeakPolarHBondContact O-CG 3.32Å; L104-L108 PolarHBondContact O-N 3.15Å; L104-Y117 HydrophobicContact CD1-CE1 3.85Å; L104-Y117 HydrophobicContact CD2-CE1 4.08Å; L104-Y117 HydrophobicContact CG-CE1 4.39Å; L104-I212 HydrophobicContact CB-CD1 4.01Å; L104-I212 HydrophobicContact CD2-CD1 3.91Å; L104-I212 HydrophobicContact CG-CD1 3.87Å
105	A	57.2	Low	53.7	Low	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-67.7	-22.6	178.3	0	0	0	0	0	113.6	L101 A109 R180 L210 I212	L101-A105 PolarHBondContact O-N 2.88Å; A105-A109 VanDerWaalsContact O-CB 3.25Å; A105-A109 WeakPolarHBondContact O-CB 3.41Å; A105-A109 PolarHBondContact O-N 2.86Å; A105-R180 VanDerWaalsContact C-NH1 3.3Å; A105-R180 VanDerWaalsContact CB-CZ 3.43Å; A105-L210 HydrophobicContact CB-CB 4Å; A105-L210 HydrophobicContact CB-CD2 3.77Å; A105-L210 HydrophobicContact CB-CG 4.45Å; A105-L210 WeakPolarHBondContact CB-O 3.3Å; A105-I212 HydrophobicContact CB-CD1 3.93Å; A105-I212 HydrophobicContact CB-CG1 4.36Å
106	A	56.9	Low	53.7	Low	28 Å²	28	68 Å²	68	23%	0.231	36%	0.358	C	S	.	.	H	α-helix	trans	-71.9	-42.9	175.2	0	0	0	0	0	110.4	E102 E103 L104 V110 Q182	E102-A106 WeakPolarHBondContact O-CB 3.11Å; E103-A106 WeakPolarHBondContact O-CB 3.29Å; E103-A106 PolarHBondContact O-N 2.91Å; L104-A106 PolarHBondContact O-N 2.77Å; A106-V110 WeakPolarHBondContact O-CB 3.18Å; A106-V110 VanDerWaalsContact O-CG2 3.26Å; A106-V110 WeakPolarHBondContact O-CG2 3.15Å; A106-V110 PolarHBondContact O-N 3Å; A106-V110 VanDerWaalsContact O-N 3.07Å; A106-Q182 VanDerWaalsContact CB-OE1 3.26Å
107	K	59.9	Low	53.9	Low	114 Å²	114	66 Å²	66	50%	0.496	35%	0.347	S	S	.	.	H	α-helix	trans	-60	-49	171.2	-179.7	-178	174.2	-175.7	0	111.7	E103 L104 A109 V110 E111	E103-K107 PolarHBondContact O-N 3.24Å; L104-K107 WeakPolarHBondContact O-CB 3.28Å; L104-K107 PolarHBondContact O-N 2.88Å; K107-A109 PolarHBondContact O-N 2.86Å; K107-V110 PolarHBondContact O-N 2.87Å; K107-E111 WeakPolarHBondContact CE-OE1 2.97Å; K107-E111 HydrophobicContact CG-CG 4.5Å; K107-E111 WeakPolarHBondContact CG-OE1 3.1Å; K107-E111 IonicContact NZ-OE1 3.7Å; K107-E111 WeakPolarHBondContact O-CB 3.27Å; K107-E111 WeakPolarHBondContact O-CG 3.23Å; K107-E111 PolarHBondContact O-N 3.46Å
108	L	58	Low	53.7	Low	1 Å²	1	71.4 Å²	71.4	1%	0.005	37%	0.374	C	S	.	.	H	α-helix	trans	-66.1	-36.7	-178.8	-65.8	171	0	0	0	112.8	L104 E111 C112 I113 Y117 L210	L104-L108 HydrophobicContact CD1-CD1 4.08Å; L104-L108 HydrophobicContact CD1-CG 4.25Å; L104-L108 HydrophobicContact CG-CD1 4.14Å; L104-L108 WeakPolarHBondContact O-CG 3.32Å; L104-L108 PolarHBondContact O-N 3.15Å; L108-E111 PolarHBondContact O-N 3.22Å; L108-C112 PolarHBondContact O-N 3.43Å; L108-I113 HydrophobicContact CD2-CD1 3.9Å; L108-Y117 HydrophobicContact CD1-CD1 3.71Å; L108-Y117 HydrophobicContact CD1-CD2 4.41Å; L108-Y117 HydrophobicContact CD1-CE1 4.23Å; L108-Y117 HydrophobicContact CD1-CG 3.8Å; L108-Y117 HydrophobicContact CD2-CD1 4.33Å; L108-Y117 HydrophobicContact CD2-CD2 3.56Å; L108-Y117 HydrophobicContact CD2-CE2 3.92Å; L108-Y117 HydrophobicContact CD2-CG 3.78Å; L108-Y117 HydrophobicContact CG-CG 4.47Å; L108-L210 HydrophobicContact CB-CD1 3.44Å; L108-L210 VanDerWaalsContact CB-CD1 3.44Å; L108-L210 HydrophobicContact CB-CD2 4.01Å; L108-L210 HydrophobicContact CB-CG 4.38Å; L108-L210 HydrophobicContact CD1-CD2 3.73Å
109	A	56	Low	53.3	Low	24 Å²	24	72.7 Å²	72.7	20%	0.198	38%	0.383	C	S	.	.	H	α-helix	trans	-66.2	-36.9	174	0	0	0	0	0	112.4	A105 K107 C112	A105-A109 VanDerWaalsContact O-CB 3.25Å; A105-A109 WeakPolarHBondContact O-CB 3.41Å; A105-A109 PolarHBondContact O-N 2.86Å; K107-A109 PolarHBondContact O-N 2.86Å; A109-C112 PolarHBondContact O-N 3.43Å
110	V	55.7	Low	52.6	Low	121 Å²	121	78.4 Å²	78.4	73%	0.733	40%	0.404	S	S	*	.	H	α-helix	trans	-70.4	-36.4	174	167.7	0	0	0	0	112.2	A106 K107 C112	A106-V110 WeakPolarHBondContact O-CB 3.18Å; A106-V110 VanDerWaalsContact O-CG2 3.26Å; A106-V110 WeakPolarHBondContact O-CG2 3.15Å; A106-V110 PolarHBondContact O-N 3Å; A106-V110 VanDerWaalsContact O-N 3.07Å; K107-V110 PolarHBondContact O-N 2.87Å; V110-C112 PolarHBondContact O-N 2.84Å
111	E	56.4	Low	52	Low	101 Å²	101	79.2 Å²	79.2	47%	0.472	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-2.3	178.4	-72.5	175.2	-179.5	0	0	113.2	K107 L108 I113	K107-E111 WeakPolarHBondContact CE-OE1 2.97Å; K107-E111 HydrophobicContact CG-CG 4.5Å; K107-E111 WeakPolarHBondContact CG-OE1 3.1Å; K107-E111 IonicContact NZ-OE1 3.7Å; K107-E111 WeakPolarHBondContact O-CB 3.27Å; K107-E111 WeakPolarHBondContact O-CG 3.23Å; K107-E111 PolarHBondContact O-N 3.46Å; L108-E111 PolarHBondContact O-N 3.22Å; E111-I113 HydrophobicContact CB-CD1 3.86Å; E111-I113 HydrophobicContact CB-CG1 3.93Å; E111-I113 PolarHBondContact O-N 2.79Å
112	C	52	Low	51.4	Low	65 Å²	65	78 Å²	78	44%	0.439	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.2	20.9	178.1	-74.6	0	0	0	0	115.2	L108 A109 V110 D114 R208	L108-C112 PolarHBondContact O-N 3.43Å; A109-C112 PolarHBondContact O-N 3.43Å; V110-C112 PolarHBondContact O-N 2.84Å; C112-D114 PolarHBondContact O-N 2.76Å; C112-R208 PolarHBondContact O-NH1 3.04Å
113	I	52.3	Low	50.7	Low	47 Å²	47	78 Å²	78	24%	0.241	41%	0.412	C	S	.	.			trans	-64.5	134.6	177.5	-60.1	170.4	0	0	0	109.2	L108 E111 E115 I126 R208	L108-I113 HydrophobicContact CD2-CD1 3.9Å; E111-I113 HydrophobicContact CB-CD1 3.86Å; E111-I113 HydrophobicContact CB-CG1 3.93Å; E111-I113 PolarHBondContact O-N 2.79Å; I113-E115 HydrophobicContact CG2-CB 4.16Å; I113-E115 VanDerWaalsContact CG2-O 3.26Å; I113-E115 WeakPolarHBondContact CG2-O 3.36Å; I113-I126 HydrophobicContact CB-CD1 4.35Å; I113-I126 HydrophobicContact CG2-CD1 4.01Å; I113-I126 WeakPolarHBondContact O-CD1 3.31Å; I113-R208 PolarHBondContact O-NH1 3.13Å
114	D	49.8	Very low	50.1	Low	119 Å²	119	74 Å²	74	64%	0.636	39%	0.393	S	S	*	.			trans	-113.8	-11.1	171.5	52	-3.3	0	0	0	112.4	C112	C112-D114 PolarHBondContact O-N 2.76Å
115	E	46.6	Very low	49.6	Very low	143 Å²	143	72.9 Å²	72.9	67%	0.668	39%	0.389	S	S	*	.	S	Bend	trans	-76.6	142	170.5	-62.3	-173.1	171.5	0	0	112.7	I113 Y117 I126	I113-E115 HydrophobicContact CG2-CB 4.16Å; I113-E115 VanDerWaalsContact CG2-O 3.26Å; I113-E115 WeakPolarHBondContact CG2-O 3.36Å; E115-Y117 PolarHBondContact O-N 2.84Å; E115-I126 VanDerWaalsContact O-CD1 3.23Å; E115-I126 WeakPolarHBondContact O-CD1 3.5Å
116	P	46.1	Very low	49	Very low	101 Å²	101	74.1 Å²	74.1	66%	0.656	40%	0.396	S	S	*	.			trans	-64	125.1	178	25.5	-34	0	0	0	112.4	A124	P116-A124 WeakPolarHBondContact CA-O 3.25Å; P116-A124 WeakPolarHBondContact CB-O 3.16Å
117	Y	46.5	Very low	48.5	Very low	82 Å²	82	74.9 Å²	74.9	32%	0.322	39%	0.393	S	S	.	.			trans	-90.4	115.9	-174.1	174.4	-94.3	0	0	0	112.4	L104 L108 E115 A123 A124	L104-Y117 HydrophobicContact CD1-CE1 3.85Å; L104-Y117 HydrophobicContact CD2-CE1 4.08Å; L104-Y117 HydrophobicContact CG-CE1 4.39Å; L108-Y117 HydrophobicContact CD1-CD1 3.71Å; L108-Y117 HydrophobicContact CD1-CD2 4.41Å; L108-Y117 HydrophobicContact CD1-CE1 4.23Å; L108-Y117 HydrophobicContact CD1-CG 3.8Å; L108-Y117 HydrophobicContact CD2-CD1 4.33Å; L108-Y117 HydrophobicContact CD2-CD2 3.56Å; L108-Y117 HydrophobicContact CD2-CE2 3.92Å; L108-Y117 HydrophobicContact CD2-CG 3.78Å; L108-Y117 HydrophobicContact CG-CG 4.47Å; E115-Y117 PolarHBondContact O-N 2.84Å; Y117-A123 CarbonylContact O-C 3.58Å; Y117-A123 WeakPolarHBondContact O-CA 3.33Å; Y117-A124 PolarHBondContact O-N 2.89Å
118	E	47	Very low	47.8	Very low	166 Å²	166	73.1 Å²	73.1	78%	0.776	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.7	120.8	174.1	-68.9	-168.6	159	0	0	112.4	A123	E118-A123 HydrophobicContact CG-CB 4.26Å
119	S	47	Very low	47.3	Very low	33 Å²	33	73.2 Å²	73.2	23%	0.231	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	171.7	172.6	79.4	0	0	0	0	111.5	D121 G122	S119-D121 PolarHBondContact O-N 2.84Å; S119-D121 PolarHBondContact OG-N 2.91Å; S119-G122 WeakPolarHBondContact CA-O 3.45Å; S119-G122 WeakPolarHBondContact CB-O 3.35Å; S119-G122 PolarHBondContact N-O 3.09Å; S119-G122 PolarHBondContact O-N 2.83Å; S119-G122 PolarHBondContact OG-N 2.82Å; S119-G122 VanDerWaalsContact OG-N 3.14Å; S119-G122 PolarHBondContact OG-O 3.05Å
120	Q	40.1	Very low	46.8	Very low	197 Å²	197	80.4 Å²	80.4	92%	0.921	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-16.3	174.2	-69.5	-175.2	7.6	0	0	113.2
121	D	39.1	Very low	46.2	Very low	148 Å²	148	78.6 Å²	78.6	79%	0.791	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	-3.2	-176.9	-55.3	-64.4	0	0	0	113.1	S119	S119-D121 PolarHBondContact O-N 2.84Å; S119-D121 PolarHBondContact OG-N 2.91Å
122	G	41.2	Very low	45.6	Very low	13 Å²	13	80.3 Å²	80.3	13%	0.134	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	148.4	178.1	-179.7	0	0	0	0	0	114.5	S119 F213	S119-G122 WeakPolarHBondContact CA-O 3.45Å; S119-G122 WeakPolarHBondContact CB-O 3.35Å; S119-G122 PolarHBondContact N-O 3.09Å; S119-G122 PolarHBondContact O-N 2.83Å; S119-G122 PolarHBondContact OG-N 2.82Å; S119-G122 VanDerWaalsContact OG-N 3.14Å; S119-G122 PolarHBondContact OG-O 3.05Å; G122-F213 CarbonylContact C-O 3.6Å; G122-F213 WeakPolarHBondContact CA-O 3.5Å
123	A	44.2	Very low	45.4	Very low	13 Å²	13	79 Å²	79	11%	0.107	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	123.7	176.9	0	0	0	0	0	110.8	Y117 E118 F213 K215	Y117-A123 CarbonylContact O-C 3.58Å; Y117-A123 WeakPolarHBondContact O-CA 3.33Å; E118-A123 HydrophobicContact CG-CB 4.26Å; A123-F213 CarbonylContact C-O 3.52Å; A123-F213 PolarHBondContact N-O 2.83Å; A123-F213 CarbonylContact O-C 3.53Å; A123-F213 WeakPolarHBondContact O-CA 3.45Å; A123-F213 WeakPolarHBondContact O-CB 3.31Å; A123-F213 PolarHBondContact O-N 2.82Å; A123-K215 HydrophobicContact CB-CB 4.46Å
124	A	44.1	Very low	45.1	Very low	2 Å²	2	78.1 Å²	78.1	2%	0.017	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	144.1	179.7	0	0	0	0	0	112.7	P116 Y117 L210 E211 I212	P116-A124 WeakPolarHBondContact CA-O 3.25Å; P116-A124 WeakPolarHBondContact CB-O 3.16Å; Y117-A124 PolarHBondContact O-N 2.89Å; A124-L210 HydrophobicContact CB-CD2 4.29Å; A124-E211 WeakPolarHBondContact CA-O 3.42Å; A124-E211 WeakPolarHBondContact CB-O 3.45Å; A124-I212 HydrophobicContact CB-CB 4.37Å; A124-I212 HydrophobicContact CB-CG1 4.11Å; A124-I212 HydrophobicContact CB-CG2 4.37Å
125	A	45.1	Very low	45.1	Very low	12 Å²	12	73.7 Å²	73.7	10%	0.099	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	129.4	169	0	0	0	0	0	109.1	E211 F213	A125-E211 PolarHBondContact N-O 3.42Å; A125-E211 PolarHBondContact O-N 2.78Å; A125-F213 HydrophobicContact CB-CD2 3.62Å; A125-F213 HydrophobicContact CB-CE2 3.96Å
126	I	44.9	Very low	45.4	Very low	27 Å²	27	72.5 Å²	72.5	14%	0.138	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	118.6	-175	-54.3	-170	0	0	0	107.8	I113 E115 L210	I113-I126 HydrophobicContact CB-CD1 4.35Å; I113-I126 HydrophobicContact CG2-CD1 4.01Å; I113-I126 WeakPolarHBondContact O-CD1 3.31Å; E115-I126 VanDerWaalsContact O-CD1 3.23Å; E115-I126 WeakPolarHBondContact O-CD1 3.5Å; I126-L210 HydrophobicContact CD1-CD1 4.04Å; I126-L210 HydrophobicContact CG1-CD1 4.04Å; I126-L210 HydrophobicContact CG1-CG 4.12Å; I126-L210 HydrophobicContact CG2-CD1 4.19Å; I126-L210 HydrophobicContact CG2-CG 4.47Å
127	Y	47.5	Very low	45.9	Very low	43 Å²	43	72 Å²	72	17%	0.169	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	121.9	-178.7	-156.9	-92.9	0	0	0	110.9	Q141 M145 L209	Y127-Q141 VanDerWaalsContact CE1-OE1 3.23Å; Y127-Q141 PolarHBondContact OH-OE1 3.39Å; Y127-M145 HydrophobicContact CD2-CE 4.32Å; Y127-M145 HydrophobicContact CE2-CE 3.39Å; Y127-M145 HydrophobicContact CE2-SD 4.2Å; Y127-L209 CarbonylContact C-O 3.55Å; Y127-L209 WeakPolarHBondContact CA-O 3.41Å; Y127-L209 PolarHBondContact N-O 3.37Å; Y127-L209 CarbonylContact O-C 3.45Å; Y127-L209 PolarHBondContact O-N 2.86Å
128	V	44.4	Very low	46.4	Very low	78 Å²	78	68.4 Å²	68.4	47%	0.473	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	96.1	179.1	-174.7	0	0	0	0	108.1
129	A	47.4	Very low	46.8	Very low	2 Å²	2	61.4 Å²	61.4	2%	0.017	31%	0.314	C	S	.	.			trans	-68.6	141.2	172.5	0	0	0	0	0	109.6	D131 Q133 V207	A129-D131 VanDerWaalsContact C-N 3.34Å; A129-Q133 HydrophobicContact CB-CB 4.48Å; A129-V207 PolarHBondContact N-O 3.04Å
130	K	44.8	Very low	47.5	Very low	176 Å²	176	62.6 Å²	62.6	77%	0.765	33%	0.326	S	S	*	.	S	Bend	trans	-77.3	-20.5	179.7	-77.3	-175.3	176.4	176.8	0	113.7
131	D	43.8	Very low	48.7	Very low	82 Å²	82	55.5 Å²	55.5	44%	0.439	29%	0.293	S	S	.	.	S	Bend	trans	-136.8	177.1	-174.3	-61.2	-63.1	0	0	0	111.9	A129 Q133	A129-D131 VanDerWaalsContact C-N 3.34Å; D131-Q133 HydrophobicContact CB-CG 4.24Å; D131-Q133 PolarHBondContact O-N 3.39Å
132	K	43.8	Very low	49.8	Very low	137 Å²	137	49.3 Å²	49.3	60%	0.596	26%	0.26	S	S	*	.			trans	-64.5	48.2	171	-100.4	167.4	173.6	158.9	0	114.1	G134 D205	K132-G134 PolarHBondContact O-N 3.37Å; K132-D205 HydrophobicContact CD-CB 3.82Å; K132-D205 WeakPolarHBondContact CE-OD1 3.18Å; K132-D205 VanDerWaalsContact CE-OD2 3.29Å; K132-D205 WeakPolarHBondContact CE-OD2 3.23Å; K132-D205 HydrophobicContact CG-CB 3.84Å; K132-D205 IonicContact NZ-OD1 2.75Å; K132-D205 PolarHBondContact NZ-OD1 3.33Å; K132-D205 IonicContact NZ-OD2 3.86Å; K132-D205 PolarHBondContact NZ-OD2 3.02Å
133	Q	47.6	Very low	51	Low	37 Å²	37	50.8 Å²	50.8	17%	0.173	27%	0.268	C	S	.	.			trans	-73.4	120.4	-179.7	-77.7	-170.8	-4.4	0	0	110.2	A129 D131 E137	A129-Q133 HydrophobicContact CB-CB 4.48Å; D131-Q133 HydrophobicContact CB-CG 4.24Å; D131-Q133 PolarHBondContact O-N 3.39Å; Q133-E137 HydrophobicContact CB-CB 3.57Å; Q133-E137 HydrophobicContact CB-CG 4.33Å; Q133-E137 HydrophobicContact CG-CB 3.5Å; Q133-E137 HydrophobicContact CG-CG 3.94Å
134	G	45.2	Very low	52.2	Low	29 Å²	29	55.1 Å²	55.1	30%	0.299	29%	0.286	S	S	.	.			trans	-71.7	175.8	171.1	0	0	0	0	0	110.5	K132 K136 E137 V138	K132-G134 PolarHBondContact O-N 3.37Å; G134-K136 PolarHBondContact O-N 2.86Å; G134-E137 WeakPolarHBondContact CA-OE2 3.48Å; G134-E137 PolarHBondContact N-OE2 3.15Å; G134-E137 PolarHBondContact O-N 3.38Å; G134-V138 WeakPolarHBondContact O-CG2 3.38Å; G134-V138 PolarHBondContact O-N 2.79Å
135	V	49.8	Very low	53.5	Low	27 Å²	27	55.4 Å²	55.4	16%	0.164	29%	0.287	C	S	.	.	H	α-helix	trans	-51.6	-32.3	177.6	175.8	0	0	0	0	111.8	V75 V138 I139 L181	V75-V135 HydrophobicContact CG2-CG1 4.28Å; V75-V135 HydrophobicContact CG2-CG2 4.01Å; V135-V138 PolarHBondContact O-N 3.35Å; V135-I139 HydrophobicContact CG1-CD1 3.79Å; V135-I139 HydrophobicContact CG1-CG1 4.46Å; V135-I139 WeakPolarHBondContact O-CB 3.42Å; V135-I139 VanDerWaalsContact O-CG1 3.27Å; V135-I139 WeakPolarHBondContact O-CG1 3.19Å; V135-I139 PolarHBondContact O-N 2.89Å; V135-L181 HydrophobicContact CB-CD1 4.31Å; V135-L181 HydrophobicContact CG1-CD1 3.62Å; V135-L181 HydrophobicContact CG2-CD1 3.89Å
136	K	53.9	Low	54.9	Low	118 Å²	118	56 Å²	56	51%	0.513	29%	0.292	S	S	.	.	H	α-helix	trans	-63.8	-47.1	176.6	-71.9	-179.4	177.2	169.8	0	113.9	E78 G134 V138 I139 A140	E78-K136 WeakPolarHBondContact OE1-CE 3.39Å; E78-K136 IonicContact OE1-NZ 2.68Å; E78-K136 PolarHBondContact OE1-NZ 3.11Å; E78-K136 WeakPolarHBondContact OE2-CE 3.46Å; G134-K136 PolarHBondContact O-N 2.86Å; K136-V138 VanDerWaalsContact C-N 3.34Å; K136-I139 PolarHBondContact O-N 2.89Å; K136-A140 WeakPolarHBondContact O-CB 3.47Å; K136-A140 PolarHBondContact O-N 2.81Å
137	E	56.5	Low	56.5	Low	90 Å²	90	61.4 Å²	61.4	42%	0.421	32%	0.315	S	S	.	.	H	α-helix	trans	-70.7	-31.8	178.9	-70.4	82.9	-163.9	0	0	112.2	Q133 G134 A140 Q141	Q133-E137 HydrophobicContact CB-CB 3.57Å; Q133-E137 HydrophobicContact CB-CG 4.33Å; Q133-E137 HydrophobicContact CG-CB 3.5Å; Q133-E137 HydrophobicContact CG-CG 3.94Å; G134-E137 WeakPolarHBondContact CA-OE2 3.48Å; G134-E137 PolarHBondContact N-OE2 3.15Å; G134-E137 PolarHBondContact O-N 3.38Å; E137-A140 WeakPolarHBondContact O-CB 3.48Å; E137-A140 PolarHBondContact O-N 3.31Å; E137-Q141 PolarHBondContact O-N 3Å
138	V	56.2	Low	58	Low	6 Å²	6	62.3 Å²	62.3	4%	0.036	32%	0.32	C	S	.	.	H	α-helix	trans	-64.6	-43.8	173.6	-179.4	0	0	0	0	110.8	G134 V135 K136 A140 Q141 L142 L209	G134-V138 WeakPolarHBondContact O-CG2 3.38Å; G134-V138 PolarHBondContact O-N 2.79Å; V135-V138 PolarHBondContact O-N 3.35Å; K136-V138 VanDerWaalsContact C-N 3.34Å; V138-A140 VanDerWaalsContact C-N 3.31Å; V138-A140 PolarHBondContact O-N 2.91Å; V138-Q141 PolarHBondContact O-N 3.3Å; V138-L142 PolarHBondContact O-N 3.39Å; V138-L142 VanDerWaalsContact O-N 3.14Å; V138-L209 HydrophobicContact CB-CD1 4.39Å; V138-L209 HydrophobicContact CG1-CD1 4.2Å; V138-L209 HydrophobicContact CG2-CD1 3.35Å
139	I	56.2	Low	59.8	Low	20 Å²	20	59.4 Å²	59.4	10%	0.103	30%	0.3	C	S	.	.	H	α-helix	trans	-65.3	-34.6	172.7	-69	169.2	0	0	0	111.3	V135 K136 L142	V135-I139 HydrophobicContact CG1-CD1 3.79Å; V135-I139 HydrophobicContact CG1-CG1 4.46Å; V135-I139 WeakPolarHBondContact O-CB 3.42Å; V135-I139 VanDerWaalsContact O-CG1 3.27Å; V135-I139 WeakPolarHBondContact O-CG1 3.19Å; V135-I139 PolarHBondContact O-N 2.89Å; K136-I139 PolarHBondContact O-N 2.89Å; I139-L142 PolarHBondContact O-N 3.43Å
140	A	62.5	Low	61.5	Low	58 Å²	58	62.8 Å²	62.8	48%	0.479	32%	0.318	S	S	.	.	H	α-helix	trans	-65.7	-41.4	173.7	0	0	0	0	0	111.7	K136 E137 V138 L142 S143 E144	K136-A140 WeakPolarHBondContact O-CB 3.47Å; K136-A140 PolarHBondContact O-N 2.81Å; E137-A140 WeakPolarHBondContact O-CB 3.48Å; E137-A140 PolarHBondContact O-N 3.31Å; V138-A140 VanDerWaalsContact C-N 3.31Å; V138-A140 PolarHBondContact O-N 2.91Å; A140-L142 VanDerWaalsContact C-N 3.34Å; A140-L142 PolarHBondContact O-N 3.28Å; A140-S143 VanDerWaalsContact O-CB 3.29Å; A140-S143 WeakPolarHBondContact O-CB 3.45Å; A140-S143 PolarHBondContact O-N 3.04Å; A140-E144 PolarHBondContact O-N 3.33Å
141	Q	63.8	Low	63.1	Low	48 Å²	48	55.9 Å²	55.9	22%	0.224	29%	0.287	C	S	.	.	H	α-helix	trans	-62.3	-38.2	175.4	-77.8	173.9	-22.7	0	0	112.6	Y127 E137 V138 S143 E144 M145	Y127-Q141 VanDerWaalsContact CE1-OE1 3.23Å; Y127-Q141 PolarHBondContact OH-OE1 3.39Å; E137-Q141 PolarHBondContact O-N 3Å; V138-Q141 PolarHBondContact O-N 3.3Å; Q141-S143 PolarHBondContact O-N 3.49Å; Q141-S143 VanDerWaalsContact O-N 3.13Å; Q141-E144 PolarHBondContact O-N 2.82Å; Q141-M145 HydrophobicContact CB-CE 4.01Å; Q141-M145 WeakPolarHBondContact O-CG 3.23Å; Q141-M145 PolarHBondContact O-N 2.85Å
142	L	62.2	Low	64.5	Low	18 Å²	18	58.8 Å²	58.8	9%	0.094	30%	0.303	C	S	.	.	H	α-helix	trans	-56.5	-28.1	172.4	-73.9	172.7	0	0	0	113	V138 I139 A140 M145 A146 A170	V138-L142 PolarHBondContact O-N 3.39Å; V138-L142 VanDerWaalsContact O-N 3.14Å; I139-L142 PolarHBondContact O-N 3.43Å; A140-L142 VanDerWaalsContact C-N 3.34Å; A140-L142 PolarHBondContact O-N 3.28Å; L142-M145 HydrophobicContact CD2-CE 3.78Å; L142-M145 HydrophobicContact CD2-SD 4.12Å; L142-M145 HydrophobicContact CG-CE 4.17Å; L142-A146 PolarHBondContact O-N 2.95Å; L142-A146 VanDerWaalsContact O-N 3.12Å; L142-A170 HydrophobicContact CD1-CB 4.24Å; L142-A170 HydrophobicContact CD2-CB 3.47Å; L142-A170 VanDerWaalsContact CD2-CB 3.47Å
143	S	67.2	Low	66.1	Low	44 Å²	44	55.8 Å²	55.8	31%	0.308	29%	0.293	S	S	.	.	H	α-helix	trans	-76.2	-25.3	175	-55.6	0	0	0	0	113.4	A140 Q141	A140-S143 VanDerWaalsContact O-CB 3.29Å; A140-S143 WeakPolarHBondContact O-CB 3.45Å; A140-S143 PolarHBondContact O-N 3.04Å; Q141-S143 PolarHBondContact O-N 3.49Å; Q141-S143 VanDerWaalsContact O-N 3.13Å
144	E	69.9	Low	67.6	Low	104 Å²	104	56.2 Å²	56.2	49%	0.486	30%	0.297	S	S	.	.	H	α-helix	trans	-78.8	-40.5	169.5	-70.9	-58.3	144.4	0	0	111.5	A140 Q141 A146 K147	A140-E144 PolarHBondContact O-N 3.33Å; Q141-E144 PolarHBondContact O-N 2.82Å; E144-A146 PolarHBondContact O-N 3.02Å; E144-K147 WeakPolarHBondContact O-CB 3.13Å; E144-K147 PolarHBondContact O-N 3.26Å; E144-K147 VanDerWaalsContact O-N 3.07Å; E144-K147 WeakPolarHBondContact OE1-CE 3.04Å; E144-K147 IonicContact OE1-NZ 3.06Å; E144-K147 PolarHBondContact OE1-NZ 3.18Å; E144-K147 WeakPolarHBondContact OE2-CD 3.05Å; E144-K147 VanDerWaalsContact OE2-CE 3.26Å; E144-K147 WeakPolarHBondContact OE2-CE 3.25Å; E144-K147 IonicContact OE2-NZ 3.29Å; E144-K147 PolarHBondContact OE2-NZ 2.84Å
145	M	71.7	Confident	69.2	Low	7 Å²	7	60.5 Å²	60.5	3%	0.034	31%	0.309	C	S	.	.	H	α-helix	trans	-59.5	-31.7	174.3	-55.7	-172.8	-130.8	0	0	111.9	Y127 Q141 L142 K147 K148 V163 N166	Y127-M145 HydrophobicContact CD2-CE 4.32Å; Y127-M145 HydrophobicContact CE2-CE 3.39Å; Y127-M145 HydrophobicContact CE2-SD 4.2Å; Q141-M145 HydrophobicContact CB-CE 4.01Å; Q141-M145 WeakPolarHBondContact O-CG 3.23Å; Q141-M145 PolarHBondContact O-N 2.85Å; L142-M145 HydrophobicContact CD2-CE 3.78Å; L142-M145 HydrophobicContact CD2-SD 4.12Å; L142-M145 HydrophobicContact CG-CE 4.17Å; M145-K147 VanDerWaalsContact C-N 3.27Å; M145-K147 PolarHBondContact O-N 3.09Å; M145-K148 PolarHBondContact O-N 3.37Å; M145-V163 HydrophobicContact CB-CG1 4.03Å; M145-V163 HydrophobicContact CG-CG1 3.58Å; M145-V163 HydrophobicContact SD-CG1 4.32Å; M145-N166 HydrophobicContact SD-CB 4.03Å
146	A	73.1	Confident	70.6	Confident	25 Å²	25	60.7 Å²	60.7	21%	0.207	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-59.5	-32.6	175.3	0	0	0	0	0	113.8	L142 E144 K148 Y149 Y167	L142-A146 PolarHBondContact O-N 2.95Å; L142-A146 VanDerWaalsContact O-N 3.12Å; E144-A146 PolarHBondContact O-N 3.02Å; A146-K148 PolarHBondContact O-N 2.87Å; A146-Y149 PolarHBondContact O-N 2.93Å; A146-Y167 HydrophobicContact CB-CD2 3.69Å; A146-Y167 HydrophobicContact CB-CE2 3.26Å; A146-Y167 HydrophobicContact CB-CG 4.49Å
147	K	78.3	Confident	71.6	Confident	141 Å²	141	60.5 Å²	60.5	61%	0.613	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-68.6	-23.6	-178.4	-60.7	-178.5	-170.2	163.2	0	112.8	E144 M145	E144-K147 WeakPolarHBondContact O-CB 3.13Å; E144-K147 PolarHBondContact O-N 3.26Å; E144-K147 VanDerWaalsContact O-N 3.07Å; E144-K147 WeakPolarHBondContact OE1-CE 3.04Å; E144-K147 IonicContact OE1-NZ 3.06Å; E144-K147 PolarHBondContact OE1-NZ 3.18Å; E144-K147 WeakPolarHBondContact OE2-CD 3.05Å; E144-K147 VanDerWaalsContact OE2-CE 3.26Å; E144-K147 WeakPolarHBondContact OE2-CE 3.25Å; E144-K147 IonicContact OE2-NZ 3.29Å; E144-K147 PolarHBondContact OE2-NZ 2.84Å; M145-K147 VanDerWaalsContact C-N 3.27Å; M145-K147 PolarHBondContact O-N 3.09Å
148	K	79.5	Confident	71.9	Confident	62 Å²	62	65 Å²	65	27%	0.27	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-93.2	5.6	-176.2	-48.9	-159.8	-179.7	-168.3	0	113.5	M145 A146 E157 D160 C164	M145-K148 PolarHBondContact O-N 3.37Å; A146-K148 PolarHBondContact O-N 2.87Å; K148-E157 PolarHBondContact O-N 3.02Å; K148-D160 HydrophobicContact CB-CB 4.41Å; K148-D160 HydrophobicContact CD-CB 3.41Å; K148-D160 VanDerWaalsContact CD-CB 3.41Å; K148-D160 WeakPolarHBondContact CD-OD1 3.47Å; K148-D160 WeakPolarHBondContact CD-OD2 3.46Å; K148-D160 IonicContact NZ-OD1 2.76Å; K148-D160 PolarHBondContact NZ-OD1 3.32Å; K148-D160 IonicContact NZ-OD2 2.73Å; K148-D160 PolarHBondContact NZ-OD2 2.77Å; K148-C164 HydrophobicContact CB-CB 4.36Å; K148-C164 PolarHBondContact O-SG 3.03Å
149	Y	82	Confident	72.1	Confident	17 Å²	17	72.4 Å²	72.4	7%	0.067	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	117.9	175.9	173.9	-108.6	0	0	0	110.6	A146 Y151 N154 C164 Y167 K168 P220	A146-Y149 PolarHBondContact O-N 2.93Å; Y149-Y151 HydrophobicContact CE1-CD2 4.02Å; Y149-Y151 HydrophobicContact CE1-CG 4.42Å; Y149-N154 PolarHBondContact OH-OD1 2.89Å; Y149-C164 VanDerWaalsContact CB-SG 3.6Å; Y149-Y167 HydrophobicContact CD1-CD1 4.04Å; Y149-Y167 AromaticContact CD1-CE1 3.52Å; Y149-Y167 HydrophobicContact CD1-CE1 3.52Å; Y149-Y167 HydrophobicContact CE1-CE1 4.32Å; Y149-Y167 AromaticContact CG-CD1 3.99Å; Y149-Y167 HydrophobicContact CG-CD1 3.99Å; Y149-Y167 AromaticContact CG-CE1 3.96Å; Y149-Y167 HydrophobicContact CG-CE1 3.96Å; Y149-K168 HydrophobicContact CD2-CD 3.54Å; Y149-K168 HydrophobicContact CD2-CG 3.68Å; Y149-K168 HydrophobicContact CE2-CD 3.55Å; Y149-K168 HydrophobicContact CE2-CG 3.75Å; Y149-K168 HydrophobicContact CG-CD 4.48Å; Y149-K168 HydrophobicContact CG-CG 4.18Å; Y149-P220 HydrophobicContact CE1-CG 4.11Å; Y149-P220 WeakPolarHBondContact OH-CD 3.46Å
150	N	82.6	Confident	72.2	Confident	73 Å²	73	73.3 Å²	73.3	39%	0.39	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	116.9	171.2	-179.4	-34.4	0	0	0	109.3	D152 N153 N154 Q155	N150-D152 PolarHBondContact OD1-N 3.3Å; N150-N153 WeakPolarHBondContact CB-OD1 3.2Å; N150-N153 VanDerWaalsContact CG-CG 3.48Å; N150-N153 PolarHBondContact ND2-ND2 2.68Å; N150-N153 PolarHBondContact O-OD1 3.43Å; N150-N153 PolarHBondContact OD1-N 2.74Å; N150-N153 PolarHBondContact OD1-OD1 2.93Å; N150-N154 WeakPolarHBondContact O-CA 3.16Å; N150-N154 PolarHBondContact O-N 3.2Å; N150-Q155 PolarHBondContact N-O 2.79Å; N150-Q155 PolarHBondContact O-N 3.26Å
151	Y	78.7	Confident	72.2	Confident	30 Å²	30	73.6 Å²	73.6	12%	0.118	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-39.4	-177.7	178.7	-86.9	0	0	0	112.8	Y149 N153 N154 Q219 Y221 T223	Y149-Y151 HydrophobicContact CE1-CD2 4.02Å; Y149-Y151 HydrophobicContact CE1-CG 4.42Å; Y151-N153 VanDerWaalsContact C-N 3.33Å; Y151-N153 PolarHBondContact O-N 2.82Å; Y151-N154 PolarHBondContact O-N 2.74Å; Y151-Q219 HydrophobicContact CD2-CG 4.33Å; Y151-Q219 VanDerWaalsContact CE1-NE2 3.33Å; Y151-Q219 HydrophobicContact CE2-CB 3.99Å; Y151-Q219 HydrophobicContact CE2-CG 3.97Å; Y151-Q219 PolarHBondContact O-NE2 2.73Å; Y151-Q219 PolarHBondContact OH-OE1 2.89Å; Y151-Y221 HydrophobicContact CD2-CD2 4.28Å; Y151-Y221 HydrophobicContact CD2-CE1 4.27Å; Y151-Y221 AromaticContact CD2-CE2 3.49Å; Y151-Y221 HydrophobicContact CD2-CE2 3.49Å; Y151-Y221 VanDerWaalsContact CD2-CE2 3.49Å; Y151-Y221 AromaticContact CD2-CZ 3.48Å; Y151-Y221 VanDerWaalsContact CD2-CZ 3.48Å; Y151-Y221 WeakPolarHBondContact CD2-OH 3.44Å; Y151-Y221 AromaticContact CE2-CD2 3.7Å; Y151-Y221 HydrophobicContact CE2-CD2 3.7Å; Y151-Y221 AromaticContact CE2-CE2 3.32Å; Y151-Y221 HydrophobicContact CE2-CE2 3.32Å; Y151-Y221 HydrophobicContact CE2-CG 4.42Å; Y151-Y221 AromaticContact CE2-CZ 3.79Å; Y151-Y221 HydrophobicContact CG-CE2 4.45Å; Y151-Y221 PolarHBondContact OH-O 2.82Å; Y151-T223 HydrophobicContact CD1-CG2 4.11Å; Y151-T223 HydrophobicContact CE1-CG2 3.33Å; Y151-T223 HydrophobicContact CE2-CG2 4.32Å; Y151-T223 VanDerWaalsContact CZ-CG2 3.46Å; Y151-T223 WeakPolarHBondContact OH-CG2 3.19Å; Y151-T223 PolarHBondContact OH-N 2.86Å; Y151-T223 VanDerWaalsContact OH-N 3.13Å; Y151-T223 PolarHBondContact OH-OG1 2.78Å
152	D	74.4	Confident	72.1	Confident	144 Å²	144	74.6 Å²	74.6	77%	0.77	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-35.3	-170.1	-60	-34.2	0	0	0	112	N150	N150-D152 PolarHBondContact OD1-N 3.3Å
153	N	76	Confident	72.2	Confident	73 Å²	73	76.1 Å²	76.1	39%	0.39	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-4.2	174.9	65.9	14.9	0	0	0	113.7	N150 Y151 Q155	N150-N153 WeakPolarHBondContact CB-OD1 3.2Å; N150-N153 VanDerWaalsContact CG-CG 3.48Å; N150-N153 PolarHBondContact ND2-ND2 2.68Å; N150-N153 PolarHBondContact O-OD1 3.43Å; N150-N153 PolarHBondContact OD1-N 2.74Å; N150-N153 PolarHBondContact OD1-OD1 2.93Å; Y151-N153 VanDerWaalsContact C-N 3.33Å; Y151-N153 PolarHBondContact O-N 2.82Å; N153-Q155 HydrophobicContact CB-CG 4.12Å; N153-Q155 PolarHBondContact ND2-OE1 3.48Å; N153-Q155 PolarHBondContact O-N 2.76Å; N153-Q155 VanDerWaalsContact OD1-CB 3.26Å; N153-Q155 WeakPolarHBondContact OD1-CB 2.98Å; N153-Q155 WeakPolarHBondContact OD1-CG 3.19Å; N153-Q155 PolarHBondContact OD1-N 2.79Å
154	N	80.5	Confident	72.4	Confident	47 Å²	47	74 Å²	74	25%	0.251	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	33.1	-175.7	173.7	45.6	0	0	0	113.3	Y149 N150 Y151 K168 G218 Q219	Y149-N154 PolarHBondContact OH-OD1 2.89Å; N150-N154 WeakPolarHBondContact O-CA 3.16Å; N150-N154 PolarHBondContact O-N 3.2Å; Y151-N154 PolarHBondContact O-N 2.74Å; N154-K168 WeakPolarHBondContact OD1-CE 3.17Å; N154-K168 PolarHBondContact OD1-NZ 2.95Å; N154-G218 WeakPolarHBondContact ND2-CA 3.24Å; N154-G218 VanDerWaalsContact OD1-C 3.25Å; N154-G218 PolarHBondContact OD1-O 2.94Å; N154-Q219 HydrophobicContact CB-CG 4.02Å
155	Q	78.3	Confident	72.3	Confident	119 Å²	119	71.4 Å²	71.4	56%	0.556	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	152.3	-180	-60.9	-179	-0.1	0	0	112.4	N150 N153	N150-Q155 PolarHBondContact N-O 2.79Å; N150-Q155 PolarHBondContact O-N 3.26Å; N153-Q155 HydrophobicContact CB-CG 4.12Å; N153-Q155 PolarHBondContact ND2-OE1 3.48Å; N153-Q155 PolarHBondContact O-N 2.76Å; N153-Q155 VanDerWaalsContact OD1-CB 3.26Å; N153-Q155 WeakPolarHBondContact OD1-CB 2.98Å; N153-Q155 WeakPolarHBondContact OD1-CG 3.19Å; N153-Q155 PolarHBondContact OD1-N 2.79Å
156	C	79.1	Confident	72	Confident	30 Å²	30	72.8 Å²	72.8	20%	0.203	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	144.9	165.9	-65.9	0	0	0	0	108.6	C164	C156-C164 WeakPolarHBondContact CA-SG 3.26Å; C156-C164 HydrophobicContact CB-CB 3.42Å; C156-C164 VanDerWaalsContact CB-CB 3.42Å; C156-C164 WeakPolarHBondContact CB-SG 3.29Å; C156-C164 WeakPolarHBondContact SG-CB 3.38Å; C156-C164 CovalentContact SG-SG 2.02Å; C156-C164 PolarHBondContact SG-SG 2.94Å
157	E	75.7	Confident	71.9	Confident	114 Å²	114	72.2 Å²	72.2	53%	0.533	38%	0.376	S	S	.	.			trans	-60.1	137.3	169.2	-65.3	178.8	147.2	0	0	110	K148 D159 D160 S161	K148-E157 PolarHBondContact O-N 3.02Å; E157-D159 VanDerWaalsContact C-N 3.34Å; E157-D159 PolarHBondContact O-N 2.64Å; E157-D160 CarbonylContact O-C 3.55Å; E157-D160 PolarHBondContact O-N 2.81Å; E157-D160 VanDerWaalsContact O-N 3.09Å; E157-S161 PolarHBondContact O-N 3.1Å; E157-S161 VanDerWaalsContact O-N 3.08Å
158	Q	63	Low	71.5	Confident	186 Å²	186	66 Å²	66	87%	0.869	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-59.4	-42.6	-168.3	-82.2	-178.5	-44.4	0	0	112.9	D160	Q158-D160 PolarHBondContact O-N 2.84Å
159	D	59.3	Low	70.5	Confident	161 Å²	161	63.9 Å²	63.9	86%	0.861	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-69.7	-13.5	-178.3	-61.4	-32.4	0	0	0	113.4	E157	E157-D159 VanDerWaalsContact C-N 3.34Å; E157-D159 PolarHBondContact O-N 2.64Å
160	D	58.8	Low	69.5	Low	38 Å²	38	63.5 Å²	63.5	20%	0.203	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-131.3	19.3	-171.5	-84.1	-81.8	0	0	0	113.6	K148 E157 Q158 A162 V163 C164	K148-D160 HydrophobicContact CB-CB 4.41Å; K148-D160 HydrophobicContact CD-CB 3.41Å; K148-D160 VanDerWaalsContact CD-CB 3.41Å; K148-D160 WeakPolarHBondContact CD-OD1 3.47Å; K148-D160 WeakPolarHBondContact CD-OD2 3.46Å; K148-D160 IonicContact NZ-OD1 2.76Å; K148-D160 PolarHBondContact NZ-OD1 3.32Å; K148-D160 IonicContact NZ-OD2 2.73Å; K148-D160 PolarHBondContact NZ-OD2 2.77Å; E157-D160 CarbonylContact O-C 3.55Å; E157-D160 PolarHBondContact O-N 2.81Å; E157-D160 VanDerWaalsContact O-N 3.09Å; Q158-D160 PolarHBondContact O-N 2.84Å; D160-A162 PolarHBondContact O-N 3.24Å; D160-A162 VanDerWaalsContact O-N 3.1Å; D160-V163 HydrophobicContact CB-CB 4.27Å; D160-V163 WeakPolarHBondContact O-CA 3.38Å; D160-V163 WeakPolarHBondContact O-CB 3.32Å; D160-V163 PolarHBondContact O-N 3.11Å; D160-V163 WeakPolarHBondContact OD1-CG2 3.32Å; D160-C164 PolarHBondContact O-N 2.82Å
161	S	63	Low	68.4	Low	65 Å²	65	60.2 Å²	60.2	46%	0.455	32%	0.322	S	S	.	.	H	α-helix	trans	-42.9	-45.9	177.2	164.2	0	0	0	0	113.7	E157 E165	E157-S161 PolarHBondContact O-N 3.1Å; E157-S161 VanDerWaalsContact O-N 3.08Å; S161-E165 WeakPolarHBondContact O-CB 3.23Å; S161-E165 WeakPolarHBondContact O-CG 3.16Å; S161-E165 PolarHBondContact O-N 3.34Å
162	A	60.4	Low	67.5	Low	69 Å²	69	60.2 Å²	60.2	57%	0.57	32%	0.322	S	S	*	.	H	α-helix	trans	-67	-38.9	177.6	0	0	0	0	0	113.3	D160 N166	D160-A162 PolarHBondContact O-N 3.24Å; D160-A162 VanDerWaalsContact O-N 3.1Å; A162-N166 PolarHBondContact O-N 2.8Å; A162-N166 VanDerWaalsContact O-N 3.12Å; A162-N166 PolarHBondContact O-ND2 3.39Å; A162-N166 PolarHBondContact O-OD1 2.9Å
163	V	64.8	Low	66	Low	49 Å²	49	55.3 Å²	55.3	30%	0.297	30%	0.296	S	S	.	.	H	α-helix	trans	-69.4	-43.1	-179.5	-177.1	0	0	0	0	110.5	M145 D160 N166 Y167	M145-V163 HydrophobicContact CB-CG1 4.03Å; M145-V163 HydrophobicContact CG-CG1 3.58Å; M145-V163 HydrophobicContact SD-CG1 4.32Å; D160-V163 HydrophobicContact CB-CB 4.27Å; D160-V163 WeakPolarHBondContact O-CA 3.38Å; D160-V163 WeakPolarHBondContact O-CB 3.32Å; D160-V163 PolarHBondContact O-N 3.11Å; D160-V163 WeakPolarHBondContact OD1-CG2 3.32Å; V163-N166 PolarHBondContact O-N 3.49Å; V163-Y167 PolarHBondContact O-N 3.22Å
164	C	71.1	Confident	64.6	Low	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-71.4	-39	176.6	165.2	0	0	0	0	113.3	K148 Y149 C156 D160 N166 Y167 K168	K148-C164 HydrophobicContact CB-CB 4.36Å; K148-C164 PolarHBondContact O-SG 3.03Å; Y149-C164 VanDerWaalsContact CB-SG 3.6Å; C156-C164 WeakPolarHBondContact CA-SG 3.26Å; C156-C164 HydrophobicContact CB-CB 3.42Å; C156-C164 VanDerWaalsContact CB-CB 3.42Å; C156-C164 WeakPolarHBondContact CB-SG 3.29Å; C156-C164 WeakPolarHBondContact SG-CB 3.38Å; C156-C164 CovalentContact SG-SG 2.02Å; C156-C164 PolarHBondContact SG-SG 2.94Å; D160-C164 PolarHBondContact O-N 2.82Å; C164-N166 VanDerWaalsContact C-N 3.29Å; C164-N166 PolarHBondContact O-N 2.93Å; C164-Y167 WeakPolarHBondContact O-CB 3.45Å; C164-Y167 PolarHBondContact O-N 3.46Å; C164-K168 WeakPolarHBondContact O-CG 3.49Å; C164-K168 PolarHBondContact O-N 2.87Å
165	E	68.2	Low	62.7	Low	49 Å²	49	50.7 Å²	50.7	23%	0.229	27%	0.273	C	S	.	.	H	α-helix	trans	-65.8	-31.5	174.4	-78.5	-67.4	141.5	0	0	112.3	S161 K168 Q169	S161-E165 WeakPolarHBondContact O-CB 3.23Å; S161-E165 WeakPolarHBondContact O-CG 3.16Å; S161-E165 PolarHBondContact O-N 3.34Å; E165-K168 PolarHBondContact O-N 3.44Å; E165-K168 WeakPolarHBondContact OE1-CD 3.2Å; E165-K168 WeakPolarHBondContact OE1-CE 3.31Å; E165-K168 IonicContact OE1-NZ 3.93Å; E165-K168 PolarHBondContact OE1-NZ 2.56Å; E165-Q169 WeakPolarHBondContact O-CB 3.23Å; E165-Q169 VanDerWaalsContact O-CG 3.25Å; E165-Q169 WeakPolarHBondContact O-CG 3.29Å; E165-Q169 PolarHBondContact O-N 2.65Å; E165-Q169 PolarHBondContact O-NE2 3.16Å
166	N	64.4	Low	60.8	Low	36 Å²	36	52.7 Å²	52.7	19%	0.193	28%	0.275	C	S	.	.	H	α-helix	trans	-62.8	-43.9	170.1	-70.5	-13.2	0	0	0	111.5	M145 A162 V163 C164 Q169 A170	M145-N166 HydrophobicContact SD-CB 4.03Å; A162-N166 PolarHBondContact O-N 2.8Å; A162-N166 VanDerWaalsContact O-N 3.12Å; A162-N166 PolarHBondContact O-ND2 3.39Å; A162-N166 PolarHBondContact O-OD1 2.9Å; V163-N166 PolarHBondContact O-N 3.49Å; C164-N166 VanDerWaalsContact C-N 3.29Å; C164-N166 PolarHBondContact O-N 2.93Å; N166-Q169 PolarHBondContact O-N 3.02Å; N166-A170 WeakPolarHBondContact O-CB 3.49Å; N166-A170 PolarHBondContact O-N 3.47Å
167	Y	71.6	Confident	58.9	Low	14 Å²	14	58.6 Å²	58.6	6%	0.055	29%	0.293	C	S	.	.	H	α-helix	trans	-58.2	-50	172.3	169.2	-97.2	0	0	0	112.3	A146 Y149 V163 C164 Q169 A170 I171	A146-Y167 HydrophobicContact CB-CD2 3.69Å; A146-Y167 HydrophobicContact CB-CE2 3.26Å; A146-Y167 HydrophobicContact CB-CG 4.49Å; Y149-Y167 HydrophobicContact CD1-CD1 4.04Å; Y149-Y167 AromaticContact CD1-CE1 3.52Å; Y149-Y167 HydrophobicContact CD1-CE1 3.52Å; Y149-Y167 HydrophobicContact CE1-CE1 4.32Å; Y149-Y167 AromaticContact CG-CD1 3.99Å; Y149-Y167 HydrophobicContact CG-CD1 3.99Å; Y149-Y167 AromaticContact CG-CE1 3.96Å; Y149-Y167 HydrophobicContact CG-CE1 3.96Å; V163-Y167 PolarHBondContact O-N 3.22Å; C164-Y167 WeakPolarHBondContact O-CB 3.45Å; C164-Y167 PolarHBondContact O-N 3.46Å; Y167-Q169 PolarHBondContact O-N 3.31Å; Y167-A170 PolarHBondContact O-N 2.88Å; Y167-A170 VanDerWaalsContact O-N 3.12Å; Y167-I171 HydrophobicContact CD1-CG1 4.36Å; Y167-I171 HydrophobicContact CD2-CD1 4.06Å; Y167-I171 HydrophobicContact CD2-CG1 3.91Å; Y167-I171 HydrophobicContact CE1-CG1 3.96Å; Y167-I171 HydrophobicContact CE2-CD1 3.49Å; Y167-I171 VanDerWaalsContact CE2-CD1 3.49Å; Y167-I171 HydrophobicContact CE2-CG1 3.47Å; Y167-I171 VanDerWaalsContact CE2-CG1 3.47Å; Y167-I171 HydrophobicContact CG-CG1 4.34Å; Y167-I171 WeakPolarHBondContact O-CG1 3.05Å; Y167-I171 PolarHBondContact O-N 3.22Å
168	K	70.5	Confident	57.3	Low	10 Å²	10	56.5 Å²	56.5	4%	0.043	28%	0.282	C	S	.	.	H	α-helix	trans	-59.2	-30.8	179.5	-67.9	165.5	75.7	175.4	0	112.4	Y149 N154 C164 E165 R172 P220	Y149-K168 HydrophobicContact CD2-CD 3.54Å; Y149-K168 HydrophobicContact CD2-CG 3.68Å; Y149-K168 HydrophobicContact CE2-CD 3.55Å; Y149-K168 HydrophobicContact CE2-CG 3.75Å; Y149-K168 HydrophobicContact CG-CD 4.48Å; Y149-K168 HydrophobicContact CG-CG 4.18Å; N154-K168 WeakPolarHBondContact OD1-CE 3.17Å; N154-K168 PolarHBondContact OD1-NZ 2.95Å; C164-K168 WeakPolarHBondContact O-CG 3.49Å; C164-K168 PolarHBondContact O-N 2.87Å; E165-K168 PolarHBondContact O-N 3.44Å; E165-K168 WeakPolarHBondContact OE1-CD 3.2Å; E165-K168 WeakPolarHBondContact OE1-CE 3.31Å; E165-K168 IonicContact OE1-NZ 3.93Å; E165-K168 PolarHBondContact OE1-NZ 2.56Å; K168-R172 WeakPolarHBondContact O-CG 3.36Å; K168-P220 HydrophobicContact CB-CB 4.41Å; K168-P220 HydrophobicContact CG-CG 4.36Å; K168-P220 WeakPolarHBondContact O-CB 3.41Å
169	Q	59	Low	56.2	Low	18 Å²	18	48.8 Å²	48.8	8%	0.084	25%	0.247	C	C	.	.	H	α-helix	trans	-77.2	-44.6	175.3	-74.1	173.5	52.9	0	0	112	E165 N166 Y167 I171 R172 L173 F213	E165-Q169 WeakPolarHBondContact O-CB 3.23Å; E165-Q169 VanDerWaalsContact O-CG 3.25Å; E165-Q169 WeakPolarHBondContact O-CG 3.29Å; E165-Q169 PolarHBondContact O-N 2.65Å; E165-Q169 PolarHBondContact O-NE2 3.16Å; N166-Q169 PolarHBondContact O-N 3.02Å; Y167-Q169 PolarHBondContact O-N 3.31Å; Q169-I171 PolarHBondContact O-N 3.04Å; Q169-R172 PolarHBondContact O-N 3.1Å; Q169-L173 PolarHBondContact O-N 3.44Å; Q169-F213 VanDerWaalsContact C-CE1 3.43Å; Q169-F213 HydrophobicContact CB-CB 3.86Å; Q169-F213 HydrophobicContact CB-CD1 3.72Å; Q169-F213 HydrophobicContact CB-CD2 3.83Å; Q169-F213 HydrophobicContact CB-CE1 4.15Å; Q169-F213 HydrophobicContact CB-CE2 4.21Å; Q169-F213 HydrophobicContact CB-CG 3.56Å; Q169-F213 HydrophobicContact CB-CZ 4.37Å; Q169-F213 HydrophobicContact CG-CB 4.05Å; Q169-F213 HydrophobicContact CG-CG 4.3Å; Q169-F213 WeakPolarHBondContact O-CD1 3.42Å; Q169-F213 WeakPolarHBondContact O-CE1 3.4Å
170	A	59.4	Low	55.5	Low	8 Å²	8	41.8 Å²	41.8	7%	0.066	21%	0.208	C	C	.	.	H	α-helix	trans	-59.8	-42.4	176.9	0	0	0	0	0	113.5	L142 N166 Y167 R172 F213	L142-A170 HydrophobicContact CD1-CB 4.24Å; L142-A170 HydrophobicContact CD2-CB 3.47Å; L142-A170 VanDerWaalsContact CD2-CB 3.47Å; N166-A170 WeakPolarHBondContact O-CB 3.49Å; N166-A170 PolarHBondContact O-N 3.47Å; Y167-A170 PolarHBondContact O-N 2.88Å; Y167-A170 VanDerWaalsContact O-N 3.12Å; A170-R172 PolarHBondContact O-N 3.13Å; A170-F213 HydrophobicContact CB-CE1 4.43Å; A170-F213 HydrophobicContact CB-CZ 4.18Å
171	I	61.1	Low	54.6	Low	5 Å²	5	40.2 Å²	40.2	3%	0.026	20%	0.2	C	C	.	.	H	α-helix	trans	-68.7	-34.8	179.5	-53.2	-57.6	0	0	0	112	R83 L90 Y167 Q169 L173 V174 P220 Y221	R83-I171 VanDerWaalsContact NH1-CD1 3.32Å; L90-I171 HydrophobicContact CD2-CG2 4.29Å; Y167-I171 HydrophobicContact CD1-CG1 4.36Å; Y167-I171 HydrophobicContact CD2-CD1 4.06Å; Y167-I171 HydrophobicContact CD2-CG1 3.91Å; Y167-I171 HydrophobicContact CE1-CG1 3.96Å; Y167-I171 HydrophobicContact CE2-CD1 3.49Å; Y167-I171 VanDerWaalsContact CE2-CD1 3.49Å; Y167-I171 HydrophobicContact CE2-CG1 3.47Å; Y167-I171 VanDerWaalsContact CE2-CG1 3.47Å; Y167-I171 HydrophobicContact CG-CG1 4.34Å; Y167-I171 WeakPolarHBondContact O-CG1 3.05Å; Y167-I171 PolarHBondContact O-N 3.22Å; Q169-I171 PolarHBondContact O-N 3.04Å; I171-L173 PolarHBondContact O-N 2.88Å; I171-V174 PolarHBondContact O-N 3.43Å; I171-P220 HydrophobicContact CB-CB 4.25Å; I171-Y221 HydrophobicContact CB-CD1 4.43Å; I171-Y221 HydrophobicContact CG2-CD1 3.5Å; I171-Y221 VanDerWaalsContact CG2-CD1 3.5Å; I171-Y221 HydrophobicContact CG2-CE1 4.1Å; I171-Y221 HydrophobicContact CG2-CG 4.43Å
172	R	58.9	Low	53.4	Low	29 Å²	29	38 Å²	38	11%	0.109	18%	0.182	C	C	.	.	H	α-helix	trans	-64.1	-36.2	-179.9	-81.4	178.2	173.8	129.7	-1.6	114.1	K168 Q169 A170 G175 Q216 G218 Q219 P220	K168-R172 WeakPolarHBondContact O-CG 3.36Å; Q169-R172 PolarHBondContact O-N 3.1Å; A170-R172 PolarHBondContact O-N 3.13Å; R172-G175 PolarHBondContact O-N 2.98Å; R172-Q216 VanDerWaalsContact CZ-O 3.31Å; R172-Q216 PolarHBondContact NH1-O 2.64Å; R172-Q216 PolarHBondContact NH2-O 2.65Å; R172-G218 VanDerWaalsContact NH2-C 3.28Å; R172-G218 PolarHBondContact NH2-O 3.43Å; R172-Q219 PolarHBondContact NH2-O 2.95Å; R172-P220 HydrophobicContact CG-CB 3.83Å; R172-P220 WeakPolarHBondContact CG-O 3.18Å
173	L	42.5	Very low	52.4	Low	42 Å²	42	38.3 Å²	38.3	22%	0.22	18%	0.175	C	C	.	.	H	α-helix	trans	-72.4	-27.2	178.8	-80.2	-173.5	0	0	0	113.4	Q169 I171 G175 R176 I212 F213	Q169-L173 PolarHBondContact O-N 3.44Å; I171-L173 PolarHBondContact O-N 2.88Å; L173-G175 PolarHBondContact O-N 3.31Å; L173-R176 CarbonylContact O-C 3.51Å; L173-R176 PolarHBondContact O-N 3.4Å; L173-I212 WeakPolarHBondContact CD1-O 3.14Å; L173-F213 HydrophobicContact CB-CE1 4.45Å; L173-F213 HydrophobicContact CD1-CD1 3.38Å; L173-F213 HydrophobicContact CD1-CE1 3.47Å; L173-F213 VanDerWaalsContact CD1-CE1 3.47Å; L173-F213 HydrophobicContact CD1-CG 4.46Å; L173-F213 HydrophobicContact CG-CD1 3.76Å; L173-F213 HydrophobicContact CG-CE1 3.99Å
174	V	46.6	Very low	51.1	Low	17 Å²	17	37.2 Å²	37.2	10%	0.103	17%	0.173	C	C	.	.	H	α-helix	trans	-64.3	-21.6	173.6	-178.7	0	0	0	0	111.6	L90 I171 I179 L240	L90-V174 HydrophobicContact CD1-CG1 4.11Å; I171-V174 PolarHBondContact O-N 3.43Å; V174-I179 HydrophobicContact CG2-CD1 4.41Å; V174-L240 HydrophobicContact CG1-CD2 4.47Å
175	G	40.2	Very low	49.4	Very low	5 Å²	5	43.1 Å²	43.1	5%	0.052	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97	13.5	168.5	0	0	0	0	0	115.6	P91 R172 L173	P91-G175 CarbonylContact O-C 3.59Å; P91-G175 WeakPolarHBondContact O-CA 3.26Å; R172-G175 PolarHBondContact O-N 2.98Å; L173-G175 PolarHBondContact O-N 3.31Å
176	R	38.6	Very low	47.7	Very low	162 Å²	162	45.6 Å²	45.6	61%	0.611	22%	0.217	S	C	*	.	S	Bend	trans	-150.2	82.7	-178.5	-71.1	-163.5	176.8	-149.8	-3.3	114.4	L173 K178	L173-R176 CarbonylContact O-C 3.51Å; L173-R176 PolarHBondContact O-N 3.4Å; R176-K178 VanDerWaalsContact C-N 3.27Å; R176-K178 PolarHBondContact O-N 2.91Å
177	R	39	Very low	46	Very low	153 Å²	153	52.5 Å²	52.5	58%	0.577	25%	0.248	S	C	*	.	S	Bend	trans	49.3	-23.8	156	-67.1	-166.8	-174.4	-171.7	2.4	122.2	T94 E96	T94-R177 WeakPolarHBondContact O-CA 3.28Å; E96-R177 PolarHBondContact N-O 3.49Å
178	K	43.4	Very low	44.1	Very low	70 Å²	70	59.3 Å²	59.3	30%	0.304	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	125.3	-170.9	-66.6	-176.6	165.3	-159.8	0	112.2	S98 E100 L101 R176	S98-K178 VanDerWaalsContact CB-CD 3.47Å; S98-K178 WeakPolarHBondContact OG-CD 3.31Å; S98-K178 WeakPolarHBondContact OG-CE 3.39Å; S98-K178 PolarHBondContact OG-NZ 3.01Å; E100-K178 IonicContact OE2-NZ 3.52Å; E100-K178 PolarHBondContact OE2-NZ 2.8Å; L101-K178 HydrophobicContact CD1-CB 4.09Å; L101-K178 HydrophobicContact CD1-CD 3.95Å; R176-K178 VanDerWaalsContact C-N 3.27Å; R176-K178 PolarHBondContact O-N 2.91Å
179	I	38.9	Very low	42.2	Very low	24 Å²	24	64 Å²	64	12%	0.123	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	146.1	172.8	-60.5	174.1	0	0	0	108.1	N79 T95 V174	N79-I179 HydrophobicContact CB-CD1 4.49Å; T95-I179 HydrophobicContact CG2-CD1 3.85Å; T95-I179 HydrophobicContact CG2-CG1 4.43Å; V174-I179 HydrophobicContact CG2-CD1 4.41Å
180	R	44.4	Very low	40.7	Very low	14 Å²	14	68.5 Å²	68.5	5%	0.053	35%	0.354	C	S	.	.			trans	-150.7	128.7	171.9	-154	-81.4	-96.1	-121.9	167.9	112.2	W97 L101 E102 A105	W97-R180 HydrophobicContact CH2-CG 4.17Å; W97-R180 HydrophobicContact CZ2-CG 3.92Å; L101-R180 VanDerWaalsContact O-CZ 3.23Å; L101-R180 PolarHBondContact O-NE 3.26Å; L101-R180 PolarHBondContact O-NH1 2.95Å; E102-R180 HydrophobicContact CB-CG 4.49Å; E102-R180 HydrophobicContact CG-CG 4.48Å; E102-R180 VanDerWaalsContact CG-NH2 3.27Å; E102-R180 VanDerWaalsContact O-CZ 3.25Å; E102-R180 PolarHBondContact O-NH1 2.86Å; E102-R180 PolarHBondContact O-NH2 3.28Å; E102-R180 VanDerWaalsContact O-NH2 3.14Å; A105-R180 VanDerWaalsContact C-NH1 3.3Å; A105-R180 VanDerWaalsContact CB-CZ 3.43Å
181	L	40.4	Very low	39.3	Very low	5 Å²	5	77.2 Å²	77.2	3%	0.026	39%	0.393	C	S	.	.			trans	-113.8	158.5	170.9	-61.5	174.5	0	0	0	109.8	F67 V75 V135 L209 E211	F67-L181 HydrophobicContact CE2-CB 4.42Å; F67-L181 WeakPolarHBondContact CE2-O 3.44Å; F67-L181 HydrophobicContact CZ-CB 4.23Å; V75-L181 HydrophobicContact CG1-CD1 3.76Å; V75-L181 HydrophobicContact CG1-CG 4.32Å; V75-L181 HydrophobicContact CG2-CD1 4.4Å; V135-L181 HydrophobicContact CB-CD1 4.31Å; V135-L181 HydrophobicContact CG1-CD1 3.62Å; V135-L181 HydrophobicContact CG2-CD1 3.89Å; L181-L209 HydrophobicContact CB-CD2 3.79Å; L181-L209 HydrophobicContact CD2-CD2 3.75Å; L181-L209 HydrophobicContact CG-CD2 4.34Å; L181-E211 HydrophobicContact CD2-CG 4.36Å
182	Q	38	Very low	37.7	Very low	18 Å²	18	85.3 Å²	85.3	8%	0.084	44%	0.435	C	S	.	.			trans	-160.2	137	171.3	-155.1	172.1	20.1	0	0	111.9	N65 A106 L209	N65-Q182 PolarHBondContact O-NE2 3.29Å; A106-Q182 VanDerWaalsContact CB-OE1 3.26Å; Q182-L209 WeakPolarHBondContact O-CA 2.85Å; Q182-L209 WeakPolarHBondContact O-CD2 3.39Å; Q182-L209 WeakPolarHBondContact O-CG 3.36Å
183	N	38.9	Very low	36.2	Very low	77 Å²	77	96.1 Å²	96.1	41%	0.412	48%	0.476	S	S	.	.	P	Polyproline II helix	trans	-95.7	118.2	175	-75.9	8.8	0	0	0	110.7	V207	N183-V207 HydrophobicContact CB-CG1 3.69Å
184	G	37.4	Very low	35.4	Very low	26 Å²	26	97.2 Å²	97.2	27%	0.268	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	121.3	167.9	0	0	0	0	0	112.1	V207 R208	G184-V207 WeakPolarHBondContact O-CA 3.42Å; G184-R208 PolarHBondContact N-O 2.93Å; G184-R208 PolarHBondContact O-N 2.9Å
185	N	36.7	Very low	34.6	Very low	123 Å²	123	105.2 Å²	105.2	66%	0.658	53%	0.533	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.7	130.3	180	-148.3	22.1	0	0	0	110.8
186	M	31.2	Very low	33.9	Very low	101 Å²	101	110.2 Å²	110.2	50%	0.498	57%	0.568	S	S	.	*			trans	-108.6	116.5	-169.5	-150.6	177.2	-171.9	0	0	112.4
187	Q	30.4	Very low	33.3	Very low	181 Å²	181	107.4 Å²	107.4	85%	0.846	58%	0.579	S	S	*	*			trans	-134.8	128.3	165.3	-82.7	-167.6	-20.5	0	0	111.9
188	N	30.7	Very low	32.5	Very low	157 Å²	157	109.1 Å²	109.1	84%	0.84	59%	0.593	S	S	*	*			trans	61.2	94.7	166.9	-63.9	-5.3	0	0	0	119.4
189	S	29.8	Very low	31.5	Very low	109 Å²	109	113.8 Å²	113.8	76%	0.762	62%	0.621	S	S	*	*			trans	-127.4	94	148.5	63.9	0	0	0	0	110.2
190	S	28.1	Very low	30.8	Very low	113 Å²	113	124 Å²	124	79%	0.79	66%	0.658	S	S	*	*			trans	-104.6	84	-176.6	58.2	0	0	0	0	112.1
191	E	29.3	Very low	29.9	Very low	191 Å²	191	130.6 Å²	130.6	89%	0.893	69%	0.692	S	S	*	*			trans	-163.2	73.2	165.1	-121.2	169.6	-158.4	0	0	113.1
192	L	27.6	Very low	29.1	Very low	175 Å²	175	142 Å²	142	92%	0.916	74%	0.735	S	S	*	*			trans	-144.9	109.9	167.6	-90.1	173.4	0	0	0	111.3
193	R	27.5	Very low	28.6	Very low	256 Å²	256	149.8 Å²	149.8	97%	0.966	77%	0.772	S	S	*	*			trans	-156.7	146.9	158.5	-65.9	-168.1	-153.5	-166.5	7.1	107.3
194	G	26.8	Very low	28.1	Very low	65 Å²	65	154 Å²	154	67%	0.67	79%	0.788	S	S	*	*			cis	-147.5	-169.4	-12	0	0	0	0	0	107.5
195	H	28.6	Very low	27.7	Very low	184 Å²	184	155.8 Å²	155.8	85%	0.852	79%	0.792	S	S	*	*			cis	-148.6	164.8	20	-69.3	-27.3	0	0	0	107.7
196	S	25.8	Very low	27.4	Very low	110 Å²	110	155.9 Å²	155.9	77%	0.769	79%	0.787	S	S	*	*			cis	-165.3	123.7	-17.1	-92.2	0	0	0	0	108
197	A	26.3	Very low	27.4	Very low	103 Å²	103	151.5 Å²	151.5	85%	0.851	77%	0.765	S	S	*	*			trans	-160.5	140.8	158.7	0	0	0	0	0	108.8
198	H	23.5	Very low	27.6	Very low	190 Å²	190	145.3 Å²	145.3	88%	0.88	73%	0.734	S	S	*	*			trans	-70.2	130.6	-172.1	-71.4	-86.2	0	0	0	113.4
199	L	22	Very low	27.6	Very low	168 Å²	168	138 Å²	138	88%	0.88	70%	0.695	S	S	*	*			trans	-156.2	136.4	133.4	-134.4	74.6	0	0	0	111.7
200	R	24.2	Very low	27.7	Very low	238 Å²	238	133 Å²	133	90%	0.898	66%	0.66	S	S	*	*			trans	-82	155.3	169.3	-80.3	172.6	162	151.9	-7.4	110.1
201	I	24.3	Very low	28	Very low	153 Å²	153	128.9 Å²	128.9	79%	0.785	63%	0.628	S	S	*	*			trans	165.4	99.9	146.9	-85.7	148.7	0	0	0	104.9
202	R	23.9	Very low	28.1	Very low	244 Å²	244	120.9 Å²	120.9	92%	0.921	59%	0.591	S	S	*	*				68.3	137.3	93.1	-80.6	-167.8	-178.5	-177.8	1.4	114.7
203	E	27.7	Very low	28.6	Very low	182 Å²	182	113 Å²	113	85%	0.85	55%	0.55	S	S	*	.			trans	-65.7	138	177.7	-62.4	158.4	119.9	0	0	110.6
204	E	28	Very low	28.8	Very low	164 Å²	164	103.2 Å²	103.2	77%	0.766	52%	0.521	S	S	*	.			trans	179	161.8	146.5	-99.2	152.9	-144.5	0	0	110.7
205	D	29.6	Very low	29.4	Very low	64 Å²	64	108 Å²	108	34%	0.342	52%	0.523	S	S	.	.			trans	-72.4	127.8	-160.2	-54.6	-109.4	0	0	0	115.3	K132	K132-D205 HydrophobicContact CD-CB 3.82Å; K132-D205 WeakPolarHBondContact CE-OD1 3.18Å; K132-D205 VanDerWaalsContact CE-OD2 3.29Å; K132-D205 WeakPolarHBondContact CE-OD2 3.23Å; K132-D205 HydrophobicContact CG-CB 3.84Å; K132-D205 IonicContact NZ-OD1 2.75Å; K132-D205 PolarHBondContact NZ-OD1 3.33Å; K132-D205 IonicContact NZ-OD2 3.86Å; K132-D205 PolarHBondContact NZ-OD2 3.02Å
206	K	30.7	Very low	30	Very low	126 Å²	126	102.6 Å²	102.6	55%	0.548	50%	0.498	S	S	.	.			trans	-105.8	121.7	176	-65.3	-178.2	-177.8	176.9	0	111.9
207	V	30.8	Very low	30.9	Very low	8 Å²	8	102.4 Å²	102.4	5%	0.048	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	120.7	174.2	-179.6	0	0	0	0	109.6	A129 N183 G184	A129-V207 PolarHBondContact N-O 3.04Å; N183-V207 HydrophobicContact CB-CG1 3.69Å; G184-V207 WeakPolarHBondContact O-CA 3.42Å
208	R	34.1	Very low	32.6	Very low	51 Å²	51	98.8 Å²	98.8	19%	0.192	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	135.3	168.2	-71.8	-166.7	-178.2	-157.8	7	110.5	C112 I113 G184	C112-R208 PolarHBondContact O-NH1 3.04Å; I113-R208 PolarHBondContact O-NH1 3.13Å; G184-R208 PolarHBondContact N-O 2.93Å; G184-R208 PolarHBondContact O-N 2.9Å
209	L	31.5	Very low	34.9	Very low	4 Å²	4	93.8 Å²	93.8	2%	0.021	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	132.1	177.9	-105.3	158	0	0	0	109.3	Y127 V138 L181 Q182	Y127-L209 CarbonylContact C-O 3.55Å; Y127-L209 WeakPolarHBondContact CA-O 3.41Å; Y127-L209 PolarHBondContact N-O 3.37Å; Y127-L209 CarbonylContact O-C 3.45Å; Y127-L209 PolarHBondContact O-N 2.86Å; V138-L209 HydrophobicContact CB-CD1 4.39Å; V138-L209 HydrophobicContact CG1-CD1 4.2Å; V138-L209 HydrophobicContact CG2-CD1 3.35Å; L181-L209 HydrophobicContact CB-CD2 3.79Å; L181-L209 HydrophobicContact CD2-CD2 3.75Å; L181-L209 HydrophobicContact CG-CD2 4.34Å; Q182-L209 WeakPolarHBondContact O-CA 2.85Å; Q182-L209 WeakPolarHBondContact O-CD2 3.39Å; Q182-L209 WeakPolarHBondContact O-CG 3.36Å
210	L	31.6	Very low	36.9	Very low	4 Å²	4	86.3 Å²	86.3	2%	0.021	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	112.3	-171.3	-150.1	147.8	0	0	0	111.9	A105 L108 A124 I126 I212	A105-L210 HydrophobicContact CB-CB 4Å; A105-L210 HydrophobicContact CB-CD2 3.77Å; A105-L210 HydrophobicContact CB-CG 4.45Å; A105-L210 WeakPolarHBondContact CB-O 3.3Å; L108-L210 HydrophobicContact CB-CD1 3.44Å; L108-L210 VanDerWaalsContact CB-CD1 3.44Å; L108-L210 HydrophobicContact CB-CD2 4.01Å; L108-L210 HydrophobicContact CB-CG 4.38Å; L108-L210 HydrophobicContact CD1-CD2 3.73Å; A124-L210 HydrophobicContact CB-CD2 4.29Å; I126-L210 HydrophobicContact CD1-CD1 4.04Å; I126-L210 HydrophobicContact CG1-CD1 4.04Å; I126-L210 HydrophobicContact CG1-CG 4.12Å; I126-L210 HydrophobicContact CG2-CD1 4.19Å; I126-L210 HydrophobicContact CG2-CG 4.47Å; L210-I212 HydrophobicContact CD2-CG1 4.3Å
211	E	35	Very low	39	Very low	27 Å²	27	76.1 Å²	76.1	13%	0.126	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	140.3	-177.2	-62.2	-172.4	122.8	0	0	110	A124 A125 L181 F213	A124-E211 WeakPolarHBondContact CA-O 3.42Å; A124-E211 WeakPolarHBondContact CB-O 3.45Å; A125-E211 PolarHBondContact N-O 3.42Å; A125-E211 PolarHBondContact O-N 2.78Å; L181-E211 HydrophobicContact CD2-CG 4.36Å; E211-F213 HydrophobicContact CB-CD2 4Å; E211-F213 HydrophobicContact CB-CE1 4.48Å; E211-F213 HydrophobicContact CB-CE2 3.3Å; E211-F213 HydrophobicContact CB-CZ 3.59Å; E211-F213 HydrophobicContact CG-CE2 4.25Å; E211-F213 HydrophobicContact CG-CZ 4.23Å; E211-F213 WeakPolarHBondContact OE2-CE2 3.37Å; E211-F213 VanDerWaalsContact OE2-CZ 3.26Å; E211-F213 WeakPolarHBondContact OE2-CZ 3.27Å
212	I	31.3	Very low	40.7	Very low	23 Å²	23	70.7 Å²	70.7	12%	0.118	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	109.1	-173.3	-57.5	167.4	0	0	0	108.4	L101 L104 A105 A124 L173 L210	L101-I212 HydrophobicContact CB-CD1 4.32Å; L101-I212 HydrophobicContact CD2-CB 4.49Å; L101-I212 HydrophobicContact CD2-CD1 3.86Å; L101-I212 HydrophobicContact CD2-CG2 4.25Å; L104-I212 HydrophobicContact CB-CD1 4.01Å; L104-I212 HydrophobicContact CD2-CD1 3.91Å; L104-I212 HydrophobicContact CG-CD1 3.87Å; A105-I212 HydrophobicContact CB-CD1 3.93Å; A105-I212 HydrophobicContact CB-CG1 4.36Å; A124-I212 HydrophobicContact CB-CB 4.37Å; A124-I212 HydrophobicContact CB-CG1 4.11Å; A124-I212 HydrophobicContact CB-CG2 4.37Å; L173-I212 WeakPolarHBondContact CD1-O 3.14Å; L210-I212 HydrophobicContact CD2-CG1 4.3Å
213	F	36.9	Very low	42.3	Very low	8 Å²	8	63 Å²	63	4%	0.035	33%	0.334	C	S	.	.			trans	-115.4	-174.8	-171.4	-67	-65.6	0	0	0	112.5	G122 A123 A125 Q169 A170 L173 E211	G122-F213 CarbonylContact C-O 3.6Å; G122-F213 WeakPolarHBondContact CA-O 3.5Å; A123-F213 CarbonylContact C-O 3.52Å; A123-F213 PolarHBondContact N-O 2.83Å; A123-F213 CarbonylContact O-C 3.53Å; A123-F213 WeakPolarHBondContact O-CA 3.45Å; A123-F213 WeakPolarHBondContact O-CB 3.31Å; A123-F213 PolarHBondContact O-N 2.82Å; A125-F213 HydrophobicContact CB-CD2 3.62Å; A125-F213 HydrophobicContact CB-CE2 3.96Å; Q169-F213 VanDerWaalsContact C-CE1 3.43Å; Q169-F213 HydrophobicContact CB-CB 3.86Å; Q169-F213 HydrophobicContact CB-CD1 3.72Å; Q169-F213 HydrophobicContact CB-CD2 3.83Å; Q169-F213 HydrophobicContact CB-CE1 4.15Å; Q169-F213 HydrophobicContact CB-CE2 4.21Å; Q169-F213 HydrophobicContact CB-CG 3.56Å; Q169-F213 HydrophobicContact CB-CZ 4.37Å; Q169-F213 HydrophobicContact CG-CB 4.05Å; Q169-F213 HydrophobicContact CG-CG 4.3Å; Q169-F213 WeakPolarHBondContact O-CD1 3.42Å; Q169-F213 WeakPolarHBondContact O-CE1 3.4Å; A170-F213 HydrophobicContact CB-CE1 4.43Å; A170-F213 HydrophobicContact CB-CZ 4.18Å; L173-F213 HydrophobicContact CB-CE1 4.45Å; L173-F213 HydrophobicContact CD1-CD1 3.38Å; L173-F213 HydrophobicContact CD1-CE1 3.47Å; L173-F213 VanDerWaalsContact CD1-CE1 3.47Å; L173-F213 HydrophobicContact CD1-CG 4.46Å; L173-F213 HydrophobicContact CG-CD1 3.76Å; L173-F213 HydrophobicContact CG-CE1 3.99Å; E211-F213 HydrophobicContact CB-CD2 4Å; E211-F213 HydrophobicContact CB-CE1 4.48Å; E211-F213 HydrophobicContact CB-CE2 3.3Å; E211-F213 HydrophobicContact CB-CZ 3.59Å; E211-F213 HydrophobicContact CG-CE2 4.25Å; E211-F213 HydrophobicContact CG-CZ 4.23Å; E211-F213 WeakPolarHBondContact OE2-CE2 3.37Å; E211-F213 VanDerWaalsContact OE2-CZ 3.26Å; E211-F213 WeakPolarHBondContact OE2-CZ 3.27Å
214	S	32.9	Very low	43.9	Very low	52 Å²	52	55.5 Å²	55.5	36%	0.364	31%	0.306	S	S	.	.			trans	-131.7	126.6	172.9	159	0	0	0	0	109.5	Q216	S214-Q216 VanDerWaalsContact C-N 3.32Å; S214-Q216 PolarHBondContact O-N 3.05Å
215	K	37.8	Very low	45.5	Very low	164 Å²	164	51.7 Å²	51.7	71%	0.713	30%	0.297	S	S	*	.			trans	-75.9	79.4	-177.6	-154.3	172.5	-167.7	172.1	0	111.4	A123	A123-K215 HydrophobicContact CB-CB 4.46Å
216	Q	42	Very low	47.2	Very low	71 Å²	71	53.2 Å²	53.2	33%	0.332	30%	0.302	S	S	.	.			trans	-93.4	135.2	171.8	-75.5	178.3	-13.7	0	0	110.9	R172 S214	R172-Q216 VanDerWaalsContact CZ-O 3.31Å; R172-Q216 PolarHBondContact NH1-O 2.64Å; R172-Q216 PolarHBondContact NH2-O 2.65Å; S214-Q216 VanDerWaalsContact C-N 3.32Å; S214-Q216 PolarHBondContact O-N 3.05Å
217	A	45.3	Very low	48.8	Very low	107 Å²	107	48.1 Å²	48.1	88%	0.884	28%	0.282	S	S	*	.			trans	-83.8	145.7	169	0	0	0	0	0	110.5
218	G	62.1	Low	50.4	Low	26 Å²	26	51.3 Å²	51.3	27%	0.268	30%	0.302	S	S	.	.	S	Bend	trans	117.6	-176.7	179.7	0	0	0	0	0	113.3	N154 R172	N154-G218 WeakPolarHBondContact ND2-CA 3.24Å; N154-G218 VanDerWaalsContact OD1-C 3.25Å; N154-G218 PolarHBondContact OD1-O 2.94Å; R172-G218 VanDerWaalsContact NH2-C 3.28Å; R172-G218 PolarHBondContact NH2-O 3.43Å
219	Q	70.3	Confident	51.7	Low	86 Å²	86	54.5 Å²	54.5	40%	0.402	32%	0.317	S	S	.	.			trans	-64	150.7	173.3	-71.4	166.3	-30.6	0	0	111.1	Y151 N154 R172	Y151-Q219 HydrophobicContact CD2-CG 4.33Å; Y151-Q219 VanDerWaalsContact CE1-NE2 3.33Å; Y151-Q219 HydrophobicContact CE2-CB 3.99Å; Y151-Q219 HydrophobicContact CE2-CG 3.97Å; Y151-Q219 PolarHBondContact O-NE2 2.73Å; Y151-Q219 PolarHBondContact OH-OE1 2.89Å; N154-Q219 HydrophobicContact CB-CG 4.02Å; R172-Q219 PolarHBondContact NH2-O 2.95Å
220	P	65.4	Low	53.1	Low	11 Å²	11	55.8 Å²	55.8	7%	0.071	33%	0.326	C	S	.	.	S	Bend	trans	-89.5	-11.9	-176.4	30.9	-31.2	0	0	0	115.4	Y149 K168 I171 R172	Y149-P220 HydrophobicContact CE1-CG 4.11Å; Y149-P220 WeakPolarHBondContact OH-CD 3.46Å; K168-P220 HydrophobicContact CB-CB 4.41Å; K168-P220 HydrophobicContact CG-CG 4.36Å; K168-P220 WeakPolarHBondContact O-CB 3.41Å; I171-P220 HydrophobicContact CB-CB 4.25Å; R172-P220 HydrophobicContact CG-CB 3.83Å; R172-P220 WeakPolarHBondContact CG-O 3.18Å
221	Y	67.4	Low	54.2	Low	24 Å²	24	57.2 Å²	57.2	9%	0.094	34%	0.337	C	S	.	.	S	Bend	trans	-151.9	171.4	177	51.2	-92	0	0	0	109.6	I88 Y151 I171	I88-Y221 HydrophobicContact CG1-CD2 4.27Å; I88-Y221 HydrophobicContact CG1-CE2 4.02Å; I88-Y221 HydrophobicContact CG2-CD2 3.94Å; I88-Y221 HydrophobicContact CG2-CG 4.02Å; Y151-Y221 HydrophobicContact CD2-CD2 4.28Å; Y151-Y221 HydrophobicContact CD2-CE1 4.27Å; Y151-Y221 AromaticContact CD2-CE2 3.49Å; Y151-Y221 HydrophobicContact CD2-CE2 3.49Å; Y151-Y221 VanDerWaalsContact CD2-CE2 3.49Å; Y151-Y221 AromaticContact CD2-CZ 3.48Å; Y151-Y221 VanDerWaalsContact CD2-CZ 3.48Å; Y151-Y221 WeakPolarHBondContact CD2-OH 3.44Å; Y151-Y221 AromaticContact CE2-CD2 3.7Å; Y151-Y221 HydrophobicContact CE2-CD2 3.7Å; Y151-Y221 AromaticContact CE2-CE2 3.32Å; Y151-Y221 HydrophobicContact CE2-CE2 3.32Å; Y151-Y221 HydrophobicContact CE2-CG 4.42Å; Y151-Y221 AromaticContact CE2-CZ 3.79Å; Y151-Y221 HydrophobicContact CG-CE2 4.45Å; Y151-Y221 PolarHBondContact OH-O 2.82Å; I171-Y221 HydrophobicContact CB-CD1 4.43Å; I171-Y221 HydrophobicContact CG2-CD1 3.5Å; I171-Y221 VanDerWaalsContact CG2-CD1 3.5Å; I171-Y221 HydrophobicContact CG2-CE1 4.1Å; I171-Y221 HydrophobicContact CG2-CG 4.43Å
222	A	60.7	Low	55.3	Low	39 Å²	39	61.5 Å²	61.5	32%	0.322	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	144.1	172.5	0	0	0	0	0	111.2	T89 F229	T89-A222 PolarHBondContact N-O 3.46Å; T89-A222 VanDerWaalsContact N-O 3.13Å; A222-F229 HydrophobicContact CB-CD2 3.73Å; A222-F229 HydrophobicContact CB-CE2 3.66Å
223	T	57.6	Low	56.2	Low	82 Å²	82	65.5 Å²	65.5	50%	0.503	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	129.3	169.8	31.7	0	0	0	0	110.9	Y151	Y151-T223 HydrophobicContact CD1-CG2 4.11Å; Y151-T223 HydrophobicContact CE1-CG2 3.33Å; Y151-T223 HydrophobicContact CE2-CG2 4.32Å; Y151-T223 VanDerWaalsContact CZ-CG2 3.46Å; Y151-T223 WeakPolarHBondContact OH-CG2 3.19Å; Y151-T223 PolarHBondContact OH-N 2.86Å; Y151-T223 VanDerWaalsContact OH-N 3.13Å; Y151-T223 PolarHBondContact OH-OG1 2.78Å
224	G	61.5	Low	57	Low	25 Å²	25	65.7 Å²	65.7	26%	0.258	41%	0.406	S	S	.	.	S	Bend	trans	-175.8	-168.9	179	0	0	0	0	0	111
225	S	61	Low	58.5	Low	83 Å²	83	67.5 Å²	67.5	58%	0.58	41%	0.411	S	S	*	.	S	Bend	trans	-61.8	160.4	162.1	-28.7	0	0	0	0	109.3	T89 C227 T228	T89-S225 PolarHBondContact OG1-O 2.84Å; S225-C227 PolarHBondContact O-N 2.69Å; S225-T228 VanDerWaalsContact CA-OG1 3.24Å; S225-T228 WeakPolarHBondContact CA-OG1 3.05Å; S225-T228 WeakPolarHBondContact CB-OG1 3.37Å; S225-T228 PolarHBondContact N-OG1 3.04Å; S225-T228 PolarHBondContact O-N 3.2Å; S225-T228 PolarHBondContact O-OG1 3.23Å; S225-T228 VanDerWaalsContact O-OG1 3.07Å; S225-T228 PolarHBondContact OG-OG1 2.82Å
226	Q	64.5	Low	59.9	Low	96 Å²	96	63.3 Å²	63.3	45%	0.449	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	130.6	167	-65.6	162.4	22.2	0	0	107.5	T228 K239	Q226-T228 VanDerWaalsContact C-N 3.32Å; Q226-T228 PolarHBondContact O-N 2.7Å; Q226-K239 HydrophobicContact CB-CB 4.33Å; Q226-K239 HydrophobicContact CG-CB 4.09Å; Q226-K239 HydrophobicContact CG-CD 4.15Å; Q226-K239 HydrophobicContact CG-CG 4.13Å
227	C	64.2	Low	60.9	Low	19 Å²	19	66.1 Å²	66.1	13%	0.128	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	64.3	12.5	178	-56	0	0	0	0	118.4	S225 F229 C230 C236	S225-C227 PolarHBondContact O-N 2.69Å; C227-F229 PolarHBondContact O-N 3.39Å; C227-F229 VanDerWaalsContact O-N 3.14Å; C227-C230 WeakPolarHBondContact CA-SG 3.29Å; C227-C230 WeakPolarHBondContact CB-SG 3.39Å; C227-C230 PolarHBondContact O-N 2.85Å; C227-C230 PolarHBondContact O-SG 2.77Å; C227-C236 HydrophobicContact CB-CB 3.45Å; C227-C236 VanDerWaalsContact CB-CB 3.45Å; C227-C236 WeakPolarHBondContact CB-SG 3.4Å; C227-C236 WeakPolarHBondContact SG-CA 3.31Å; C227-C236 WeakPolarHBondContact SG-CB 3.39Å; C227-C236 CovalentContact SG-SG 2.03Å; C227-C236 PolarHBondContact SG-SG 2.72Å
228	T	64.4	Low	61.8	Low	75 Å²	75	66 Å²	66	46%	0.46	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-28.7	177.9	-53.7	0	0	0	0	115.1	S225 Q226	S225-T228 VanDerWaalsContact CA-OG1 3.24Å; S225-T228 WeakPolarHBondContact CA-OG1 3.05Å; S225-T228 WeakPolarHBondContact CB-OG1 3.37Å; S225-T228 PolarHBondContact N-OG1 3.04Å; S225-T228 PolarHBondContact O-N 3.2Å; S225-T228 PolarHBondContact O-OG1 3.23Å; S225-T228 VanDerWaalsContact O-OG1 3.07Å; S225-T228 PolarHBondContact OG-OG1 2.82Å; Q226-T228 VanDerWaalsContact C-N 3.32Å; Q226-T228 PolarHBondContact O-N 2.7Å
229	F	61.5	Low	61.9	Low	118 Å²	118	70.7 Å²	70.7	52%	0.518	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	27.6	-176	-56.6	-69.8	0	0	0	112.2	T89 A222 C227	T89-F229 HydrophobicContact CG2-CB 3.9Å; T89-F229 HydrophobicContact CG2-CD2 3.63Å; T89-F229 HydrophobicContact CG2-CG 4.19Å; A222-F229 HydrophobicContact CB-CD2 3.73Å; A222-F229 HydrophobicContact CB-CE2 3.66Å; C227-F229 PolarHBondContact O-N 3.39Å; C227-F229 VanDerWaalsContact O-N 3.14Å
230	C	61.2	Low	61.2	Low	31 Å²	31	67.9 Å²	67.9	21%	0.209	40%	0.398	C	S	.	.			trans	-75.6	144.7	168.4	-57.7	0	0	0	0	110.2	C227 A234 C241	C227-C230 WeakPolarHBondContact CA-SG 3.29Å; C227-C230 WeakPolarHBondContact CB-SG 3.39Å; C227-C230 PolarHBondContact O-N 2.85Å; C227-C230 PolarHBondContact O-SG 2.77Å; C230-A234 HydrophobicContact CB-CB 4.22Å; C230-C241 WeakPolarHBondContact CA-SG 2.82Å; C230-C241 HydrophobicContact CB-CB 3.74Å; C230-C241 WeakPolarHBondContact CB-SG 3.2Å; C230-C241 PolarHBondContact N-SG 3.15Å; C230-C241 VanDerWaalsContact N-SG 3.45Å; C230-C241 WeakPolarHBondContact SG-CA 3.24Å; C230-C241 WeakPolarHBondContact SG-CB 3.26Å; C230-C241 CovalentContact SG-SG 2.03Å; C230-C241 PolarHBondContact SG-SG 3.2Å
231	S	54.5	Low	60.8	Low	35 Å²	35	67.4 Å²	67.4	25%	0.245	40%	0.395	C	S	.	.			trans	-64.2	153.7	167.3	56	0	0	0	0	110	T233 A234	S231-T233 PolarHBondContact O-N 3.21Å; S231-T233 PolarHBondContact OG-OG1 3.07Å; S231-A234 PolarHBondContact O-N 2.8Å
232	A	59	Low	60.1	Low	117 Å²	117	67.7 Å²	67.7	97%	0.967	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-15.4	178.5	0	0	0	0	0	115
233	T	49.2	Very low	59.4	Low	107 Å²	107	67.3 Å²	67.3	66%	0.656	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.3	16.2	177.6	64.1	0	0	0	0	114.1	S231	S231-T233 PolarHBondContact O-N 3.21Å; S231-T233 PolarHBondContact OG-OG1 3.07Å
234	A	54.6	Low	58.5	Low	12 Å²	12	69.5 Å²	69.5	10%	0.099	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	116.2	-177.4	0	0	0	0	0	111.5	C230 S231 C241 C242	C230-A234 HydrophobicContact CB-CB 4.22Å; S231-A234 PolarHBondContact O-N 2.8Å; A234-C241 HydrophobicContact CB-CB 4.44Å; A234-C242 CarbonylContact C-O 3.59Å; A234-C242 VanDerWaalsContact C-O 3.3Å; A234-C242 VanDerWaalsContact CA-O 3.25Å; A234-C242 WeakPolarHBondContact CA-O 3.34Å
235	N	64.5	Low	57	Low	90 Å²	90	72.9 Å²	72.9	48%	0.481	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	137.6	175.4	-80.1	-25.7	0	0	0	111.5	K237 C242 E244	N235-K237 PolarHBondContact O-N 3.19Å; N235-K237 VanDerWaalsContact O-N 3.16Å; N235-C242 PolarHBondContact N-O 2.82Å; N235-C242 PolarHBondContact O-N 2.91Å; N235-C242 VanDerWaalsContact O-O 3.08Å; N235-E244 WeakPolarHBondContact ND2-CG 3.46Å; N235-E244 PolarHBondContact ND2-OE1 2.01Å
236	C	67.6	Low	55.4	Low	75 Å²	75	74.3 Å²	74.3	51%	0.507	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	104.8	171.2	-171.2	0	0	0	0	109.7	C227 L240	C227-C236 HydrophobicContact CB-CB 3.45Å; C227-C236 VanDerWaalsContact CB-CB 3.45Å; C227-C236 WeakPolarHBondContact CB-SG 3.4Å; C227-C236 WeakPolarHBondContact SG-CA 3.31Å; C227-C236 WeakPolarHBondContact SG-CB 3.39Å; C227-C236 CovalentContact SG-SG 2.03Å; C227-C236 PolarHBondContact SG-SG 2.72Å; C236-L240 WeakPolarHBondContact CA-O 3.38Å
237	K	61.6	Low	53.6	Low	130 Å²	130	75.3 Å²	75.3	57%	0.565	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.6	130.4	174	-169.2	-175	174.6	-177.1	0	109.2	N235 K239 L240 C242	N235-K237 PolarHBondContact O-N 3.19Å; N235-K237 VanDerWaalsContact O-N 3.16Å; K237-K239 PolarHBondContact O-N 3.36Å; K237-K239 VanDerWaalsContact O-N 3.1Å; K237-L240 PolarHBondContact N-O 2.91Å; K237-L240 WeakPolarHBondContact O-CB 3.29Å; K237-L240 PolarHBondContact O-N 3.19Å; K237-C242 HydrophobicContact CB-CB 4.1Å
238	D	64.3	Low	51.8	Low	106 Å²	106	79.5 Å²	79.5	57%	0.567	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	36.7	179.3	-53.7	-44.1	0	0	0	113.7	L240	D238-L240 VanDerWaalsContact C-N 3.25Å; D238-L240 PolarHBondContact O-N 3.04Å
239	K	65.3	Low	49.9	Very low	123 Å²	123	81.8 Å²	81.8	54%	0.535	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.3	14.1	-177.9	-43.4	179.1	177.5	169	0	115	Q226 K237	Q226-K239 HydrophobicContact CB-CB 4.33Å; Q226-K239 HydrophobicContact CG-CB 4.09Å; Q226-K239 HydrophobicContact CG-CD 4.15Å; Q226-K239 HydrophobicContact CG-CG 4.13Å; K237-K239 PolarHBondContact O-N 3.36Å; K237-K239 VanDerWaalsContact O-N 3.1Å
240	L	55.1	Low	48.1	Very low	27 Å²	27	81.9 Å²	81.9	14%	0.141	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	151.5	179.4	-60.4	168.2	0	0	0	110.8	L80 L90 V174 C236 K237 D238 C242	L80-L240 HydrophobicContact CD2-CD1 3.35Å; L90-L240 HydrophobicContact CB-CD2 3.92Å; L90-L240 HydrophobicContact CD1-CD2 3.5Å; L90-L240 VanDerWaalsContact CD1-CD2 3.5Å; L90-L240 HydrophobicContact CG-CD2 4.34Å; V174-L240 HydrophobicContact CG1-CD2 4.47Å; C236-L240 WeakPolarHBondContact CA-O 3.38Å; K237-L240 PolarHBondContact N-O 2.91Å; K237-L240 WeakPolarHBondContact O-CB 3.29Å; K237-L240 PolarHBondContact O-N 3.19Å; D238-L240 VanDerWaalsContact C-N 3.25Å; D238-L240 PolarHBondContact O-N 3.04Å; L240-C242 PolarHBondContact O-N 2.9Å; L240-C242 VanDerWaalsContact O-N 3.11Å
241	C	57.3	Low	46.5	Very low	1 Å²	1	88.6 Å²	88.6	1%	0.007	53%	0.525	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	85.8	173	-62.4	0	0	0	0	110.5	L90 L92 G93 C230 A234	L90-C241 PolarHBondContact O-SG 3.39Å; L92-C241 CarbonylContact C-O 3.13Å; L92-C241 WeakPolarHBondContact CA-O 3.4Å; G93-C241 PolarHBondContact N-O 3.49Å; C230-C241 WeakPolarHBondContact CA-SG 2.82Å; C230-C241 HydrophobicContact CB-CB 3.74Å; C230-C241 WeakPolarHBondContact CB-SG 3.2Å; C230-C241 PolarHBondContact N-SG 3.15Å; C230-C241 VanDerWaalsContact N-SG 3.45Å; C230-C241 WeakPolarHBondContact SG-CA 3.24Å; C230-C241 WeakPolarHBondContact SG-CB 3.26Å; C230-C241 CovalentContact SG-SG 2.03Å; C230-C241 PolarHBondContact SG-SG 3.2Å; A234-C241 HydrophobicContact CB-CB 4.44Å
242	C	52.1	Low	45.4	Very low	31 Å²	31	91.2 Å²	91.2	21%	0.209	54%	0.543	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	126.7	179.9	-67.4	0	0	0	0	110.1	G93 A234 N235 K237 L240	G93-C242 WeakPolarHBondContact O-CA 3.47Å; A234-C242 CarbonylContact C-O 3.59Å; A234-C242 VanDerWaalsContact C-O 3.3Å; A234-C242 VanDerWaalsContact CA-O 3.25Å; A234-C242 WeakPolarHBondContact CA-O 3.34Å; N235-C242 PolarHBondContact N-O 2.82Å; N235-C242 PolarHBondContact O-N 2.91Å; N235-C242 VanDerWaalsContact O-O 3.08Å; K237-C242 HydrophobicContact CB-CB 4.1Å; L240-C242 PolarHBondContact O-N 2.9Å; L240-C242 VanDerWaalsContact O-N 3.11Å
243	G	46.4	Very low	44.5	Very low	30 Å²	30	89.6 Å²	89.6	31%	0.309	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59	148.8	167.8	0	0	0	0	0	110.2	A245	G243-A245 PolarHBondContact O-N 3.45Å
244	E	38.2	Very low	44.8	Very low	129 Å²	129	88.5 Å²	88.5	60%	0.603	52%	0.52	S	S	*	.			trans	-58.2	115.1	175.9	-73.9	-160.6	135.7	0	0	111.4	N235 N246	N235-E244 WeakPolarHBondContact ND2-CG 3.46Å; N235-E244 PolarHBondContact ND2-OE1 2.01Å; E244-N246 PolarHBondContact O-N 3.4Å
245	A	31	Very low	45.1	Very low	96 Å²	96	88.9 Å²	88.9	79%	0.793	53%	0.526	S	S	*	.			trans	-70	91	159.8	0	0	0	0	0	107	G243 P247	G243-A245 PolarHBondContact O-N 3.45Å; A245-P247 WeakPolarHBondContact O-CD 3.49Å; A245-P247 VanDerWaalsContact O-N 3.16Å
246	N	27	Very low	45.3	Very low	112 Å²	112	91.2 Å²	91.2	60%	0.599	53%	0.534	S	S	*	.			trans	-54.8	117.5	-176	-162.4	2.1	0	0	0	109.9	E244 L248	E244-N246 PolarHBondContact O-N 3.4Å; N246-L248 PolarHBondContact O-N 3.45Å
247	P	26.1	Very low	45.9	Very low	117 Å²	117	92.1 Å²	92.1	76%	0.76	53%	0.529	S	S	*	.			trans	-81.8	65.7	-171.5	34.1	-36.8	0	0	0	111.1	A245	A245-P247 WeakPolarHBondContact O-CD 3.49Å; A245-P247 VanDerWaalsContact O-N 3.16Å
248	L	27.5	Very low	46.9	Very low	108 Å²	108	86 Å²	86	57%	0.565	50%	0.502	S	S	*	.			trans	-125.8	99.6	176.1	-75.7	173.4	0	0	0	111.7	N246	N246-L248 PolarHBondContact O-N 3.45Å
249	T	24	Very low	47.7	Very low	123 Å²	123	86.8 Å²	86.8	76%	0.755	51%	0.511	S	S	*	.			trans	-46.1	133.7	153.8	40.9	0	0	0	0	111.1
250	T	24.6	Very low	48.8	Very low	120 Å²	120	82.1 Å²	82.1	74%	0.736	49%	0.492	S	S	*	.	S	Bend	trans	67.8	120	167.2	64.5	0	0	0	0	118.4
251	N	27.4	Very low	50.3	Low	172 Å²	172	82.4 Å²	82.4	92%	0.92	49%	0.494	S	S	*	.			trans	61.9	38.7	152.1	-61.2	-9	0	0	0	121
252	S	30	Very low	52	Low	89 Å²	89	84 Å²	84	62%	0.622	50%	0.502	S	S	*	.			trans	-100.1	143.4	175.1	53.5	0	0	0	0	115
253	S	40.9	Very low	53.8	Low	83 Å²	83	84.1 Å²	84.1	58%	0.58	50%	0.502	S	S	*	.			trans	-94.2	165.6	-174.9	66.6	0	0	0	0	113.2	G255	S253-G255 PolarHBondContact O-N 3.21Å
254	C	55.4	Low	56.1	Low	85 Å²	85	82.7 Å²	82.7	57%	0.574	49%	0.487	S	S	*	.	S	Bend	trans	-75.3	33.8	178.4	-58.4	0	0	0	0	114.1	C360	C254-C360 PolarHBondContact O-N 2.99Å
255	G	61.4	Low	58.7	Low	20 Å²	20	78 Å²	78	21%	0.206	46%	0.464	C	S	.	.			trans	73.4	147.5	-160.3	0	0	0	0	0	111.6	S253	S253-G255 PolarHBondContact O-N 3.21Å
256	E	68.7	Low	61.7	Low	139 Å²	139	75.2 Å²	75.2	65%	0.65	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-79.6	165.8	172.3	-61.3	-153.2	158.5	0	0	110.5	P258 D309 C360	E256-P258 WeakPolarHBondContact O-CD 3.31Å; E256-D309 CarbonylContact C-O 3.5Å; E256-D309 WeakPolarHBondContact CA-O 3.39Å; E256-D309 PolarHBondContact N-O 3.12Å; E256-C360 WeakPolarHBondContact O-CA 3.1Å; E256-C360 WeakPolarHBondContact O-CB 3.3Å
257	K	79.2	Confident	64.9	Low	93 Å²	93	69.9 Å²	69.9	40%	0.404	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-75.3	124.8	176.1	-177	-169.3	158.5	-151.2	0	108	T259 L261	K257-T259 PolarHBondContact O-N 3.35Å; K257-L261 HydrophobicContact CD-CD1 4.39Å; K257-L261 HydrophobicContact CG-CD1 4.24Å
258	P	82.6	Confident	67.9	Low	2 Å²	2	64.6 Å²	64.6	1%	0.013	37%	0.37	C	S	.	.	P	Polyproline II helix	trans	-52.5	137.4	176.2	-25.3	33.4	0	0	0	111.5	E256 N260 L261 A302 D309 C310 L313	E256-P258 WeakPolarHBondContact O-CD 3.31Å; P258-N260 WeakPolarHBondContact CB-OD1 3.24Å; P258-L261 HydrophobicContact CB-CD2 4.12Å; P258-L261 HydrophobicContact CB-CG 4.48Å; P258-L261 WeakPolarHBondContact O-CG 3.12Å; P258-A302 HydrophobicContact CB-CB 3.87Å; P258-A302 HydrophobicContact CG-CB 4.16Å; P258-D309 WeakPolarHBondContact CA-OD2 3.3Å; P258-C310 HydrophobicContact CG-CB 3.95Å; P258-L313 HydrophobicContact CG-CD2 4.08Å
259	T	82.3	Confident	70.9	Confident	122 Å²	122	60.4 Å²	60.4	75%	0.748	35%	0.348	S	S	*	.	S	Bend	trans	-78	-32.4	-179.2	51.4	0	0	0	0	111.9	K257 L261 D309	K257-T259 PolarHBondContact O-N 3.35Å; T259-L261 PolarHBondContact O-N 3.09Å; T259-D309 PolarHBondContact N-OD2 3.47Å; T259-D309 PolarHBondContact OG1-OD2 2.9Å
260	N	86.6	Confident	73.4	Confident	26 Å²	26	62.5 Å²	62.5	14%	0.139	34%	0.343	C	S	.	.			trans	-86.5	46.2	-175.5	66.8	-24.9	0	0	0	114.6	P258 I262 E303 N304	P258-N260 WeakPolarHBondContact CB-OD1 3.24Å; N260-I262 PolarHBondContact O-N 2.92Å; N260-E303 HydrophobicContact CB-CB 4.48Å; N260-E303 PolarHBondContact ND2-N 2.91Å; N260-E303 PolarHBondContact O-N 3.26Å; N260-N304 PolarHBondContact ND2-N 3.4Å; N260-N304 VanDerWaalsContact ND2-N 3.1Å; N260-N304 PolarHBondContact ND2-ND2 3.47Å; N260-N304 PolarHBondContact ND2-O 3.34Å; N260-N304 PolarHBondContact ND2-OD1 3.4Å
261	L	88.5	Confident	75.9	Confident	33 Å²	33	62.6 Å²	62.6	17%	0.173	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	116.8	-177.1	-70.8	-179.9	0	0	0	113.4	K257 P258 T259 Y300 I301 A302 S411	K257-L261 HydrophobicContact CD-CD1 4.39Å; K257-L261 HydrophobicContact CG-CD1 4.24Å; P258-L261 HydrophobicContact CB-CD2 4.12Å; P258-L261 HydrophobicContact CB-CG 4.48Å; P258-L261 WeakPolarHBondContact O-CG 3.12Å; T259-L261 PolarHBondContact O-N 3.09Å; L261-Y300 HydrophobicContact CB-CD1 4.35Å; L261-I301 WeakPolarHBondContact CA-O 3.46Å; L261-A302 HydrophobicContact CD2-CB 4.36Å; L261-S411 WeakPolarHBondContact CD1-O 3.49Å; L261-S411 VanDerWaalsContact CD2-O 3.29Å; L261-S411 WeakPolarHBondContact CD2-O 3.09Å
262	I	91	Very high	78.3	Confident	34 Å²	34	57.1 Å²	57.1	17%	0.174	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	147.7	176	55.7	172.1	0	0	0	112.1	N260 T279 Y300 I301 E303	N260-I262 PolarHBondContact O-N 2.92Å; I262-T279 HydrophobicContact CD1-CG2 3.66Å; I262-T279 HydrophobicContact CG1-CG2 4.11Å; I262-Y300 VanDerWaalsContact O-CA 3.31Å; I262-Y300 WeakPolarHBondContact O-CA 3.37Å; I262-I301 HydrophobicContact CG1-CG1 4.06Å; I262-I301 WeakPolarHBondContact CG1-O 3.33Å; I262-I301 PolarHBondContact N-O 2.8Å; I262-I301 PolarHBondContact O-N 2.73Å; I262-E303 HydrophobicContact CD1-CB 3.88Å; I262-E303 HydrophobicContact CD1-CG 4.01Å; I262-E303 HydrophobicContact CG1-CB 4.1Å; I262-E303 HydrophobicContact CG2-CB 3.99Å; I262-E303 HydrophobicContact CG2-CG 4.37Å
263	P	91.9	Very high	80.6	Confident	33 Å²	33	57.3 Å²	57.3	21%	0.214	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	128.8	-179.5	29.5	-34.4	0	0	0	111.7	Y265 I297 Y300	P263-Y265 HydrophobicContact CB-CE2 4.38Å; P263-Y265 HydrophobicContact CG-CE2 4.03Å; P263-I297 HydrophobicContact CB-CD1 4.11Å; P263-I297 HydrophobicContact CB-CG1 4.14Å; P263-I297 HydrophobicContact CB-CG2 4.2Å; P263-Y300 HydrophobicContact CB-CD1 4.34Å; P263-Y300 HydrophobicContact CB-CE1 4Å
264	L	94	Very high	82.7	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	110.1	171.2	-176.4	62	0	0	0	108.7	L277 T279 F298 G299 I301 L316 L350 I410	L264-L277 HydrophobicContact CD1-CB 4.01Å; L264-L277 HydrophobicContact CD2-CD1 4.31Å; L264-L277 HydrophobicContact CG-CB 4.31Å; L264-T279 HydrophobicContact CD1-CG2 3.97Å; L264-F298 HydrophobicContact CD2-CD1 4.03Å; L264-F298 HydrophobicContact CG-CB 4.45Å; L264-F298 WeakPolarHBondContact O-CA 3.4Å; L264-F298 WeakPolarHBondContact O-CB 3.04Å; L264-F298 PolarHBondContact O-N 2.91Å; L264-G299 PolarHBondContact N-O 3.42Å; L264-I301 HydrophobicContact CB-CD1 4.47Å; L264-I301 HydrophobicContact CD1-CD1 4.18Å; L264-I301 HydrophobicContact CD2-CD1 4.37Å; L264-I301 HydrophobicContact CD2-CG2 4.11Å; L264-L316 HydrophobicContact CD2-CD2 3.96Å; L264-L350 HydrophobicContact CD1-CD1 4Å; L264-I410 HydrophobicContact CD2-CD1 4.22Å
265	Y	93.3	Very high	84.3	Confident	32 Å²	32	49.4 Å²	49.4	13%	0.125	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	143.1	179.6	-57.7	-81.5	0	0	0	111.5	P263 L277 T278 T281 R284 I297	P263-Y265 HydrophobicContact CB-CE2 4.38Å; P263-Y265 HydrophobicContact CG-CE2 4.03Å; Y265-L277 WeakPolarHBondContact O-CA 3.35Å; Y265-T278 WeakPolarHBondContact CB-O 3.42Å; Y265-T278 WeakPolarHBondContact CD2-O 3.46Å; Y265-T278 PolarHBondContact N-O 3.27Å; Y265-T278 PolarHBondContact O-N 3.05Å; Y265-T278 VanDerWaalsContact O-N 3.1Å; Y265-T281 HydrophobicContact CE2-CG2 4.08Å; Y265-R284 HydrophobicContact CG-CG 4.48Å; Y265-I297 HydrophobicContact CD1-CG1 4.15Å; Y265-I297 HydrophobicContact CE1-CG1 4Å
266	R	94	Very high	85.7	Confident	37 Å²	37	48.7 Å²	48.7	14%	0.14	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	118.2	173	178.5	178.2	60.6	168.3	-1.7	111.2	V268 T275 L277 K295 G296 F298 Y379 T380	R266-V268 HydrophobicContact CG-CG2 4.27Å; R266-T275 HydrophobicContact CG-CG2 3.58Å; R266-L277 HydrophobicContact CB-CD2 3.83Å; R266-L277 HydrophobicContact CG-CD2 3.95Å; R266-K295 HydrophobicContact CG-CB 4.36Å; R266-K295 WeakPolarHBondContact O-CA 3.36Å; R266-K295 WeakPolarHBondContact O-CB 3.45Å; R266-K295 PolarHBondContact O-N 3.42Å; R266-G296 PolarHBondContact N-O 2.87Å; R266-F298 HydrophobicContact CB-CB 3.96Å; R266-F298 HydrophobicContact CB-CD2 3.84Å; R266-F298 HydrophobicContact CB-CG 4.2Å; R266-F298 HydrophobicContact CG-CD2 4.18Å; R266-Y379 VanDerWaalsContact CD-O 3.26Å; R266-Y379 WeakPolarHBondContact CD-O 3.33Å; R266-Y379 PolarHBondContact NH1-O 2.96Å; R266-T380 PolarHBondContact NH1-OG1 3.32Å
267	L	92.7	Very high	87	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	140.8	171.5	-57.6	101.8	0	0	0	110.9	T275 V276 T278 R284 L287 M288 Y292 E293 D294	L267-T275 CarbonylContact O-C 3.56Å; L267-T275 WeakPolarHBondContact O-CA 3.38Å; L267-V276 PolarHBondContact N-O 3.4Å; L267-V276 PolarHBondContact O-N 2.88Å; L267-T278 HydrophobicContact CD1-CG2 3.83Å; L267-R284 HydrophobicContact CD1-CB 4.31Å; L267-R284 HydrophobicContact CD1-CG 4.16Å; L267-R284 HydrophobicContact CD2-CG 3.97Å; L267-R284 HydrophobicContact CG-CG 4.39Å; L267-L287 HydrophobicContact CD1-CD1 4.3Å; L267-L287 HydrophobicContact CD2-CB 3.81Å; L267-M288 HydrophobicContact CD2-CG 3.94Å; L267-Y292 HydrophobicContact CB-CD1 4.13Å; L267-E293 WeakPolarHBondContact CA-O 3.44Å; L267-D294 HydrophobicContact CD2-CB 4.39Å
268	V	90.9	Very high	87.6	Confident	5 Å²	5	38.4 Å²	38.4	3%	0.03	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	128.4	-178	178.8	0	0	0	0	110.7	R266 Y270 D274 T275 E293 K295 Y378	R266-V268 HydrophobicContact CG-CG2 4.27Å; V268-Y270 PolarHBondContact O-N 3.19Å; V268-D274 WeakPolarHBondContact CA-O 3.17Å; V268-T275 HydrophobicContact CG2-CG2 4.45Å; V268-E293 PolarHBondContact N-O 2.95Å; V268-E293 PolarHBondContact O-N 2.69Å; V268-K295 HydrophobicContact CB-CG 4.15Å; V268-K295 HydrophobicContact CG2-CG 3.65Å; V268-Y378 HydrophobicContact CG1-CE2 4.11Å; V268-Y378 HydrophobicContact CG2-CE2 4.08Å
269	H	88.7	Confident	88.1	Confident	21 Å²	21	40.1 Å²	40.1	10%	0.097	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	122.7	-179.4	-170	-49.9	0	0	0	111.3	N271 R272 N273 D274 Y292	H269-N271 PolarHBondContact ND1-N 3.45Å; H269-N271 PolarHBondContact O-N 2.77Å; H269-R272 HydrophobicContact CB-CB 4.21Å; H269-R272 PolarHBondContact CD2-NE 3.47Å; H269-R272 PolarHBondContact O-N 3Å; H269-N273 WeakPolarHBondContact O-CA 3.27Å; H269-N273 PolarHBondContact O-N 2.73Å; H269-D274 WeakPolarHBondContact CB-OD1 3.1Å; H269-D274 IonicContact CD2-OD1 2.77Å; H269-D274 IonicContact CG-OD1 2.8Å; H269-D274 PolarHBondContact N-O 2.79Å; H269-Y292 HydrophobicContact CB-CD1 3.94Å; H269-Y292 HydrophobicContact CB-CE1 3.6Å; H269-Y292 HydrophobicContact CB-CE2 4.49Å; H269-Y292 HydrophobicContact CB-CG 4.5Å; H269-Y292 AromaticContact CD2-CE2 3.83Å; H269-Y292 AromaticContact CD2-CZ 3.81Å
270	Y	78.2	Confident	88.6	Confident	167 Å²	167	36.3 Å²	36.3	66%	0.655	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-47.5	-171.1	-170.9	-98.4	0	0	0	114.4	V268 V291	V268-Y270 PolarHBondContact O-N 3.19Å; Y270-V291 PolarHBondContact N-O 2.87Å
271	N	76	Confident	88.7	Confident	121 Å²	121	38.5 Å²	38.5	65%	0.647	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-38.7	-179.9	-66.9	-24.9	0	0	0	114.8	H269	H269-N271 PolarHBondContact ND1-N 3.45Å; H269-N271 PolarHBondContact O-N 2.77Å
272	R	78	Confident	88.8	Confident	57 Å²	57	44 Å²	44	22%	0.215	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91	-26.2	-169.2	-63.3	-170.2	-44.7	-170.9	6.6	113.1	H269 D274 Y292 D325 Y326 Q376	H269-R272 HydrophobicContact CB-CB 4.21Å; H269-R272 PolarHBondContact CD2-NE 3.47Å; H269-R272 PolarHBondContact O-N 3Å; R272-D274 WeakPolarHBondContact CB-OD1 3.02Å; R272-D274 IonicContact CZ-OD1 3.67Å; R272-D274 VanDerWaalsContact CZ-OD1 3.25Å; R272-D274 IonicContact CZ-OD2 3.97Å; R272-D274 IonicContact NE-OD1 3.65Å; R272-D274 PolarHBondContact NE-OD1 3.21Å; R272-D274 IonicContact NH2-OD1 3.55Å; R272-D274 PolarHBondContact NH2-OD1 3.45Å; R272-D274 IonicContact NH2-OD2 3.66Å; R272-D274 PolarHBondContact NH2-OD2 3.25Å; R272-D274 PolarHBondContact O-N 2.88Å; R272-Y292 PolarHBondContact NH2-OH 3Å; R272-D325 PolarHBondContact NH2-O 2.88Å; R272-Y326 VanDerWaalsContact CZ-CE1 3.46Å; R272-Q376 PolarHBondContact O-OE1 2.94Å
273	N	77.7	Confident	88.8	Confident	93 Å²	93	44.8 Å²	44.8	50%	0.497	22%	0.223	S	C	.	.			trans	57.6	23.1	-169.4	-67.6	-52.7	0	0	0	114.7	H269 Y378	H269-N273 WeakPolarHBondContact O-CA 3.27Å; H269-N273 PolarHBondContact O-N 2.73Å; N273-Y378 WeakPolarHBondContact O-CD2 3.27Å
274	D	84.7	Confident	88.7	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.011	22%	0.222	C	C	.	.			trans	-73.4	155.6	160.8	62.3	-78.1	0	0	0	110.7	V268 H269 R272 Y292 Y326 F377	V268-D274 WeakPolarHBondContact CA-O 3.17Å; H269-D274 WeakPolarHBondContact CB-OD1 3.1Å; H269-D274 IonicContact CD2-OD1 2.77Å; H269-D274 IonicContact CG-OD1 2.8Å; H269-D274 PolarHBondContact N-O 2.79Å; R272-D274 WeakPolarHBondContact CB-OD1 3.02Å; R272-D274 IonicContact CZ-OD1 3.67Å; R272-D274 VanDerWaalsContact CZ-OD1 3.25Å; R272-D274 IonicContact CZ-OD2 3.97Å; R272-D274 IonicContact NE-OD1 3.65Å; R272-D274 PolarHBondContact NE-OD1 3.21Å; R272-D274 IonicContact NH2-OD1 3.55Å; R272-D274 PolarHBondContact NH2-OD1 3.45Å; R272-D274 IonicContact NH2-OD2 3.66Å; R272-D274 PolarHBondContact NH2-OD2 3.25Å; R272-D274 PolarHBondContact O-N 2.88Å; D274-Y292 PolarHBondContact OD2-OH 3.47Å; D274-Y326 HydrophobicContact CB-CD1 4.15Å; D274-F377 WeakPolarHBondContact CA-O 3.32Å
275	T	89.9	Confident	88.5	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	133.9	-175.7	-60.4	0	0	0	0	111.2	R266 L267 V268 L277 F377 Y378 Y379	R266-T275 HydrophobicContact CG-CG2 3.58Å; L267-T275 CarbonylContact O-C 3.56Å; L267-T275 WeakPolarHBondContact O-CA 3.38Å; V268-T275 HydrophobicContact CG2-CG2 4.45Å; T275-L277 HydrophobicContact CG2-CD2 4.04Å; T275-F377 PolarHBondContact N-O 2.79Å; T275-Y378 VanDerWaalsContact OG1-CD2 3.27Å; T275-Y378 WeakPolarHBondContact OG1-CD2 3.24Å; T275-Y379 HydrophobicContact CG2-CD2 4.07Å
276	V	91.8	Very high	88.3	Confident	5 Å²	5	52 Å²	52	3%	0.03	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	126.5	169.2	178.1	0	0	0	0	108.7	L267 L287 Y292 Y327 Y329	L267-V276 PolarHBondContact N-O 3.4Å; L267-V276 PolarHBondContact O-N 2.88Å; V276-L287 HydrophobicContact CB-CD1 4.18Å; V276-L287 HydrophobicContact CG1-CD1 3.67Å; V276-Y292 HydrophobicContact CB-CE1 4.31Å; V276-Y292 HydrophobicContact CG2-CD1 4.39Å; V276-Y292 HydrophobicContact CG2-CE1 3.59Å; V276-Y327 HydrophobicContact CG2-CD2 3.72Å; V276-Y327 HydrophobicContact CG2-CE2 4.08Å; V276-Y327 HydrophobicContact CG2-CG 4.41Å; V276-Y329 WeakPolarHBondContact CA-OH 3.36Å
277	L	94.2	Very high	88	Confident	6 Å²	6	51.1 Å²	51.1	3%	0.031	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	136.3	168.8	-55.3	-179.5	0	0	0	109	L264 Y265 R266 T275 F298 Y329 L350 Y379	L264-L277 HydrophobicContact CD1-CB 4.01Å; L264-L277 HydrophobicContact CD2-CD1 4.31Å; L264-L277 HydrophobicContact CG-CB 4.31Å; Y265-L277 WeakPolarHBondContact O-CA 3.35Å; R266-L277 HydrophobicContact CB-CD2 3.83Å; R266-L277 HydrophobicContact CG-CD2 3.95Å; T275-L277 HydrophobicContact CG2-CD2 4.04Å; L277-F298 HydrophobicContact CD1-CD1 3.98Å; L277-F298 HydrophobicContact CD1-CE1 3.83Å; L277-F298 HydrophobicContact CD2-CB 4.29Å; L277-F298 HydrophobicContact CD2-CD1 3.84Å; L277-F298 HydrophobicContact CD2-CD2 4.15Å; L277-F298 HydrophobicContact CD2-CE1 4.18Å; L277-F298 HydrophobicContact CD2-CE2 4.45Å; L277-F298 HydrophobicContact CD2-CG 3.84Å; L277-F298 HydrophobicContact CD2-CZ 4.49Å; L277-Y329 HydrophobicContact CB-CD1 4.44Å; L277-Y329 HydrophobicContact CB-CD2 4.15Å; L277-Y329 HydrophobicContact CB-CE1 4.08Å; L277-Y329 HydrophobicContact CB-CE2 3.79Å; L277-Y329 HydrophobicContact CB-CG 4.49Å; L277-Y329 HydrophobicContact CD1-CD2 3.72Å; L277-Y329 HydrophobicContact CD1-CE2 4.12Å; L277-Y329 HydrophobicContact CD1-CG 4.12Å; L277-Y329 HydrophobicContact CG-CD2 3.88Å; L277-Y329 HydrophobicContact CG-CE2 3.73Å; L277-Y329 VanDerWaalsContact N-CZ 3.32Å; L277-Y329 PolarHBondContact N-OH 2.96Å; L277-Y329 PolarHBondContact O-OH 3.03Å; L277-Y329 VanDerWaalsContact O-OH 3.13Å; L277-L350 HydrophobicContact CB-CD1 4.34Å; L277-Y379 HydrophobicContact CD1-CD1 4.44Å; L277-Y379 HydrophobicContact CD1-CG 4.23Å
278	T	93.4	Very high	87.8	Confident	10 Å²	10	55 Å²	55	6%	0.061	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	145.8	177	-169.2	0	0	0	0	111.4	Y265 L267 S280 T283 R284	Y265-T278 WeakPolarHBondContact CB-O 3.42Å; Y265-T278 WeakPolarHBondContact CD2-O 3.46Å; Y265-T278 PolarHBondContact N-O 3.27Å; Y265-T278 PolarHBondContact O-N 3.05Å; Y265-T278 VanDerWaalsContact O-N 3.1Å; L267-T278 HydrophobicContact CD1-CG2 3.83Å; T278-S280 PolarHBondContact OG1-N 3.36Å; T278-T283 HydrophobicContact CG2-CG2 4.32Å; T278-R284 HydrophobicContact CG2-CB 4.26Å
279	T	93.1	Very high	87.5	Confident	39 Å²	39	63.5 Å²	63.5	24%	0.239	31%	0.308	C	S	.	.	S	Bend	trans	-89.7	-18.2	169.3	44.4	0	0	0	0	112.3	I262 L264 T281 I301 L350	I262-T279 HydrophobicContact CD1-CG2 3.66Å; I262-T279 HydrophobicContact CG1-CG2 4.11Å; L264-T279 HydrophobicContact CD1-CG2 3.97Å; T279-T281 PolarHBondContact O-N 3.03Å; T279-I301 HydrophobicContact CG2-CD1 3.77Å; T279-I301 HydrophobicContact CG2-CG1 4.18Å; T279-L350 WeakPolarHBondContact CG2-O 3.29Å; T279-L350 PolarHBondContact OG1-O 3.45Å
280	S	91.5	Very high	87.3	Confident	42 Å²	42	68.9 Å²	68.9	29%	0.294	33%	0.332	S	S	.	.			trans	-78.9	115.9	-177.6	168	0	0	0	0	112.1	T278 K282 T283 R284	T278-S280 PolarHBondContact OG1-N 3.36Å; S280-K282 VanDerWaalsContact C-N 3.3Å; S280-K282 PolarHBondContact O-N 2.95Å; S280-K282 PolarHBondContact OG-N 3.21Å; S280-T283 WeakPolarHBondContact CB-OG1 3.46Å; S280-T283 PolarHBondContact O-N 3.36Å; S280-T283 WeakPolarHBondContact OG-CB 2.99Å; S280-T283 PolarHBondContact OG-N 2.76Å; S280-T283 PolarHBondContact OG-OG1 2.99Å; S280-R284 PolarHBondContact O-N 2.86Å
281	T	90	Very high	87.6	Confident	72 Å²	72	64.4 Å²	64.4	44%	0.442	32%	0.322	S	S	.	.	H	α-helix	trans	-59.3	-40.3	171	50.7	0	0	0	0	111.6	Y265 T279 T283 R284 D285	Y265-T281 HydrophobicContact CE2-CG2 4.08Å; T279-T281 PolarHBondContact O-N 3.03Å; T281-T283 VanDerWaalsContact C-N 3.33Å; T281-T283 PolarHBondContact O-N 2.84Å; T281-R284 WeakPolarHBondContact O-CB 2.96Å; T281-R284 PolarHBondContact O-N 3.49Å; T281-D285 WeakPolarHBondContact O-CB 3.2Å; T281-D285 PolarHBondContact O-N 3.37Å
282	K	90.7	Very high	88.2	Confident	148 Å²	148	59.6 Å²	59.6	64%	0.643	29%	0.294	S	S	*	.	H	α-helix	trans	-58.6	-42.9	174.6	-176.3	178.8	-179.2	-179.9	0	112	S280 Q286	S280-K282 VanDerWaalsContact C-N 3.3Å; S280-K282 PolarHBondContact O-N 2.95Å; S280-K282 PolarHBondContact OG-N 3.21Å; K282-Q286 WeakPolarHBondContact O-CB 3.46Å; K282-Q286 VanDerWaalsContact O-CG 3.24Å; K282-Q286 WeakPolarHBondContact O-CG 3.21Å; K282-Q286 PolarHBondContact O-N 3.14Å
283	T	89.3	Confident	88.8	Confident	50 Å²	50	61.2 Å²	61.2	31%	0.307	30%	0.304	S	S	.	.	H	α-helix	trans	-70.7	-42.5	178.7	-56.7	0	0	0	0	111.2	T278 S280 T281 D285 Q286 L287	T278-T283 HydrophobicContact CG2-CG2 4.32Å; S280-T283 WeakPolarHBondContact CB-OG1 3.46Å; S280-T283 PolarHBondContact O-N 3.36Å; S280-T283 WeakPolarHBondContact OG-CB 2.99Å; S280-T283 PolarHBondContact OG-N 2.76Å; S280-T283 PolarHBondContact OG-OG1 2.99Å; T281-T283 VanDerWaalsContact C-N 3.33Å; T281-T283 PolarHBondContact O-N 2.84Å; T283-D285 PolarHBondContact O-N 3.07Å; T283-Q286 PolarHBondContact O-N 2.89Å; T283-L287 HydrophobicContact CG2-CD1 3.96Å; T283-L287 HydrophobicContact CG2-CG 4.5Å; T283-L287 WeakPolarHBondContact O-CB 3.45Å; T283-L287 VanDerWaalsContact O-CG 3.3Å; T283-L287 WeakPolarHBondContact O-CG 3.22Å; T283-L287 PolarHBondContact O-N 2.99Å
284	R	90.6	Very high	89.5	Confident	51 Å²	51	59.1 Å²	59.1	19%	0.192	29%	0.293	C	S	.	.	H	α-helix	trans	-54.3	-51	171.7	-178.4	-160.3	69	-172.5	0.8	110.9	Y265 L267 T278 S280 T281 Q286 L287 M288 D294	Y265-R284 HydrophobicContact CG-CG 4.48Å; L267-R284 HydrophobicContact CD1-CB 4.31Å; L267-R284 HydrophobicContact CD1-CG 4.16Å; L267-R284 HydrophobicContact CD2-CG 3.97Å; L267-R284 HydrophobicContact CG-CG 4.39Å; T278-R284 HydrophobicContact CG2-CB 4.26Å; S280-R284 PolarHBondContact O-N 2.86Å; T281-R284 WeakPolarHBondContact O-CB 2.96Å; T281-R284 PolarHBondContact O-N 3.49Å; R284-Q286 PolarHBondContact O-N 2.93Å; R284-L287 PolarHBondContact O-N 2.81Å; R284-M288 HydrophobicContact CG-CE 4.18Å; R284-M288 WeakPolarHBondContact O-CG 3.47Å; R284-M288 PolarHBondContact O-N 2.88Å; R284-D294 WeakPolarHBondContact CD-OD2 3.48Å
285	D	88.9	Confident	89.7	Confident	62 Å²	62	62.9 Å²	62.9	33%	0.332	31%	0.309	S	S	.	.	H	α-helix	trans	-69	-33.2	-176.7	-61.5	-9.2	0	0	0	112.4	T281 T283 M288 K289	T281-D285 WeakPolarHBondContact O-CB 3.2Å; T281-D285 PolarHBondContact O-N 3.37Å; T283-D285 PolarHBondContact O-N 3.07Å; D285-M288 HydrophobicContact CB-CE 4.41Å; D285-M288 WeakPolarHBondContact OD1-CE 3.15Å; D285-K289 WeakPolarHBondContact O-CG 3.07Å; D285-K289 PolarHBondContact O-N 2.96Å
286	Q	89	Confident	89.7	Confident	103 Å²	103	64.3 Å²	64.3	48%	0.481	33%	0.325	S	S	.	.	H	α-helix	trans	-66.8	-38.6	170.7	-77.5	175.4	-10.3	0	0	112.8	K282 T283 R284 K289	K282-Q286 WeakPolarHBondContact O-CB 3.46Å; K282-Q286 VanDerWaalsContact O-CG 3.24Å; K282-Q286 WeakPolarHBondContact O-CG 3.21Å; K282-Q286 PolarHBondContact O-N 3.14Å; T283-Q286 PolarHBondContact O-N 2.89Å; R284-Q286 PolarHBondContact O-N 2.93Å; Q286-K289 PolarHBondContact O-N 3.46Å
287	L	88.6	Confident	89.5	Confident	20 Å²	20	67.7 Å²	67.7	11%	0.105	34%	0.342	C	S	.	.	H	α-helix	trans	-74.6	-35.9	178.3	-72.4	169.4	0	0	0	112.1	L267 V276 T283 R284 K289 K290 Y292	L267-L287 HydrophobicContact CD1-CD1 4.3Å; L267-L287 HydrophobicContact CD2-CB 3.81Å; V276-L287 HydrophobicContact CB-CD1 4.18Å; V276-L287 HydrophobicContact CG1-CD1 3.67Å; T283-L287 HydrophobicContact CG2-CD1 3.96Å; T283-L287 HydrophobicContact CG2-CG 4.5Å; T283-L287 WeakPolarHBondContact O-CB 3.45Å; T283-L287 VanDerWaalsContact O-CG 3.3Å; T283-L287 WeakPolarHBondContact O-CG 3.22Å; T283-L287 PolarHBondContact O-N 2.99Å; R284-L287 PolarHBondContact O-N 2.81Å; L287-K289 PolarHBondContact O-N 3.2Å; L287-K290 CarbonylContact O-C 3.59Å; L287-K290 WeakPolarHBondContact O-CA 3.31Å; L287-K290 WeakPolarHBondContact O-CB 3.4Å; L287-K290 PolarHBondContact O-N 3.18Å; L287-Y292 HydrophobicContact CB-CD2 4.31Å; L287-Y292 HydrophobicContact CB-CG 4.35Å; L287-Y292 HydrophobicContact CD2-CD2 3.8Å; L287-Y292 HydrophobicContact CD2-CE2 3.88Å; L287-Y292 HydrophobicContact CD2-CG 4.45Å
288	M	87.7	Confident	89.4	Confident	80 Å²	80	67.8 Å²	67.8	39%	0.394	34%	0.342	S	S	.	.	H	α-helix	trans	-63.2	-26.8	171.3	-73.6	-165.4	-64.8	0	0	113.2	L267 R284 D285 D294	L267-M288 HydrophobicContact CD2-CG 3.94Å; R284-M288 HydrophobicContact CG-CE 4.18Å; R284-M288 WeakPolarHBondContact O-CG 3.47Å; R284-M288 PolarHBondContact O-N 2.88Å; D285-M288 HydrophobicContact CB-CE 4.41Å; D285-M288 WeakPolarHBondContact OD1-CE 3.15Å; M288-D294 HydrophobicContact CG-CB 4.03Å; M288-D294 HydrophobicContact SD-CB 3.63Å
289	K	86.1	Confident	89.1	Confident	184 Å²	184	67.4 Å²	67.4	80%	0.8	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-10.7	169.7	-70.4	172.3	-175.8	-177.6	0	113.3	D285 Q286 L287	D285-K289 WeakPolarHBondContact O-CG 3.07Å; D285-K289 PolarHBondContact O-N 2.96Å; Q286-K289 PolarHBondContact O-N 3.46Å; L287-K289 PolarHBondContact O-N 3.2Å
290	K	83.5	Confident	88.9	Confident	135 Å²	135	67.4 Å²	67.4	59%	0.587	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	-149	171.6	-62.3	-177.9	176.9	-176.3	0	109.5	L287 Y292	L287-K290 CarbonylContact O-C 3.59Å; L287-K290 WeakPolarHBondContact O-CA 3.31Å; L287-K290 WeakPolarHBondContact O-CB 3.4Å; L287-K290 PolarHBondContact O-N 3.18Å; K290-Y292 VanDerWaalsContact C-N 3.33Å; K290-Y292 PolarHBondContact O-N 2.93Å
291	V	85.3	Confident	88.9	Confident	73 Å²	73	65.4 Å²	65.4	44%	0.442	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	19	-173.5	-141.5	0	0	0	0	113.3	Y270	Y270-V291 PolarHBondContact N-O 2.87Å
292	Y	88.9	Confident	89	Confident	19 Å²	19	62 Å²	62	8%	0.075	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	133.4	-178.5	-74.6	-94.4	0	0	0	111.9	L267 H269 R272 D274 V276 L287 K290	L267-Y292 HydrophobicContact CB-CD1 4.13Å; H269-Y292 HydrophobicContact CB-CD1 3.94Å; H269-Y292 HydrophobicContact CB-CE1 3.6Å; H269-Y292 HydrophobicContact CB-CE2 4.49Å; H269-Y292 HydrophobicContact CB-CG 4.5Å; H269-Y292 AromaticContact CD2-CE2 3.83Å; H269-Y292 AromaticContact CD2-CZ 3.81Å; R272-Y292 PolarHBondContact NH2-OH 3Å; D274-Y292 PolarHBondContact OD2-OH 3.47Å; V276-Y292 HydrophobicContact CB-CE1 4.31Å; V276-Y292 HydrophobicContact CG2-CD1 4.39Å; V276-Y292 HydrophobicContact CG2-CE1 3.59Å; L287-Y292 HydrophobicContact CB-CD2 4.31Å; L287-Y292 HydrophobicContact CB-CG 4.35Å; L287-Y292 HydrophobicContact CD2-CD2 3.8Å; L287-Y292 HydrophobicContact CD2-CE2 3.88Å; L287-Y292 HydrophobicContact CD2-CG 4.45Å; K290-Y292 VanDerWaalsContact C-N 3.33Å; K290-Y292 PolarHBondContact O-N 2.93Å
293	E	90.2	Very high	88.9	Confident	91 Å²	91	60.5 Å²	60.5	43%	0.425	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	122.9	172.5	-166.7	-166.8	151.9	0	0	109.1	L267 V268 K295	L267-E293 WeakPolarHBondContact CA-O 3.44Å; V268-E293 PolarHBondContact N-O 2.95Å; V268-E293 PolarHBondContact O-N 2.69Å; E293-K295 VanDerWaalsContact CD-CE 3.5Å; E293-K295 PolarHBondContact O-N 3.1Å; E293-K295 IonicContact OE1-NZ 3.82Å; E293-K295 PolarHBondContact OE1-NZ 3.45Å; E293-K295 WeakPolarHBondContact OE2-CE 3.45Å; E293-K295 IonicContact OE2-NZ 2.88Å; E293-K295 PolarHBondContact OE2-NZ 2.88Å
294	D	91	Very high	88.8	Confident	50 Å²	50	61.8 Å²	61.8	27%	0.267	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	124.9	172.4	-173.6	3.3	0	0	0	110.2	L267 R284 M288 G296	L267-D294 HydrophobicContact CD2-CB 4.39Å; R284-D294 WeakPolarHBondContact CD-OD2 3.48Å; M288-D294 HydrophobicContact CG-CB 4.03Å; M288-D294 HydrophobicContact SD-CB 3.63Å; D294-G296 WeakPolarHBondContact OD1-CA 3.39Å; D294-G296 PolarHBondContact OD1-N 2.67Å
295	K	90.8	Very high	88.5	Confident	80 Å²	80	62.9 Å²	62.9	35%	0.348	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	11.6	177.6	-59.2	-61.2	-178.2	177.7	0	112.2	R266 V268 E293	R266-K295 HydrophobicContact CG-CB 4.36Å; R266-K295 WeakPolarHBondContact O-CA 3.36Å; R266-K295 WeakPolarHBondContact O-CB 3.45Å; R266-K295 PolarHBondContact O-N 3.42Å; V268-K295 HydrophobicContact CB-CG 4.15Å; V268-K295 HydrophobicContact CG2-CG 3.65Å; E293-K295 VanDerWaalsContact CD-CE 3.5Å; E293-K295 PolarHBondContact O-N 3.1Å; E293-K295 IonicContact OE1-NZ 3.82Å; E293-K295 PolarHBondContact OE1-NZ 3.45Å; E293-K295 WeakPolarHBondContact OE2-CE 3.45Å; E293-K295 IonicContact OE2-NZ 2.88Å; E293-K295 PolarHBondContact OE2-NZ 2.88Å
296	G	88.2	Confident	87.8	Confident	31 Å²	31	62.3 Å²	62.3	32%	0.32	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	83.3	-167.2	179.2	0	0	0	0	0	113.5	R266 D294 F298	R266-G296 PolarHBondContact N-O 2.87Å; D294-G296 WeakPolarHBondContact OD1-CA 3.39Å; D294-G296 PolarHBondContact OD1-N 2.67Å; G296-F298 PolarHBondContact O-N 2.72Å
297	I	88.9	Confident	86.8	Confident	76 Å²	76	60.5 Å²	60.5	39%	0.39	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	122.9	178.3	-60.2	167.7	0	0	0	109.1	P263 Y265 G299 Y300	P263-I297 HydrophobicContact CB-CD1 4.11Å; P263-I297 HydrophobicContact CB-CG1 4.14Å; P263-I297 HydrophobicContact CB-CG2 4.2Å; Y265-I297 HydrophobicContact CD1-CG1 4.15Å; Y265-I297 HydrophobicContact CE1-CG1 4Å; I297-G299 VanDerWaalsContact CG2-O 3.22Å; I297-G299 WeakPolarHBondContact CG2-O 3.32Å; I297-Y300 HydrophobicContact CG2-CD2 4.1Å; I297-Y300 HydrophobicContact CG2-CE2 3.68Å
298	F	90.8	Very high	85.9	Confident	7 Å²	7	64.8 Å²	64.8	3%	0.031	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	-36.9	176.2	-165.4	-124.2	0	0	0	112.3	L264 R266 L277 G296 A366 V381 I410	L264-F298 HydrophobicContact CD2-CD1 4.03Å; L264-F298 HydrophobicContact CG-CB 4.45Å; L264-F298 WeakPolarHBondContact O-CA 3.4Å; L264-F298 WeakPolarHBondContact O-CB 3.04Å; L264-F298 PolarHBondContact O-N 2.91Å; R266-F298 HydrophobicContact CB-CB 3.96Å; R266-F298 HydrophobicContact CB-CD2 3.84Å; R266-F298 HydrophobicContact CB-CG 4.2Å; R266-F298 HydrophobicContact CG-CD2 4.18Å; L277-F298 HydrophobicContact CD1-CD1 3.98Å; L277-F298 HydrophobicContact CD1-CE1 3.83Å; L277-F298 HydrophobicContact CD2-CB 4.29Å; L277-F298 HydrophobicContact CD2-CD1 3.84Å; L277-F298 HydrophobicContact CD2-CD2 4.15Å; L277-F298 HydrophobicContact CD2-CE1 4.18Å; L277-F298 HydrophobicContact CD2-CE2 4.45Å; L277-F298 HydrophobicContact CD2-CG 3.84Å; L277-F298 HydrophobicContact CD2-CZ 4.49Å; G296-F298 PolarHBondContact O-N 2.72Å; F298-A366 HydrophobicContact CE1-CB 3.65Å; F298-A366 HydrophobicContact CZ-CB 3.67Å; F298-V381 HydrophobicContact CD2-CG1 4.39Å; F298-V381 HydrophobicContact CE1-CG1 4.23Å; F298-V381 HydrophobicContact CE2-CG1 4.08Å; F298-V381 HydrophobicContact CZ-CG1 3.97Å; F298-V381 WeakPolarHBondContact O-CG1 3.42Å; F298-I410 HydrophobicContact CD1-CD1 3.55Å; F298-I410 HydrophobicContact CE1-CD1 3.42Å; F298-I410 VanDerWaalsContact CE1-CD1 3.42Å
299	G	87.8	Confident	85	Confident	3 Å²	3	62.4 Å²	62.4	3%	0.031	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.9	-170.2	-177.2	0	0	0	0	0	108.4	L264 I297	L264-G299 PolarHBondContact N-O 3.42Å; I297-G299 VanDerWaalsContact CG2-O 3.22Å; I297-G299 WeakPolarHBondContact CG2-O 3.32Å
300	Y	89.4	Confident	84.6	Confident	38 Å²	38	53.7 Å²	53.7	15%	0.149	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	152	175.1	-68.6	-111.7	0	0	0	109.2	L261 I262 P263 I297 I410 S411 R413	L261-Y300 HydrophobicContact CB-CD1 4.35Å; I262-Y300 VanDerWaalsContact O-CA 3.31Å; I262-Y300 WeakPolarHBondContact O-CA 3.37Å; P263-Y300 HydrophobicContact CB-CD1 4.34Å; P263-Y300 HydrophobicContact CB-CE1 4Å; I297-Y300 HydrophobicContact CG2-CD2 4.1Å; I297-Y300 HydrophobicContact CG2-CE2 3.68Å; Y300-I410 WeakPolarHBondContact O-CG2 3.41Å; Y300-S411 CarbonylContact C-O 3.52Å; Y300-S411 WeakPolarHBondContact CB-O 3.3Å; Y300-S411 CarbonylContact O-C 3.54Å; Y300-S411 PolarHBondContact O-N 3.1Å; Y300-S411 VanDerWaalsContact O-N 3.08Å; Y300-R413 WeakPolarHBondContact CE2-O 3.19Å; Y300-R413 VanDerWaalsContact CZ-O 3.31Å; Y300-R413 PolarHBondContact OH-O 2.85Å
301	I	91.7	Very high	84.5	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	154.1	178.5	61.3	179.1	0	0	0	108.7	L261 I262 L264 T279 L316 L350 Y352 V353 I410	L261-I301 WeakPolarHBondContact CA-O 3.46Å; I262-I301 HydrophobicContact CG1-CG1 4.06Å; I262-I301 WeakPolarHBondContact CG1-O 3.33Å; I262-I301 PolarHBondContact N-O 2.8Å; I262-I301 PolarHBondContact O-N 2.73Å; L264-I301 HydrophobicContact CB-CD1 4.47Å; L264-I301 HydrophobicContact CD1-CD1 4.18Å; L264-I301 HydrophobicContact CD2-CD1 4.37Å; L264-I301 HydrophobicContact CD2-CG2 4.11Å; T279-I301 HydrophobicContact CG2-CD1 3.77Å; T279-I301 HydrophobicContact CG2-CG1 4.18Å; I301-L316 HydrophobicContact CD1-CD2 4.46Å; I301-L350 HydrophobicContact CD1-CB 4.14Å; I301-L350 WeakPolarHBondContact CD1-O 3.39Å; I301-Y352 WeakPolarHBondContact CB-O 3.4Å; I301-V353 HydrophobicContact CB-CG1 4.41Å; I301-V353 HydrophobicContact CG2-CG1 3.56Å; I301-I410 HydrophobicContact CG2-CG2 3.98Å
302	A	90.6	Very high	84.3	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	136.1	175.7	0	0	0	0	0	109.6	P258 L261 L313 G351 Y352	P258-A302 HydrophobicContact CB-CB 3.87Å; P258-A302 HydrophobicContact CG-CB 4.16Å; L261-A302 HydrophobicContact CD2-CB 4.36Å; A302-L313 HydrophobicContact CB-CD1 4.04Å; A302-L313 HydrophobicContact CB-CD2 3.89Å; A302-G351 CarbonylContact O-C 3.38Å; A302-G351 VanDerWaalsContact O-CA 3.32Å; A302-G351 WeakPolarHBondContact O-CA 3.5Å; A302-Y352 PolarHBondContact N-O 2.88Å; A302-Y352 PolarHBondContact O-N 2.82Å
303	E	90.4	Very high	84.1	Confident	118 Å²	118	55.7 Å²	55.7	55%	0.551	29%	0.286	S	S	*	.	S	Bend	trans	-69.1	-35	-178.3	-178.1	165.3	-137.3	0	0	112.6	N260 I262	N260-E303 HydrophobicContact CB-CB 4.48Å; N260-E303 PolarHBondContact ND2-N 2.91Å; N260-E303 PolarHBondContact O-N 3.26Å; I262-E303 HydrophobicContact CD1-CB 3.88Å; I262-E303 HydrophobicContact CD1-CG 4.01Å; I262-E303 HydrophobicContact CG1-CB 4.1Å; I262-E303 HydrophobicContact CG2-CB 3.99Å; I262-E303 HydrophobicContact CG2-CG 4.37Å
304	N	86.7	Confident	84	Confident	76 Å²	76	53.2 Å²	53.2	41%	0.406	28%	0.277	S	S	.	.	S	Bend	trans	-132.1	164	179.8	66.8	48.4	0	0	0	111.4	N260 N306	N260-N304 PolarHBondContact ND2-N 3.4Å; N260-N304 VanDerWaalsContact ND2-N 3.1Å; N260-N304 PolarHBondContact ND2-ND2 3.47Å; N260-N304 PolarHBondContact ND2-O 3.34Å; N260-N304 PolarHBondContact ND2-OD1 3.4Å; N304-N306 PolarHBondContact O-N 2.88Å; N304-N306 VanDerWaalsContact OD1-CB 3.27Å; N304-N306 WeakPolarHBondContact OD1-CB 3.35Å; N304-N306 PolarHBondContact OD1-N 2.84Å; N304-N306 VanDerWaalsContact OD1-N 3.13Å
305	N	83.4	Confident	83.9	Confident	74 Å²	74	52.1 Å²	52.1	40%	0.396	27%	0.273	S	S	.	.			trans	-81	56.2	177.9	-164.1	12.2	0	0	0	111.9	T307 L313 Y352	N305-T307 VanDerWaalsContact C-N 3.28Å; N305-T307 PolarHBondContact O-N 3.08Å; N305-L313 WeakPolarHBondContact OD1-CB 3.46Å; N305-Y352 HydrophobicContact CB-CD1 3.84Å; N305-Y352 HydrophobicContact CB-CD2 4.33Å; N305-Y352 HydrophobicContact CB-CE1 3.59Å; N305-Y352 HydrophobicContact CB-CE2 4.09Å; N305-Y352 HydrophobicContact CB-CG 4.24Å
306	N	75.7	Confident	84.1	Confident	51 Å²	51	48.5 Å²	48.5	27%	0.273	26%	0.257	S	S	.	.			trans	-72.9	88.4	174.4	-173.2	21.2	0	0	0	110.2	N304 T308 D309 C310	N304-N306 PolarHBondContact O-N 2.88Å; N304-N306 VanDerWaalsContact OD1-CB 3.27Å; N304-N306 WeakPolarHBondContact OD1-CB 3.35Å; N304-N306 PolarHBondContact OD1-N 2.84Å; N304-N306 VanDerWaalsContact OD1-N 3.13Å; N306-T308 PolarHBondContact ND2-OG1 2.84Å; N306-T308 PolarHBondContact O-N 2.92Å; N306-T308 VanDerWaalsContact O-N 3.16Å; N306-T308 PolarHBondContact OD1-N 2.84Å; N306-T308 PolarHBondContact OD1-OG1 2.84Å; N306-D309 PolarHBondContact ND2-OD1 3.49Å; N306-D309 PolarHBondContact O-N 3.15Å; N306-C310 PolarHBondContact O-N 2.81Å
307	T	68.1	Low	84.2	Confident	64 Å²	64	47.2 Å²	47.2	39%	0.393	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-16.3	179.9	54.5	0	0	0	0	113.1	N305 C310 H311	N305-T307 VanDerWaalsContact C-N 3.28Å; N305-T307 PolarHBondContact O-N 3.08Å; T307-C310 CarbonylContact O-C 3.51Å; T307-C310 PolarHBondContact O-N 3.48Å; T307-H311 PolarHBondContact O-CE1 2.84Å; T307-H311 PolarHBondContact O-N 2.93Å; T307-H311 PolarHBondContact O-ND1 3Å; T307-H311 VanDerWaalsContact O-ND1 3.12Å
308	T	68.4	Low	84.4	Confident	111 Å²	111	43.8 Å²	43.8	68%	0.681	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70	-34.4	174.8	63.2	0	0	0	0	113	N306	N306-T308 PolarHBondContact ND2-OG1 2.84Å; N306-T308 PolarHBondContact O-N 2.92Å; N306-T308 VanDerWaalsContact O-N 3.16Å; N306-T308 PolarHBondContact OD1-N 2.84Å; N306-T308 PolarHBondContact OD1-OG1 2.84Å
309	D	68.3	Low	84.4	Confident	30 Å²	30	43.5 Å²	43.5	16%	0.16	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-42.2	171.2	-66.9	11.1	0	0	0	110	E256 P258 T259 N306	E256-D309 CarbonylContact C-O 3.5Å; E256-D309 WeakPolarHBondContact CA-O 3.39Å; E256-D309 PolarHBondContact N-O 3.12Å; P258-D309 WeakPolarHBondContact CA-OD2 3.3Å; T259-D309 PolarHBondContact N-OD2 3.47Å; T259-D309 PolarHBondContact OG1-OD2 2.9Å; N306-D309 PolarHBondContact ND2-OD1 3.49Å; N306-D309 PolarHBondContact O-N 3.15Å
310	C	78.1	Confident	84.6	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.235	C	C	.	.			trans	-154.5	104.5	-167.9	174.7	0	0	0	0	113.4	P258 N306 T307 Y312 L313 C360	P258-C310 HydrophobicContact CG-CB 3.95Å; N306-C310 PolarHBondContact O-N 2.81Å; T307-C310 CarbonylContact O-C 3.51Å; T307-C310 PolarHBondContact O-N 3.48Å; C310-Y312 PolarHBondContact O-N 2.61Å; C310-Y312 VanDerWaalsContact O-N 3.15Å; C310-L313 HydrophobicContact CB-CD1 4.26Å; C310-L313 HydrophobicContact CB-CD2 4.37Å; C310-L313 HydrophobicContact CB-CG 3.87Å; C310-L313 WeakPolarHBondContact O-CG 3.23Å; C310-L313 PolarHBondContact O-N 3Å; C310-C360 HydrophobicContact CB-CB 3.72Å; C310-C360 WeakPolarHBondContact CB-SG 3.45Å; C310-C360 WeakPolarHBondContact SG-CB 3.44Å; C310-C360 CovalentContact SG-SG 2.01Å; C310-C360 PolarHBondContact SG-SG 2.86Å
311	H	81.9	Confident	84.4	Confident	151 Å²	151	48 Å²	48	70%	0.699	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-9.2	173.8	-62.4	-62.4	0	0	0	114.9	T307	T307-H311 PolarHBondContact O-CE1 2.84Å; T307-H311 PolarHBondContact O-N 2.93Å; T307-H311 PolarHBondContact O-ND1 3Å; T307-H311 VanDerWaalsContact O-ND1 3.12Å
312	Y	81.1	Confident	83.8	Confident	102 Å²	102	51.5 Å²	51.5	40%	0.4	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	5.7	179.6	-62.4	-66.5	0	0	0	114	C310 T314 P355 H359	C310-Y312 PolarHBondContact O-N 2.61Å; C310-Y312 VanDerWaalsContact O-N 3.15Å; Y312-T314 PolarHBondContact O-OG1 2.81Å; Y312-P355 WeakPolarHBondContact O-CD 3.47Å; Y312-H359 AromaticContact CD1-CE1 3.74Å; Y312-H359 AromaticContact CD1-ND1 3.28Å; Y312-H359 VanDerWaalsContact CD1-ND1 3.28Å; Y312-H359 WeakPolarHBondContact CD1-ND1 3.43Å; Y312-H359 HydrophobicContact CD2-CB 3.9Å; Y312-H359 AromaticContact CD2-CG 3.96Å; Y312-H359 AromaticContact CD2-ND1 3.75Å; Y312-H359 AromaticContact CE1-CE1 3.74Å; Y312-H359 AromaticContact CE1-ND1 3.69Å; Y312-H359 HydrophobicContact CG-CB 4.05Å; Y312-H359 AromaticContact CG-CG 3.95Å; Y312-H359 AromaticContact CG-ND1 3.31Å; Y312-H359 VanDerWaalsContact CG-ND1 3.31Å
313	L	85.7	Confident	83	Confident	16 Å²	16	57 Å²	57	8%	0.084	30%	0.299	C	S	.	.			trans	-65.9	136.2	178.9	-72.4	-178.9	0	0	0	112	P258 A302 N305 C310 V353 V354	P258-L313 HydrophobicContact CG-CD2 4.08Å; A302-L313 HydrophobicContact CB-CD1 4.04Å; A302-L313 HydrophobicContact CB-CD2 3.89Å; N305-L313 WeakPolarHBondContact OD1-CB 3.46Å; C310-L313 HydrophobicContact CB-CD1 4.26Å; C310-L313 HydrophobicContact CB-CD2 4.37Å; C310-L313 HydrophobicContact CB-CG 3.87Å; C310-L313 WeakPolarHBondContact O-CG 3.23Å; C310-L313 PolarHBondContact O-N 3Å; L313-V353 CarbonylContact C-O 3.6Å; L313-V353 WeakPolarHBondContact CA-O 3.5Å; L313-V354 HydrophobicContact CD2-CG1 4.25Å
314	T	86.7	Confident	82.2	Confident	40 Å²	40	53.7 Å²	53.7	25%	0.245	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	131.9	-178.7	-25.1	0	0	0	0	109.9	Y312 L316 A331 Y352 V353	Y312-T314 PolarHBondContact O-OG1 2.81Å; T314-L316 PolarHBondContact O-N 3.3Å; T314-A331 WeakPolarHBondContact CG2-O 3.46Å; T314-Y352 WeakPolarHBondContact O-CA 3.14Å; T314-V353 PolarHBondContact N-O 3.35Å; T314-V353 WeakPolarHBondContact O-CG2 3.45Å; T314-V353 PolarHBondContact O-N 2.89Å
315	P	90.3	Very high	81.7	Confident	27 Å²	27	53.3 Å²	53.3	18%	0.175	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	128.1	-173.4	22.6	-33.3	0	0	0	113.2	T317 A331 E349 Y352	P315-T317 PolarHBondContact O-N 2.88Å; P315-A331 WeakPolarHBondContact O-CA 3.37Å; P315-E349 HydrophobicContact CB-CG 4.24Å; P315-Y352 HydrophobicContact CB-CD1 4Å; P315-Y352 HydrophobicContact CB-CE1 3.61Å; P315-Y352 HydrophobicContact CG-CE1 4.26Å
316	L	93.4	Very high	81.8	Confident	4 Å²	4	50.9 Å²	50.9	2%	0.021	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	93.2	172.6	-173.9	67.1	0	0	0	109.9	L264 I301 T314 V330 A331 L350 G351 V353 L408	L264-L316 HydrophobicContact CD2-CD2 3.96Å; I301-L316 HydrophobicContact CD1-CD2 4.46Å; T314-L316 PolarHBondContact O-N 3.3Å; L316-V330 CarbonylContact C-O 3.52Å; L316-A331 HydrophobicContact CD1-CB 4.38Å; L316-L350 HydrophobicContact CD2-CB 4.5Å; L316-L350 HydrophobicContact CD2-CD1 4.33Å; L316-L350 PolarHBondContact O-N 2.89Å; L316-G351 WeakPolarHBondContact CB-O 3.34Å; L316-G351 PolarHBondContact N-O 3.05Å; L316-V353 HydrophobicContact CB-CG1 4.16Å; L316-V353 HydrophobicContact CB-CG2 4.27Å; L316-V353 HydrophobicContact CD1-CG2 4.48Å; L316-V353 HydrophobicContact CD2-CG1 4.11Å; L316-L408 HydrophobicContact CD1-CD1 4.25Å
317	T	91.3	Very high	82.4	Confident	4 Å²	4	50.8 Å²	50.8	3%	0.025	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	133	178.7	-58.3	0	0	0	0	111.3	P315 L319 Y329 V330 K336 V346	P315-T317 PolarHBondContact O-N 2.88Å; T317-L319 HydrophobicContact CG2-CD1 4Å; T317-L319 HydrophobicContact CG2-CG 4.31Å; T317-Y329 WeakPolarHBondContact O-CA 3.3Å; T317-V330 PolarHBondContact N-O 3.38Å; T317-V330 PolarHBondContact O-N 3.08Å; T317-K336 HydrophobicContact CG2-CD 4.29Å; T317-K336 HydrophobicContact CG2-CG 4.46Å; T317-V346 HydrophobicContact CG2-CG1 3.89Å
318	A	92.7	Very high	83.5	Confident	4 Å²	4	47.7 Å²	47.7	3%	0.033	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	127.5	169	0	0	0	0	0	110.6	Y329 V347 G348 L350	A318-Y329 HydrophobicContact CB-CD1 3.67Å; A318-Y329 HydrophobicContact CB-CE1 3.5Å; A318-V347 HydrophobicContact CB-CB 4.33Å; A318-V347 WeakPolarHBondContact O-CB 3.28Å; A318-V347 PolarHBondContact O-N 2.92Å; A318-G348 PolarHBondContact N-O 2.87Å; A318-G348 PolarHBondContact O-N 2.71Å; A318-L350 HydrophobicContact CB-CD1 4.45Å; A318-L350 HydrophobicContact CB-CG 4.27Å
319	L	91.3	Very high	84.6	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	147.6	170.4	-53.9	93.4	0	0	0	110.4	T317 Y327 V328 V330 K336 E340 W344 D345 V346	T317-L319 HydrophobicContact CG2-CD1 4Å; T317-L319 HydrophobicContact CG2-CG 4.31Å; L319-Y327 CarbonylContact O-C 3.6Å; L319-Y327 VanDerWaalsContact O-CA 3.31Å; L319-Y327 WeakPolarHBondContact O-CA 3.36Å; L319-V328 HydrophobicContact CB-CG1 3.88Å; L319-V328 HydrophobicContact CD1-CG1 4.27Å; L319-V328 PolarHBondContact N-O 3.17Å; L319-V328 PolarHBondContact O-N 3.43Å; L319-V330 HydrophobicContact CD1-CG1 4.46Å; L319-V330 HydrophobicContact CD1-CG2 3.55Å; L319-K336 HydrophobicContact CD2-CG 4.48Å; L319-E340 HydrophobicContact CD2-CG 3.86Å; L319-W344 HydrophobicContact CB-CB 4.11Å; L319-W344 HydrophobicContact CD2-CB 4.31Å; L319-D345 CarbonylContact C-O 3.43Å; L319-D345 VanDerWaalsContact CA-O 3.24Å; L319-D345 WeakPolarHBondContact CA-O 3.36Å; L319-V346 HydrophobicContact CD2-CG2 3.74Å; L319-V346 HydrophobicContact CG-CG2 4.1Å
320	K	90.6	Very high	85.6	Confident	55 Å²	55	41.3 Å²	41.3	24%	0.239	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	146	-177.9	-179.8	-172.5	-179.8	-175.3	0	110.1	D325 Y326 Y327 W344 D345 V347	K320-D325 WeakPolarHBondContact CE-OD1 3.05Å; K320-D325 IonicContact NZ-OD1 3.92Å; K320-D325 PolarHBondContact NZ-OD1 2.86Å; K320-Y326 WeakPolarHBondContact CA-O 3.03Å; K320-Y327 HydrophobicContact CB-CD1 4.22Å; K320-Y327 HydrophobicContact CB-CE1 4.07Å; K320-Y327 HydrophobicContact CD-CE1 4.37Å; K320-Y327 HydrophobicContact CD-CE2 4.5Å; K320-Y327 HydrophobicContact CG-CE1 4.3Å; K320-Y327 HydrophobicContact CG-CE2 4.43Å; K320-W344 VanDerWaalsContact C-CE3 3.46Å; K320-W344 CarbonylContact O-C 3.53Å; K320-W344 WeakPolarHBondContact O-CA 3.29Å; K320-D345 PolarHBondContact N-O 2.79Å; K320-D345 PolarHBondContact O-N 2.82Å; K320-V347 HydrophobicContact CB-CG2 3.39Å
321	R	86.6	Confident	85.9	Confident	81 Å²	81	42.1 Å²	42.1	31%	0.306	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	131.2	172.3	-164.4	167.1	-174.7	-171.2	3.5	110.6	T323 V324 Y326 W344 N375	R321-T323 VanDerWaalsContact C-N 3.3Å; R321-T323 PolarHBondContact O-N 3.43Å; R321-V324 HydrophobicContact CB-CG2 3.93Å; R321-V324 HydrophobicContact CG-CG2 3.94Å; R321-V324 PolarHBondContact O-N 2.81Å; R321-Y326 PolarHBondContact N-O 2.82Å; R321-Y326 VanDerWaalsContact N-O 3.13Å; R321-W344 HydrophobicContact CB-CD2 4.19Å; R321-W344 HydrophobicContact CB-CE3 3.98Å; R321-W344 HydrophobicContact CB-CH2 4Å; R321-W344 HydrophobicContact CB-CZ2 4.24Å; R321-W344 HydrophobicContact CB-CZ3 3.88Å; R321-N375 PolarHBondContact NH1-ND2 2.66Å
322	P	78.5	Confident	85.5	Confident	73 Å²	73	36.8 Å²	36.8	47%	0.474	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-39.1	-174.8	-18.8	20.6	0	0	0	113.8	G343 D345	P322-G343 WeakPolarHBondContact CD-O 3.13Å; P322-D345 WeakPolarHBondContact CG-OD2 3.48Å
323	T	73.9	Confident	85.3	Confident	117 Å²	117	37 Å²	37	72%	0.718	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-10.2	-170.7	54.1	0	0	0	0	115	R321	R321-T323 VanDerWaalsContact C-N 3.3Å; R321-T323 PolarHBondContact O-N 3.43Å
324	V	74	Confident	84.7	Confident	48 Å²	48	43.1 Å²	43.1	29%	0.291	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	136.7	-174.5	-77.6	0	0	0	0	110.1	R321 Y326	R321-V324 HydrophobicContact CB-CG2 3.93Å; R321-V324 HydrophobicContact CG-CG2 3.94Å; R321-V324 PolarHBondContact O-N 2.81Å; V324-Y326 HydrophobicContact CB-CD2 3.87Å; V324-Y326 HydrophobicContact CB-CE2 3.85Å; V324-Y326 HydrophobicContact CB-CG 4.35Å; V324-Y326 HydrophobicContact CG1-CE2 4.24Å; V324-Y326 HydrophobicContact CG2-CD2 3.29Å; V324-Y326 HydrophobicContact CG2-CE2 3.57Å; V324-Y326 HydrophobicContact CG2-CG 4.03Å; V324-Y326 PolarHBondContact O-N 3.1Å
325	D	76	Confident	84.3	Confident	67 Å²	67	45 Å²	45	36%	0.358	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	66.3	174.9	-75.1	-21.5	0	0	0	112.1	R272 K320	R272-D325 PolarHBondContact NH2-O 2.88Å; K320-D325 WeakPolarHBondContact CE-OD1 3.05Å; K320-D325 IonicContact NZ-OD1 3.92Å; K320-D325 PolarHBondContact NZ-OD1 2.86Å
326	Y	85.2	Confident	83.9	Confident	23 Å²	23	46 Å²	46	9%	0.09	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	139.8	170.1	-59.6	-33.9	0	0	0	108.8	R272 D274 K320 R321 V324 W344 L374 Q376	R272-Y326 VanDerWaalsContact CZ-CE1 3.46Å; D274-Y326 HydrophobicContact CB-CD1 4.15Å; K320-Y326 WeakPolarHBondContact CA-O 3.03Å; R321-Y326 PolarHBondContact N-O 2.82Å; R321-Y326 VanDerWaalsContact N-O 3.13Å; V324-Y326 HydrophobicContact CB-CD2 3.87Å; V324-Y326 HydrophobicContact CB-CE2 3.85Å; V324-Y326 HydrophobicContact CB-CG 4.35Å; V324-Y326 HydrophobicContact CG1-CE2 4.24Å; V324-Y326 HydrophobicContact CG2-CD2 3.29Å; V324-Y326 HydrophobicContact CG2-CE2 3.57Å; V324-Y326 HydrophobicContact CG2-CG 4.03Å; V324-Y326 PolarHBondContact O-N 3.1Å; Y326-W344 WeakPolarHBondContact O-CZ3 3.45Å; Y326-L374 VanDerWaalsContact CE2-O 3.27Å; Y326-L374 WeakPolarHBondContact CE2-O 3.49Å; Y326-Q376 HydrophobicContact CD1-CG 4.04Å; Y326-Q376 HydrophobicContact CD2-CG 4.33Å; Y326-Q376 HydrophobicContact CE1-CG 3.6Å; Y326-Q376 HydrophobicContact CE2-CG 3.96Å; Y326-Q376 HydrophobicContact CG-CG 4.41Å; Y326-Q376 PolarHBondContact OH-NE2 3.07Å
327	Y	89.6	Confident	83.3	Confident	49 Å²	49	50 Å²	50	19%	0.192	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	146.1	-177	-70.6	-101.5	0	0	0	110.6	V276 L319 K320 Y329 V347 F377	V276-Y327 HydrophobicContact CG2-CD2 3.72Å; V276-Y327 HydrophobicContact CG2-CE2 4.08Å; V276-Y327 HydrophobicContact CG2-CG 4.41Å; L319-Y327 CarbonylContact O-C 3.6Å; L319-Y327 VanDerWaalsContact O-CA 3.31Å; L319-Y327 WeakPolarHBondContact O-CA 3.36Å; K320-Y327 HydrophobicContact CB-CD1 4.22Å; K320-Y327 HydrophobicContact CB-CE1 4.07Å; K320-Y327 HydrophobicContact CD-CE1 4.37Å; K320-Y327 HydrophobicContact CD-CE2 4.5Å; K320-Y327 HydrophobicContact CG-CE1 4.3Å; K320-Y327 HydrophobicContact CG-CE2 4.43Å; Y327-Y329 WeakPolarHBondContact CB-OH 3.34Å; Y327-V347 HydrophobicContact CD1-CG2 4.46Å; Y327-V347 HydrophobicContact CE1-CG1 4.49Å; Y327-V347 HydrophobicContact CE1-CG2 4.01Å; Y327-F377 WeakPolarHBondContact O-CD2 3.4Å
328	V	89.9	Confident	82.6	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	139.5	167.5	68.4	0	0	0	0	109	L319 V330 Y339 W344 F377	L319-V328 HydrophobicContact CB-CG1 3.88Å; L319-V328 HydrophobicContact CD1-CG1 4.27Å; L319-V328 PolarHBondContact N-O 3.17Å; L319-V328 PolarHBondContact O-N 3.43Å; V328-V330 HydrophobicContact CG2-CG1 4.47Å; V328-Y339 HydrophobicContact CG1-CD1 4.1Å; V328-Y339 HydrophobicContact CG1-CD2 4Å; V328-Y339 HydrophobicContact CG1-CE1 4.32Å; V328-Y339 HydrophobicContact CG1-CE2 4.21Å; V328-Y339 HydrophobicContact CG1-CG 3.97Å; V328-Y339 HydrophobicContact CG2-CD2 4.33Å; V328-Y339 HydrophobicContact CG2-CE1 4.32Å; V328-Y339 HydrophobicContact CG2-CE2 3.72Å; V328-W344 HydrophobicContact CB-CE3 4.44Å; V328-W344 HydrophobicContact CB-CZ3 4.16Å; V328-W344 HydrophobicContact CG1-CD2 4.22Å; V328-W344 HydrophobicContact CG1-CE3 3.71Å; V328-W344 HydrophobicContact CG1-CZ3 3.93Å; V328-F377 HydrophobicContact CB-CD2 3.88Å; V328-F377 HydrophobicContact CB-CE2 3.76Å; V328-F377 HydrophobicContact CB-CG 4.47Å; V328-F377 HydrophobicContact CB-CZ 4.24Å; V328-F377 HydrophobicContact CG2-CD1 4.29Å; V328-F377 HydrophobicContact CG2-CD2 4.1Å; V328-F377 HydrophobicContact CG2-CE1 4.05Å; V328-F377 HydrophobicContact CG2-CE2 3.88Å; V328-F377 HydrophobicContact CG2-CG 4.3Å; V328-F377 HydrophobicContact CG2-CZ 3.85Å
329	Y	91.8	Very high	82.2	Confident	2 Å²	2	53.7 Å²	53.7	1%	0.008	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	129.7	179	-54.4	-76.7	0	0	0	109.3	V276 L277 T317 A318 Y327 L350 Y379	V276-Y329 WeakPolarHBondContact CA-OH 3.36Å; L277-Y329 HydrophobicContact CB-CD1 4.44Å; L277-Y329 HydrophobicContact CB-CD2 4.15Å; L277-Y329 HydrophobicContact CB-CE1 4.08Å; L277-Y329 HydrophobicContact CB-CE2 3.79Å; L277-Y329 HydrophobicContact CB-CG 4.49Å; L277-Y329 HydrophobicContact CD1-CD2 3.72Å; L277-Y329 HydrophobicContact CD1-CE2 4.12Å; L277-Y329 HydrophobicContact CD1-CG 4.12Å; L277-Y329 HydrophobicContact CG-CD2 3.88Å; L277-Y329 HydrophobicContact CG-CE2 3.73Å; L277-Y329 VanDerWaalsContact N-CZ 3.32Å; L277-Y329 PolarHBondContact N-OH 2.96Å; L277-Y329 PolarHBondContact O-OH 3.03Å; L277-Y329 VanDerWaalsContact O-OH 3.13Å; T317-Y329 WeakPolarHBondContact O-CA 3.3Å; A318-Y329 HydrophobicContact CB-CD1 3.67Å; A318-Y329 HydrophobicContact CB-CE1 3.5Å; Y327-Y329 WeakPolarHBondContact CB-OH 3.34Å; Y329-L350 HydrophobicContact CD1-CD1 3.69Å; Y329-L350 HydrophobicContact CE1-CD1 3.65Å; Y329-Y379 HydrophobicContact CD2-CD2 4.08Å; Y329-Y379 HydrophobicContact CD2-CE1 4.23Å; Y329-Y379 AromaticContact CD2-CE2 3.55Å; Y329-Y379 HydrophobicContact CD2-CE2 3.55Å; Y329-Y379 AromaticContact CD2-CZ 3.64Å; Y329-Y379 HydrophobicContact CE2-CD2 4.38Å; Y329-Y379 HydrophobicContact CE2-CE2 4Å; Y329-Y379 PolarHBondContact N-OH 2.82Å
330	V	88.6	Confident	82	Confident	5 Å²	5	57.5 Å²	57.5	3%	0.03	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	145.2	-178	-60.8	0	0	0	0	110.5	L316 T317 L319 V328 F335 K336 Y339	L316-V330 CarbonylContact C-O 3.52Å; T317-V330 PolarHBondContact N-O 3.38Å; T317-V330 PolarHBondContact O-N 3.08Å; L319-V330 HydrophobicContact CD1-CG1 4.46Å; L319-V330 HydrophobicContact CD1-CG2 3.55Å; V328-V330 HydrophobicContact CG2-CG1 4.47Å; V330-F335 HydrophobicContact CB-CB 4.09Å; V330-F335 HydrophobicContact CG1-CB 3.86Å; V330-K336 HydrophobicContact CG2-CB 4.06Å; V330-Y339 HydrophobicContact CG1-CD2 3.75Å; V330-Y339 HydrophobicContact CG1-CE2 3.77Å
331	A	83.9	Confident	81.6	Confident	17 Å²	17	59.3 Å²	59.3	14%	0.14	32%	0.322	C	S	.	.	S	Bend	trans	-116.1	2.4	179	0	0	0	0	0	113.9	T314 P315 L316 V353 L408	T314-A331 WeakPolarHBondContact CG2-O 3.46Å; P315-A331 WeakPolarHBondContact O-CA 3.37Å; L316-A331 HydrophobicContact CD1-CB 4.38Å; A331-V353 HydrophobicContact CB-CG2 3.53Å; A331-L408 HydrophobicContact CB-CD2 3.74Å
332	A	75.2	Confident	81.4	Confident	39 Å²	39	60.8 Å²	60.8	32%	0.322	34%	0.337	S	S	.	.	S	Bend	trans	-129.6	134.6	178.2	0	0	0	0	0	109.6	E334 F335 K336	A332-E334 VanDerWaalsContact C-N 3.25Å; A332-E334 PolarHBondContact O-N 3.06Å; A332-F335 HydrophobicContact CB-CD2 4.11Å; A332-F335 PolarHBondContact O-N 3.39Å; A332-K336 PolarHBondContact O-N 3.33Å
333	D	75.6	Confident	81.7	Confident	105 Å²	105	59.4 Å²	59.4	56%	0.561	34%	0.335	S	S	*	.	H	α-helix	trans	-59.4	-35.4	-174.5	-65.7	-46.1	0	0	0	112.6	F335 K336 T337	D333-F335 PolarHBondContact O-N 2.88Å; D333-F335 VanDerWaalsContact O-N 3.16Å; D333-K336 WeakPolarHBondContact O-CA 3.34Å; D333-K336 WeakPolarHBondContact O-CB 3.26Å; D333-K336 PolarHBondContact O-N 3.46Å; D333-T337 PolarHBondContact O-N 2.9Å; D333-T337 PolarHBondContact O-OG1 2.96Å; D333-T337 VanDerWaalsContact O-OG1 3.12Å
334	E	74.1	Confident	82.4	Confident	145 Å²	145	54.4 Å²	54.4	68%	0.678	30%	0.303	S	S	*	.	H	α-helix	trans	-49.9	-41.8	172.9	-64.2	175.4	-164.5	0	0	112.4	A332 V338	A332-E334 VanDerWaalsContact C-N 3.25Å; A332-E334 PolarHBondContact O-N 3.06Å; E334-V338 VanDerWaalsContact O-CG2 3.23Å; E334-V338 WeakPolarHBondContact O-CG2 3.23Å; E334-V338 PolarHBondContact O-N 2.9Å
335	F	77.1	Confident	83.2	Confident	79 Å²	79	56.2 Å²	56.2	35%	0.346	31%	0.311	S	S	.	.	H	α-helix	trans	-80.2	-28.3	178.5	-65.5	-52.2	0	0	0	113.2	V330 A332 D333 V338 Y339	V330-F335 HydrophobicContact CB-CB 4.09Å; V330-F335 HydrophobicContact CG1-CB 3.86Å; A332-F335 HydrophobicContact CB-CD2 4.11Å; A332-F335 PolarHBondContact O-N 3.39Å; D333-F335 PolarHBondContact O-N 2.88Å; D333-F335 VanDerWaalsContact O-N 3.16Å; F335-V338 PolarHBondContact O-N 3.47Å; F335-Y339 WeakPolarHBondContact O-CD2 3.45Å; F335-Y339 PolarHBondContact O-N 2.84Å
336	K	83	Confident	83.9	Confident	50 Å²	50	56 Å²	56	22%	0.217	31%	0.312	C	S	.	.	H	α-helix	trans	-62	-54.3	173.8	-177.5	-175.3	169.7	-177.4	0	109.5	T317 L319 V330 A332 D333 V338 Y339 E340	T317-K336 HydrophobicContact CG2-CD 4.29Å; T317-K336 HydrophobicContact CG2-CG 4.46Å; L319-K336 HydrophobicContact CD2-CG 4.48Å; V330-K336 HydrophobicContact CG2-CB 4.06Å; A332-K336 PolarHBondContact O-N 3.33Å; D333-K336 WeakPolarHBondContact O-CA 3.34Å; D333-K336 WeakPolarHBondContact O-CB 3.26Å; D333-K336 PolarHBondContact O-N 3.46Å; K336-V338 VanDerWaalsContact C-N 3.27Å; K336-V338 PolarHBondContact O-N 3.43Å; K336-Y339 PolarHBondContact O-N 3.13Å; K336-E340 WeakPolarHBondContact CE-OE1 3.32Å; K336-E340 HydrophobicContact CG-CG 4.47Å; K336-E340 WeakPolarHBondContact O-CG 3.2Å; K336-E340 PolarHBondContact O-N 2.87Å
337	T	81.1	Confident	84	Confident	86 Å²	86	58.9 Å²	58.9	53%	0.528	33%	0.332	S	S	.	.	H	α-helix	trans	-55.9	-39.9	176.2	-48.7	0	0	0	0	112.4	D333 E340 S341	D333-T337 PolarHBondContact O-N 2.9Å; D333-T337 PolarHBondContact O-OG1 2.96Å; D333-T337 VanDerWaalsContact O-OG1 3.12Å; T337-E340 WeakPolarHBondContact CA-OE2 3.48Å; T337-S341 WeakPolarHBondContact O-CB 3.39Å; T337-S341 PolarHBondContact O-N 2.8Å; T337-S341 PolarHBondContact O-OG 2.81Å
338	V	76.8	Confident	84	Confident	69 Å²	69	57.9 Å²	57.9	42%	0.418	34%	0.337	S	S	.	.	H	α-helix	trans	-67.3	-35.6	175.8	168.3	0	0	0	0	112.8	E334 F335 K336 S341 N342	E334-V338 VanDerWaalsContact O-CG2 3.23Å; E334-V338 WeakPolarHBondContact O-CG2 3.23Å; E334-V338 PolarHBondContact O-N 2.9Å; F335-V338 PolarHBondContact O-N 3.47Å; K336-V338 VanDerWaalsContact C-N 3.27Å; K336-V338 PolarHBondContact O-N 3.43Å; V338-S341 WeakPolarHBondContact CA-OG 3.26Å; V338-S341 PolarHBondContact O-OG 3.33Å; V338-S341 VanDerWaalsContact O-OG 3.12Å; V338-N342 WeakPolarHBondContact O-CB 3.35Å; V338-N342 PolarHBondContact O-N 2.84Å; V338-N342 PolarHBondContact O-ND2 2.9Å
339	Y	83.4	Confident	84.1	Confident	18 Å²	18	62.6 Å²	62.6	7%	0.071	36%	0.359	C	S	.	.	H	α-helix	trans	-78.5	-39	175.8	-78.6	-65.9	0	0	0	112.2	V328 V330 F335 K336 N342 G343 W344 F377	V328-Y339 HydrophobicContact CG1-CD1 4.1Å; V328-Y339 HydrophobicContact CG1-CD2 4Å; V328-Y339 HydrophobicContact CG1-CE1 4.32Å; V328-Y339 HydrophobicContact CG1-CE2 4.21Å; V328-Y339 HydrophobicContact CG1-CG 3.97Å; V328-Y339 HydrophobicContact CG2-CD2 4.33Å; V328-Y339 HydrophobicContact CG2-CE1 4.32Å; V328-Y339 HydrophobicContact CG2-CE2 3.72Å; V330-Y339 HydrophobicContact CG1-CD2 3.75Å; V330-Y339 HydrophobicContact CG1-CE2 3.77Å; F335-Y339 WeakPolarHBondContact O-CD2 3.45Å; F335-Y339 PolarHBondContact O-N 2.84Å; K336-Y339 PolarHBondContact O-N 3.13Å; Y339-N342 CarbonylContact O-C 3.57Å; Y339-N342 WeakPolarHBondContact O-CA 3.05Å; Y339-N342 PolarHBondContact O-N 3.17Å; Y339-G343 PolarHBondContact O-N 2.81Å; Y339-W344 AromaticContact CD1-CD1 3.92Å; Y339-W344 HydrophobicContact CD1-CD2 4.31Å; Y339-W344 HydrophobicContact CD1-CG 4.22Å; Y339-W344 AromaticContact CD1-NE1 3.84Å; Y339-W344 WeakPolarHBondContact O-CB 3.3Å; Y339-W344 VanDerWaalsContact O-CD1 3.28Å; Y339-W344 PolarHBondContact O-N 3.04Å; Y339-W344 VanDerWaalsContact O-N 3.16Å; Y339-F377 HydrophobicContact CE1-CZ 4.11Å
340	E	86.3	Confident	84.1	Confident	79 Å²	79	63.8 Å²	63.8	37%	0.369	37%	0.365	S	S	.	.	H	α-helix	trans	-57.4	-50.6	174.1	-71.3	168.1	145.1	0	0	111.2	L319 K336 T337 N342 G343 V346	L319-E340 HydrophobicContact CD2-CG 3.86Å; K336-E340 WeakPolarHBondContact CE-OE1 3.32Å; K336-E340 HydrophobicContact CG-CG 4.47Å; K336-E340 WeakPolarHBondContact O-CG 3.2Å; K336-E340 PolarHBondContact O-N 2.87Å; T337-E340 WeakPolarHBondContact CA-OE2 3.48Å; E340-N342 PolarHBondContact O-N 2.81Å; E340-N342 VanDerWaalsContact O-N 3.1Å; E340-G343 PolarHBondContact O-N 2.76Å; E340-V346 HydrophobicContact CG-CG2 3.92Å; E340-V346 WeakPolarHBondContact OE1-CG2 3.41Å
341	S	83.1	Confident	84.2	Confident	93 Å²	93	63.8 Å²	63.8	65%	0.65	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-17.1	175.1	55.6	0	0	0	0	114.6	T337 V338	T337-S341 WeakPolarHBondContact O-CB 3.39Å; T337-S341 PolarHBondContact O-N 2.8Å; T337-S341 PolarHBondContact O-OG 2.81Å; V338-S341 WeakPolarHBondContact CA-OG 3.26Å; V338-S341 PolarHBondContact O-OG 3.33Å; V338-S341 VanDerWaalsContact O-OG 3.12Å
342	N	81.3	Confident	84.6	Confident	113 Å²	113	64.9 Å²	64.9	60%	0.604	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	18.1	174.3	-79.9	-74.1	0	0	0	113.2	V338 Y339 E340	V338-N342 WeakPolarHBondContact O-CB 3.35Å; V338-N342 PolarHBondContact O-N 2.84Å; V338-N342 PolarHBondContact O-ND2 2.9Å; Y339-N342 CarbonylContact O-C 3.57Å; Y339-N342 WeakPolarHBondContact O-CA 3.05Å; Y339-N342 PolarHBondContact O-N 3.17Å; E340-N342 PolarHBondContact O-N 2.81Å; E340-N342 VanDerWaalsContact O-N 3.1Å
343	G	85.3	Confident	85.3	Confident	43 Å²	43	63.1 Å²	63.1	44%	0.443	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.2	43	173.6	0	0	0	0	0	113.8	P322 Y339 E340	P322-G343 WeakPolarHBondContact CD-O 3.13Å; Y339-G343 PolarHBondContact O-N 2.81Å; E340-G343 PolarHBondContact O-N 2.76Å
344	W	89.7	Confident	85.8	Confident	12 Å²	12	58.1 Å²	58.1	5%	0.045	33%	0.325	C	S	.	.			trans	-109.1	131.9	167.6	-66.4	68.3	0	0	0	110.1	L319 K320 R321 Y326 V328 Y339 N375 F377	L319-W344 HydrophobicContact CB-CB 4.11Å; L319-W344 HydrophobicContact CD2-CB 4.31Å; K320-W344 VanDerWaalsContact C-CE3 3.46Å; K320-W344 CarbonylContact O-C 3.53Å; K320-W344 WeakPolarHBondContact O-CA 3.29Å; R321-W344 HydrophobicContact CB-CD2 4.19Å; R321-W344 HydrophobicContact CB-CE3 3.98Å; R321-W344 HydrophobicContact CB-CH2 4Å; R321-W344 HydrophobicContact CB-CZ2 4.24Å; R321-W344 HydrophobicContact CB-CZ3 3.88Å; Y326-W344 WeakPolarHBondContact O-CZ3 3.45Å; V328-W344 HydrophobicContact CB-CE3 4.44Å; V328-W344 HydrophobicContact CB-CZ3 4.16Å; V328-W344 HydrophobicContact CG1-CD2 4.22Å; V328-W344 HydrophobicContact CG1-CE3 3.71Å; V328-W344 HydrophobicContact CG1-CZ3 3.93Å; Y339-W344 AromaticContact CD1-CD1 3.92Å; Y339-W344 HydrophobicContact CD1-CD2 4.31Å; Y339-W344 HydrophobicContact CD1-CG 4.22Å; Y339-W344 AromaticContact CD1-NE1 3.84Å; Y339-W344 WeakPolarHBondContact O-CB 3.3Å; Y339-W344 VanDerWaalsContact O-CD1 3.28Å; Y339-W344 PolarHBondContact O-N 3.04Å; Y339-W344 VanDerWaalsContact O-N 3.16Å; W344-N375 HydrophobicContact CZ2-CB 4.09Å; W344-F377 HydrophobicContact CH2-CD2 4.22Å; W344-F377 AromaticContact CH2-CE2 3.65Å; W344-F377 HydrophobicContact CH2-CE2 3.65Å; W344-F377 AromaticContact CZ2-CE2 4Å; W344-F377 HydrophobicContact CZ2-CE2 4Å; W344-F377 HydrophobicContact CZ3-CE2 4.4Å
345	D	90.8	Very high	85.6	Confident	86 Å²	86	54.6 Å²	54.6	46%	0.46	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	132.2	177.8	-52.1	-40.5	0	0	0	109.8	L319 K320 P322 V347	L319-D345 CarbonylContact C-O 3.43Å; L319-D345 VanDerWaalsContact CA-O 3.24Å; L319-D345 WeakPolarHBondContact CA-O 3.36Å; K320-D345 PolarHBondContact N-O 2.79Å; K320-D345 PolarHBondContact O-N 2.82Å; P322-D345 WeakPolarHBondContact CG-OD2 3.48Å; D345-V347 PolarHBondContact O-N 2.85Å
346	V	90.1	Very high	85	Confident	63 Å²	63	52.8 Å²	52.8	38%	0.382	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	126.2	169	176.7	0	0	0	0	109.5	T317 L319 E340	T317-V346 HydrophobicContact CG2-CG1 3.89Å; L319-V346 HydrophobicContact CD2-CG2 3.74Å; L319-V346 HydrophobicContact CG-CG2 4.1Å; E340-V346 HydrophobicContact CG-CG2 3.92Å; E340-V346 WeakPolarHBondContact OE1-CG2 3.41Å
347	V	87.6	Confident	84.3	Confident	83 Å²	83	56 Å²	56	50%	0.503	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	-33.9	177.2	-176.5	0	0	0	0	111.2	A318 K320 Y327 D345	A318-V347 HydrophobicContact CB-CB 4.33Å; A318-V347 WeakPolarHBondContact O-CB 3.28Å; A318-V347 PolarHBondContact O-N 2.92Å; K320-V347 HydrophobicContact CB-CG2 3.39Å; Y327-V347 HydrophobicContact CD1-CG2 4.46Å; Y327-V347 HydrophobicContact CE1-CG1 4.49Å; Y327-V347 HydrophobicContact CE1-CG2 4.01Å; D345-V347 PolarHBondContact O-N 2.85Å
348	G	89	Confident	83.5	Confident	29 Å²	29	54 Å²	54	30%	0.299	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	146.1	173.4	179.6	0	0	0	0	0	112.8	A318	A318-G348 PolarHBondContact N-O 2.87Å; A318-G348 PolarHBondContact O-N 2.71Å
349	E	91.8	Very high	83.6	Confident	99 Å²	99	53.1 Å²	53.1	46%	0.463	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	138.9	172.7	-64.9	179.5	-169.4	0	0	110.1	P315 Y352	P315-E349 HydrophobicContact CB-CG 4.24Å; E349-Y352 PolarHBondContact OE2-OH 2.8Å
350	L	91.9	Very high	83.4	Confident	27 Å²	27	52.2 Å²	52.2	14%	0.141	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	-17.7	178	-65.6	-178.1	0	0	0	113.5	L264 L277 T279 I301 L316 A318 Y329	L264-L350 HydrophobicContact CD1-CD1 4Å; L277-L350 HydrophobicContact CB-CD1 4.34Å; T279-L350 WeakPolarHBondContact CG2-O 3.29Å; T279-L350 PolarHBondContact OG1-O 3.45Å; I301-L350 HydrophobicContact CD1-CB 4.14Å; I301-L350 WeakPolarHBondContact CD1-O 3.39Å; L316-L350 HydrophobicContact CD2-CB 4.5Å; L316-L350 HydrophobicContact CD2-CD1 4.33Å; L316-L350 PolarHBondContact O-N 2.89Å; A318-L350 HydrophobicContact CB-CD1 4.45Å; A318-L350 HydrophobicContact CB-CG 4.27Å; Y329-L350 HydrophobicContact CD1-CD1 3.69Å; Y329-L350 HydrophobicContact CE1-CD1 3.65Å
351	G	91.9	Very high	82.8	Confident	4 Å²	4	52 Å²	52	4%	0.041	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	137.7	-168.5	-167.4	0	0	0	0	0	110.3	A302 L316	A302-G351 CarbonylContact O-C 3.38Å; A302-G351 VanDerWaalsContact O-CA 3.32Å; A302-G351 WeakPolarHBondContact O-CA 3.5Å; L316-G351 WeakPolarHBondContact CB-O 3.34Å; L316-G351 PolarHBondContact N-O 3.05Å
352	Y	91.6	Very high	82.3	Confident	41 Å²	41	47.8 Å²	47.8	16%	0.161	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	134.4	-169.9	-59	-94.9	0	0	0	112.3	I301 A302 N305 T314 P315 E349	I301-Y352 WeakPolarHBondContact CB-O 3.4Å; A302-Y352 PolarHBondContact N-O 2.88Å; A302-Y352 PolarHBondContact O-N 2.82Å; N305-Y352 HydrophobicContact CB-CD1 3.84Å; N305-Y352 HydrophobicContact CB-CD2 4.33Å; N305-Y352 HydrophobicContact CB-CE1 3.59Å; N305-Y352 HydrophobicContact CB-CE2 4.09Å; N305-Y352 HydrophobicContact CB-CG 4.24Å; T314-Y352 WeakPolarHBondContact O-CA 3.14Å; P315-Y352 HydrophobicContact CB-CD1 4Å; P315-Y352 HydrophobicContact CB-CE1 3.61Å; P315-Y352 HydrophobicContact CG-CE1 4.26Å; E349-Y352 PolarHBondContact OE2-OH 2.8Å
353	V	90.8	Very high	81.7	Confident	1 Å²	1	45.9 Å²	45.9	1%	0.006	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	-177.6	178.9	-69.3	0	0	0	0	110.4	I301 L313 T314 L316 A331 P409 I410	I301-V353 HydrophobicContact CB-CG1 4.41Å; I301-V353 HydrophobicContact CG2-CG1 3.56Å; L313-V353 CarbonylContact C-O 3.6Å; L313-V353 WeakPolarHBondContact CA-O 3.5Å; T314-V353 PolarHBondContact N-O 3.35Å; T314-V353 WeakPolarHBondContact O-CG2 3.45Å; T314-V353 PolarHBondContact O-N 2.89Å; L316-V353 HydrophobicContact CB-CG1 4.16Å; L316-V353 HydrophobicContact CB-CG2 4.27Å; L316-V353 HydrophobicContact CD1-CG2 4.48Å; L316-V353 HydrophobicContact CD2-CG1 4.11Å; A331-V353 HydrophobicContact CB-CG2 3.53Å; V353-P409 WeakPolarHBondContact CB-O 3.12Å; V353-I410 HydrophobicContact CG1-CG1 4.24Å
354	V	84.5	Confident	81.1	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.006	28%	0.277	C	S	.	.			trans	-123.8	153.1	175.9	-61.6	0	0	0	0	111.5	L313 S356 H359 C360 A362 P409	L313-V354 HydrophobicContact CD2-CG1 4.25Å; V354-S356 WeakPolarHBondContact CG2-O 3.38Å; V354-S356 PolarHBondContact O-N 3.04Å; V354-H359 HydrophobicContact CB-CB 4.04Å; V354-H359 HydrophobicContact CG1-CB 4.46Å; V354-H359 HydrophobicContact CG2-CB 4.13Å; V354-C360 HydrophobicContact CG1-CB 4.22Å; V354-A362 HydrophobicContact CG2-CB 3.35Å; V354-P409 HydrophobicContact CG2-CB 4.3Å; V354-P409 VanDerWaalsContact O-CB 3.27Å; V354-P409 WeakPolarHBondContact O-CB 3.46Å; V354-P409 VanDerWaalsContact O-CD 3.24Å; V354-P409 WeakPolarHBondContact O-CD 3.46Å; V354-P409 VanDerWaalsContact O-CG 3.25Å; V354-P409 WeakPolarHBondContact O-CG 3.49Å
355	P	70.9	Confident	80.5	Confident	71 Å²	71	49.7 Å²	49.7	46%	0.461	29%	0.292	S	S	.	.	S	Bend	trans	-80.5	-7.9	-173.9	30.9	-37.2	0	0	0	115.3	Y312	Y312-P355 WeakPolarHBondContact O-CD 3.47Å
356	S	64.3	Low	80	Confident	40 Å²	40	45.7 Å²	45.7	28%	0.28	27%	0.271	S	S	.	.	S	Bend	trans	-150.5	155.7	169.9	-78.5	0	0	0	0	113.4	V354 H359	V354-S356 WeakPolarHBondContact CG2-O 3.38Å; V354-S356 PolarHBondContact O-N 3.04Å; S356-H359 WeakPolarHBondContact O-CB 3.34Å; S356-H359 PolarHBondContact O-N 3.33Å
357	E	67.7	Low	79.5	Confident	118 Å²	118	45 Å²	45	55%	0.551	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	142.2	169.3	-170.6	175.9	172.7	0	0	109.6	H359	E357-H359 VanDerWaalsContact C-N 3.33Å; E357-H359 PolarHBondContact O-N 3.29Å
358	G	64.3	Low	79.3	Confident	44 Å²	44	41.4 Å²	41.4	45%	0.454	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	89.1	-25.6	-173.8	0	0	0	0	0	115.2	C360 A362	G358-C360 PolarHBondContact O-N 3Å; G358-A362 PolarHBondContact N-O 3.13Å
359	H	78.4	Confident	78.9	Confident	50 Å²	50	40.9 Å²	40.9	23%	0.231	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-66.3	129.6	173.2	-68.9	-154.3	0	0	0	109.3	Y312 V354 S356 E357 S361 A362	Y312-H359 AromaticContact CD1-CE1 3.74Å; Y312-H359 AromaticContact CD1-ND1 3.28Å; Y312-H359 VanDerWaalsContact CD1-ND1 3.28Å; Y312-H359 WeakPolarHBondContact CD1-ND1 3.43Å; Y312-H359 HydrophobicContact CD2-CB 3.9Å; Y312-H359 AromaticContact CD2-CG 3.96Å; Y312-H359 AromaticContact CD2-ND1 3.75Å; Y312-H359 AromaticContact CE1-CE1 3.74Å; Y312-H359 AromaticContact CE1-ND1 3.69Å; Y312-H359 HydrophobicContact CG-CB 4.05Å; Y312-H359 AromaticContact CG-CG 3.95Å; Y312-H359 AromaticContact CG-ND1 3.31Å; Y312-H359 VanDerWaalsContact CG-ND1 3.31Å; V354-H359 HydrophobicContact CB-CB 4.04Å; V354-H359 HydrophobicContact CG1-CB 4.46Å; V354-H359 HydrophobicContact CG2-CB 4.13Å; S356-H359 WeakPolarHBondContact O-CB 3.34Å; S356-H359 PolarHBondContact O-N 3.33Å; E357-H359 VanDerWaalsContact C-N 3.33Å; E357-H359 PolarHBondContact O-N 3.29Å; H359-S361 PolarHBondContact O-N 3.23Å; H359-S361 VanDerWaalsContact O-N 3.15Å; H359-A362 WeakPolarHBondContact O-CB 3.34Å; H359-A362 PolarHBondContact O-N 3.04Å
360	C	80.2	Confident	78.1	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	51.4	39.7	177.4	-51.7	0	0	0	0	113.5	C254 E256 C310 V354 G358 A362	C254-C360 PolarHBondContact O-N 2.99Å; E256-C360 WeakPolarHBondContact O-CA 3.1Å; E256-C360 WeakPolarHBondContact O-CB 3.3Å; C310-C360 HydrophobicContact CB-CB 3.72Å; C310-C360 WeakPolarHBondContact CB-SG 3.45Å; C310-C360 WeakPolarHBondContact SG-CB 3.44Å; C310-C360 CovalentContact SG-SG 2.01Å; C310-C360 PolarHBondContact SG-SG 2.86Å; V354-C360 HydrophobicContact CG1-CB 4.22Å; G358-C360 PolarHBondContact O-N 3Å; C360-A362 PolarHBondContact O-N 3.26Å
361	S	73.1	Confident	77	Confident	75 Å²	75	43.5 Å²	43.5	52%	0.524	24%	0.235	S	C	.	.	G	3₁₀ helix	trans	57.6	23.6	-175	-54.1	0	0	0	0	115.8	H359 S363	H359-S361 PolarHBondContact O-N 3.23Å; H359-S361 VanDerWaalsContact O-N 3.15Å; S361-S363 PolarHBondContact O-N 3.35Å
362	A	73	Confident	75.2	Confident	4 Å²	4	47.3 Å²	47.3	3%	0.033	26%	0.261	C	S	.	.			trans	-64.2	128.9	173.5	0	0	0	0	0	111.5	V354 G358 H359 C360	V354-A362 HydrophobicContact CG2-CB 3.35Å; G358-A362 PolarHBondContact N-O 3.13Å; H359-A362 WeakPolarHBondContact O-CB 3.34Å; H359-A362 PolarHBondContact O-N 3.04Å; C360-A362 PolarHBondContact O-N 3.26Å
363	S	69.7	Low	73.6	Confident	72 Å²	72	50.7 Å²	50.7	50%	0.503	29%	0.286	S	S	.	.			trans	-125.9	6.3	-169.1	43.4	0	0	0	0	113.6	S361	S361-S363 PolarHBondContact O-N 3.35Å
364	L	70.8	Confident	72	Confident	52 Å²	52	54.3 Å²	54.3	27%	0.272	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	138.6	178.4	-64.3	174	0	0	0	110.9	V381 I410	L364-V381 HydrophobicContact CB-CG1 4.49Å; L364-I410 PolarHBondContact N-O 3.44Å; L364-I410 PolarHBondContact O-N 3.23Å
365	K	78.1	Confident	71.2	Confident	83 Å²	83	56.5 Å²	56.5	36%	0.361	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	115.7	173.2	-175.1	171.4	-175.1	167.6	0	109.1	Y367	K365-Y367 WeakPolarHBondContact O-CD2 3.32Å; K365-Y367 WeakPolarHBondContact O-CE2 3.43Å
366	A	80.3	Confident	71.4	Confident	2 Å²	2	53.6 Å²	53.6	2%	0.017	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	147.8	172.5	0	0	0	0	0	111.7	F298 T380 V381 T407 L408 I410	F298-A366 HydrophobicContact CE1-CB 3.65Å; F298-A366 HydrophobicContact CZ-CB 3.67Å; A366-T380 CarbonylContact C-O 3.49Å; A366-T380 WeakPolarHBondContact CA-O 3.4Å; A366-V381 HydrophobicContact CB-CG1 3.87Å; A366-T407 CarbonylContact O-C 3.56Å; A366-T407 VanDerWaalsContact O-CA 3.27Å; A366-T407 WeakPolarHBondContact O-CA 3.25Å; A366-L408 VanDerWaalsContact CA-O 3.27Å; A366-L408 WeakPolarHBondContact CA-O 3.4Å; A366-L408 WeakPolarHBondContact CB-O 3.21Å; A366-L408 PolarHBondContact N-O 3.26Å; A366-L408 PolarHBondContact O-N 2.84Å; A366-I410 HydrophobicContact CB-CD1 3.79Å; A366-I410 HydrophobicContact CB-CG1 4.28Å
367	Y	80.7	Confident	72.4	Confident	49 Å²	49	51.9 Å²	51.9	19%	0.192	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	126.9	-179.1	-57.3	-96	0	0	0	108.9	K365 Y379 T380 A386 T407	K365-Y367 WeakPolarHBondContact O-CD2 3.32Å; K365-Y367 WeakPolarHBondContact O-CE2 3.43Å; Y367-Y379 WeakPolarHBondContact O-CA 3.44Å; Y367-T380 WeakPolarHBondContact CD2-O 3.37Å; Y367-T380 PolarHBondContact N-O 3.11Å; Y367-T380 PolarHBondContact O-N 2.8Å; Y367-T380 VanDerWaalsContact O-N 3.1Å; Y367-A386 HydrophobicContact CD1-CB 3.77Å; Y367-A386 HydrophobicContact CD2-CB 3.68Å; Y367-A386 HydrophobicContact CE1-CB 4.06Å; Y367-A386 HydrophobicContact CE2-CB 4Å; Y367-A386 HydrophobicContact CG-CB 3.56Å; Y367-T407 HydrophobicContact CD1-CG2 3.86Å; Y367-T407 HydrophobicContact CE1-CG2 4.27Å
368	Q	83.3	Confident	73.2	Confident	7 Å²	7	47.7 Å²	47.7	3%	0.033	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	124.6	176.4	175.5	-177	1	0	0	110	F377 Y379 P405 R406	Q368-F377 HydrophobicContact CG-CD1 4.05Å; Q368-F377 VanDerWaalsContact NE2-CD1 3.32Å; Q368-F377 VanDerWaalsContact NE2-CE1 3.33Å; Q368-Y379 HydrophobicContact CB-CD1 3.93Å; Q368-Y379 HydrophobicContact CB-CE1 3.58Å; Q368-Y379 HydrophobicContact CG-CD1 4.23Å; Q368-Y379 HydrophobicContact CG-CE1 3.49Å; Q368-Y379 VanDerWaalsContact CG-CE1 3.49Å; Q368-Y379 PolarHBondContact NE2-OH 3.06Å; Q368-P405 VanDerWaalsContact O-CA 3.24Å; Q368-P405 WeakPolarHBondContact O-CA 3.36Å; Q368-P405 WeakPolarHBondContact O-CB 3.2Å; Q368-R406 HydrophobicContact CB-CB 4.26Å; Q368-R406 WeakPolarHBondContact CB-O 3.15Å; Q368-R406 PolarHBondContact N-O 3.03Å; Q368-R406 PolarHBondContact O-N 2.83Å
369	F	79.3	Confident	74.4	Confident	18 Å²	18	45.6 Å²	45.6	8%	0.079	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	122.5	176.6	-67.3	-85.6	0	0	0	110.9	F377 Y378 T380 A386 M389 L390 P405	F369-F377 CarbonylContact O-C 2.85Å; F369-F377 WeakPolarHBondContact O-CA 3.49Å; F369-Y378 PolarHBondContact N-O 3.4Å; F369-Y378 PolarHBondContact O-N 2.89Å; F369-T380 HydrophobicContact CE2-CG2 4.1Å; F369-A386 HydrophobicContact CE2-CB 3.97Å; F369-A386 HydrophobicContact CZ-CB 3.77Å; F369-M389 HydrophobicContact CB-SD 4.36Å; F369-M389 HydrophobicContact CD1-CB 3.89Å; F369-M389 HydrophobicContact CD1-SD 4.36Å; F369-M389 HydrophobicContact CD2-CB 4.49Å; F369-M389 HydrophobicContact CD2-SD 3.62Å; F369-M389 HydrophobicContact CE1-CB 3.61Å; F369-M389 HydrophobicContact CE2-CB 4.24Å; F369-M389 HydrophobicContact CE2-SD 3.96Å; F369-M389 HydrophobicContact CG-CB 4.33Å; F369-M389 HydrophobicContact CG-SD 3.84Å; F369-M389 HydrophobicContact CZ-CB 3.82Å; F369-M389 HydrophobicContact CZ-SD 4.49Å; F369-L390 HydrophobicContact CE1-CD2 4.44Å; F369-L390 HydrophobicContact CE1-CG 4.2Å; F369-P405 HydrophobicContact CD1-CB 3.91Å; F369-P405 HydrophobicContact CE1-CB 3.75Å; F369-P405 HydrophobicContact CE1-CG 4Å; F369-P405 HydrophobicContact CZ-CB 4.24Å
370	Q	74.4	Confident	74.8	Confident	46 Å²	46	43.2 Å²	43.2	22%	0.215	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	134.7	174.6	-175.9	170.6	-37.5	0	0	110.9	F377 E403	Q370-F377 HydrophobicContact CB-CD1 3.98Å; Q370-F377 HydrophobicContact CB-CE1 3.72Å; Q370-F377 HydrophobicContact CG-CD1 4.26Å; Q370-F377 HydrophobicContact CG-CE1 3.69Å; Q370-F377 HydrophobicContact CG-CZ 4.11Å; Q370-E403 VanDerWaalsContact CD-OE2 3.29Å; Q370-E403 PolarHBondContact NE2-OE2 3.08Å
371	R	68.8	Low	74.9	Confident	136 Å²	136	45.2 Å²	45.2	51%	0.513	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	108.2	175.3	-163.6	178.4	-174.1	-177.9	1.5	110	T373 L374 N375 Q376	R371-T373 PolarHBondContact O-N 2.93Å; R371-L374 PolarHBondContact O-N 3.22Å; R371-N375 PolarHBondContact O-N 2.86Å; R371-Q376 HydrophobicContact CB-CB 4.21Å; R371-Q376 PolarHBondContact N-O 2.89Å
372	S	55.8	Low	75.2	Confident	84 Å²	84	45.2 Å²	45.2	59%	0.587	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54	-26.4	-163.5	51.9	0	0	0	0	117
373	T	56.6	Low	75.1	Confident	112 Å²	112	48.4 Å²	48.4	69%	0.687	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	-8.2	-174.9	59.1	0	0	0	0	115	R371	R371-T373 PolarHBondContact O-N 2.93Å
374	L	58	Low	75	Confident	76 Å²	76	49 Å²	49	40%	0.398	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-139.6	-1.9	-168.2	-67	172.5	0	0	0	115	Y326 R371 Q376	Y326-L374 VanDerWaalsContact CE2-O 3.27Å; Y326-L374 WeakPolarHBondContact CE2-O 3.49Å; R371-L374 PolarHBondContact O-N 3.22Å; L374-Q376 HydrophobicContact CB-CB 4.48Å; L374-Q376 HydrophobicContact CB-CG 3.81Å; L374-Q376 PolarHBondContact O-N 3.3Å
375	N	67	Low	75.3	Confident	48 Å²	48	49.1 Å²	49.1	26%	0.257	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	50	36.7	-170.1	-63	-2.5	0	0	0	113	R321 W344 R371	R321-N375 PolarHBondContact NH1-ND2 2.66Å; W344-N375 HydrophobicContact CZ2-CB 4.09Å; R371-N375 PolarHBondContact O-N 2.86Å
376	Q	75	Confident	74.9	Confident	10 Å²	10	45.3 Å²	45.3	5%	0.047	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	132	172.9	-72.1	170.7	-13.9	0	0	109.3	R272 Y326 R371 L374	R272-Q376 PolarHBondContact O-OE1 2.94Å; Y326-Q376 HydrophobicContact CD1-CG 4.04Å; Y326-Q376 HydrophobicContact CD2-CG 4.33Å; Y326-Q376 HydrophobicContact CE1-CG 3.6Å; Y326-Q376 HydrophobicContact CE2-CG 3.96Å; Y326-Q376 HydrophobicContact CG-CG 4.41Å; Y326-Q376 PolarHBondContact OH-NE2 3.07Å; R371-Q376 HydrophobicContact CB-CB 4.21Å; R371-Q376 PolarHBondContact N-O 2.89Å; L374-Q376 HydrophobicContact CB-CB 4.48Å; L374-Q376 HydrophobicContact CB-CG 3.81Å; L374-Q376 PolarHBondContact O-N 3.3Å
377	F	85	Confident	74.2	Confident	3 Å²	3	46.9 Å²	46.9	1%	0.013	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	139.2	178.5	-63.4	-83.1	0	0	0	112	D274 T275 Y327 V328 Y339 W344 Q368 F369 Q370 Y379	D274-F377 WeakPolarHBondContact CA-O 3.32Å; T275-F377 PolarHBondContact N-O 2.79Å; Y327-F377 WeakPolarHBondContact O-CD2 3.4Å; V328-F377 HydrophobicContact CB-CD2 3.88Å; V328-F377 HydrophobicContact CB-CE2 3.76Å; V328-F377 HydrophobicContact CB-CG 4.47Å; V328-F377 HydrophobicContact CB-CZ 4.24Å; V328-F377 HydrophobicContact CG2-CD1 4.29Å; V328-F377 HydrophobicContact CG2-CD2 4.1Å; V328-F377 HydrophobicContact CG2-CE1 4.05Å; V328-F377 HydrophobicContact CG2-CE2 3.88Å; V328-F377 HydrophobicContact CG2-CG 4.3Å; V328-F377 HydrophobicContact CG2-CZ 3.85Å; Y339-F377 HydrophobicContact CE1-CZ 4.11Å; W344-F377 HydrophobicContact CH2-CD2 4.22Å; W344-F377 AromaticContact CH2-CE2 3.65Å; W344-F377 HydrophobicContact CH2-CE2 3.65Å; W344-F377 AromaticContact CZ2-CE2 4Å; W344-F377 HydrophobicContact CZ2-CE2 4Å; W344-F377 HydrophobicContact CZ3-CE2 4.4Å; Q368-F377 HydrophobicContact CG-CD1 4.05Å; Q368-F377 VanDerWaalsContact NE2-CD1 3.32Å; Q368-F377 VanDerWaalsContact NE2-CE1 3.33Å; F369-F377 CarbonylContact O-C 2.85Å; F369-F377 WeakPolarHBondContact O-CA 3.49Å; Q370-F377 HydrophobicContact CB-CD1 3.98Å; Q370-F377 HydrophobicContact CB-CE1 3.72Å; Q370-F377 HydrophobicContact CG-CD1 4.26Å; Q370-F377 HydrophobicContact CG-CE1 3.69Å; Q370-F377 HydrophobicContact CG-CZ 4.11Å; F377-Y379 HydrophobicContact CB-CD2 4.45Å; F377-Y379 HydrophobicContact CB-CE2 3.58Å
378	Y	85.7	Confident	73.6	Confident	30 Å²	30	48.3 Å²	48.3	12%	0.118	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	134.4	173.8	-173	-94.2	0	0	0	110.4	V268 N273 T275 F369 Q385 M389	V268-Y378 HydrophobicContact CG1-CE2 4.11Å; V268-Y378 HydrophobicContact CG2-CE2 4.08Å; N273-Y378 WeakPolarHBondContact O-CD2 3.27Å; T275-Y378 VanDerWaalsContact OG1-CD2 3.27Å; T275-Y378 WeakPolarHBondContact OG1-CD2 3.24Å; F369-Y378 PolarHBondContact N-O 3.4Å; F369-Y378 PolarHBondContact O-N 2.89Å; Y378-Q385 PolarHBondContact OH-NE2 3.47Å; Y378-M389 HydrophobicContact CD1-CE 3.44Å; Y378-M389 VanDerWaalsContact CD1-CE 3.44Å; Y378-M389 HydrophobicContact CD1-SD 3.6Å; Y378-M389 VanDerWaalsContact CD1-SD 3.6Å; Y378-M389 HydrophobicContact CE1-CE 3.81Å; Y378-M389 HydrophobicContact CE1-SD 3.96Å; Y378-M389 HydrophobicContact CG-CE 3.86Å; Y378-M389 HydrophobicContact CG-SD 4.5Å
379	Y	89.5	Confident	72.8	Confident	1 Å²	1	50.4 Å²	50.4	0%	0.004	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	134.1	-177.2	-63	-93.4	0	0	0	111.5	R266 T275 L277 Y329 Y367 Q368 F377 L408	R266-Y379 VanDerWaalsContact CD-O 3.26Å; R266-Y379 WeakPolarHBondContact CD-O 3.33Å; R266-Y379 PolarHBondContact NH1-O 2.96Å; T275-Y379 HydrophobicContact CG2-CD2 4.07Å; L277-Y379 HydrophobicContact CD1-CD1 4.44Å; L277-Y379 HydrophobicContact CD1-CG 4.23Å; Y329-Y379 HydrophobicContact CD2-CD2 4.08Å; Y329-Y379 HydrophobicContact CD2-CE1 4.23Å; Y329-Y379 AromaticContact CD2-CE2 3.55Å; Y329-Y379 HydrophobicContact CD2-CE2 3.55Å; Y329-Y379 AromaticContact CD2-CZ 3.64Å; Y329-Y379 HydrophobicContact CE2-CD2 4.38Å; Y329-Y379 HydrophobicContact CE2-CE2 4Å; Y329-Y379 PolarHBondContact N-OH 2.82Å; Y367-Y379 WeakPolarHBondContact O-CA 3.44Å; Q368-Y379 HydrophobicContact CB-CD1 3.93Å; Q368-Y379 HydrophobicContact CB-CE1 3.58Å; Q368-Y379 HydrophobicContact CG-CD1 4.23Å; Q368-Y379 HydrophobicContact CG-CE1 3.49Å; Q368-Y379 VanDerWaalsContact CG-CE1 3.49Å; Q368-Y379 PolarHBondContact NE2-OH 3.06Å; F377-Y379 HydrophobicContact CB-CD2 4.45Å; F377-Y379 HydrophobicContact CB-CE2 3.58Å; Y379-L408 HydrophobicContact CE1-CD1 4.43Å
380	T	86	Confident	72	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	146.9	175.3	-164.5	0	0	0	0	112.3	R266 A366 Y367 F369 D382 Q385 A386	R266-T380 PolarHBondContact NH1-OG1 3.32Å; A366-T380 CarbonylContact C-O 3.49Å; A366-T380 WeakPolarHBondContact CA-O 3.4Å; Y367-T380 WeakPolarHBondContact CD2-O 3.37Å; Y367-T380 PolarHBondContact N-O 3.11Å; Y367-T380 PolarHBondContact O-N 2.8Å; Y367-T380 VanDerWaalsContact O-N 3.1Å; F369-T380 HydrophobicContact CE2-CG2 4.1Å; T380-D382 PolarHBondContact OG1-N 2.97Å; T380-D382 VanDerWaalsContact OG1-N 3.15Å; T380-Q385 HydrophobicContact CG2-CB 4.31Å; T380-Q385 PolarHBondContact OG1-OE1 3.27Å; T380-A386 HydrophobicContact CG2-CB 4.25Å
381	V	83	Confident	71.5	Confident	42 Å²	42	58 Å²	58	26%	0.255	31%	0.306	S	S	.	.			trans	-98.8	-3.8	165.8	-67.4	0	0	0	0	112.2	F298 L364 A366 S383	F298-V381 HydrophobicContact CD2-CG1 4.39Å; F298-V381 HydrophobicContact CE1-CG1 4.23Å; F298-V381 HydrophobicContact CE2-CG1 4.08Å; F298-V381 HydrophobicContact CZ-CG1 3.97Å; F298-V381 WeakPolarHBondContact O-CG1 3.42Å; L364-V381 HydrophobicContact CB-CG1 4.49Å; A366-V381 HydrophobicContact CB-CG1 3.87Å; V381-S383 PolarHBondContact O-N 2.89Å
382	D	79	Confident	71	Confident	75 Å²	75	56.7 Å²	56.7	40%	0.401	30%	0.304	S	S	.	.			trans	-80.3	107.7	177.6	177.9	-5	0	0	0	110.2	T380 M384 Q385 A386	T380-D382 PolarHBondContact OG1-N 2.97Å; T380-D382 VanDerWaalsContact OG1-N 3.15Å; D382-M384 VanDerWaalsContact C-N 3.26Å; D382-M384 PolarHBondContact O-N 2.83Å; D382-M384 WeakPolarHBondContact OD1-CA 3.46Å; D382-M384 VanDerWaalsContact OD1-CB 3.27Å; D382-M384 WeakPolarHBondContact OD1-CB 3.21Å; D382-M384 PolarHBondContact OD1-N 2.81Å; D382-Q385 HydrophobicContact CB-CB 3.79Å; D382-Q385 PolarHBondContact O-N 2.64Å; D382-Q385 VanDerWaalsContact O-N 3.16Å; D382-Q385 PolarHBondContact OD1-N 2.93Å; D382-Q385 VanDerWaalsContact OD1-N 3.11Å; D382-A386 WeakPolarHBondContact O-CB 3.16Å; D382-A386 PolarHBondContact O-N 2.78Å
383	S	71.4	Confident	70.8	Confident	71 Å²	71	54.5 Å²	54.5	50%	0.497	28%	0.284	S	S	.	.	H	α-helix	trans	-63.5	-27.1	177.8	61.4	0	0	0	0	113.5	V381 A387	V381-S383 PolarHBondContact O-N 2.89Å; S383-A387 VanDerWaalsContact O-CB 3.27Å; S383-A387 WeakPolarHBondContact O-CB 3.15Å; S383-A387 PolarHBondContact O-N 3.16Å
384	M	68	Low	70	Confident	84 Å²	84	52.7 Å²	52.7	41%	0.414	28%	0.28	S	S	.	.	H	α-helix	trans	-71.8	-43.8	171.4	-66	-163.3	62.3	0	0	111.2	D382 A386 A387 E388	D382-M384 VanDerWaalsContact C-N 3.26Å; D382-M384 PolarHBondContact O-N 2.83Å; D382-M384 WeakPolarHBondContact OD1-CA 3.46Å; D382-M384 VanDerWaalsContact OD1-CB 3.27Å; D382-M384 WeakPolarHBondContact OD1-CB 3.21Å; D382-M384 PolarHBondContact OD1-N 2.81Å; M384-A386 VanDerWaalsContact C-N 3.32Å; M384-A386 PolarHBondContact O-N 2.79Å; M384-A387 PolarHBondContact O-N 2.92Å; M384-E388 PolarHBondContact O-N 3.17Å
385	Q	75.8	Confident	69.1	Low	55 Å²	55	56.9 Å²	56.9	26%	0.257	30%	0.295	S	S	.	.	H	α-helix	trans	-63.2	-41	175.4	-167	-176.8	31.5	0	0	111	Y378 T380 D382 E388 M389	Y378-Q385 PolarHBondContact OH-NE2 3.47Å; T380-Q385 HydrophobicContact CG2-CB 4.31Å; T380-Q385 PolarHBondContact OG1-OE1 3.27Å; D382-Q385 HydrophobicContact CB-CB 3.79Å; D382-Q385 PolarHBondContact O-N 2.64Å; D382-Q385 VanDerWaalsContact O-N 3.16Å; D382-Q385 PolarHBondContact OD1-N 2.93Å; D382-Q385 VanDerWaalsContact OD1-N 3.11Å; Q385-E388 PolarHBondContact O-N 3.42Å; Q385-M389 WeakPolarHBondContact O-CG 3.4Å; Q385-M389 PolarHBondContact O-N 3.15Å
386	A	70.2	Confident	67.8	Low	2 Å²	2	61.4 Å²	61.4	2%	0.017	32%	0.315	C	S	.	.	H	α-helix	trans	-60.8	-46.7	174	0	0	0	0	0	111.7	Y367 F369 T380 D382 M384 E388 M389 L390	Y367-A386 HydrophobicContact CD1-CB 3.77Å; Y367-A386 HydrophobicContact CD2-CB 3.68Å; Y367-A386 HydrophobicContact CE1-CB 4.06Å; Y367-A386 HydrophobicContact CE2-CB 4Å; Y367-A386 HydrophobicContact CG-CB 3.56Å; F369-A386 HydrophobicContact CE2-CB 3.97Å; F369-A386 HydrophobicContact CZ-CB 3.77Å; T380-A386 HydrophobicContact CG2-CB 4.25Å; D382-A386 WeakPolarHBondContact O-CB 3.16Å; D382-A386 PolarHBondContact O-N 2.78Å; M384-A386 VanDerWaalsContact C-N 3.32Å; M384-A386 PolarHBondContact O-N 2.79Å; A386-E388 VanDerWaalsContact C-N 3.34Å; A386-E388 PolarHBondContact O-N 2.99Å; A386-M389 PolarHBondContact O-N 3.01Å; A386-L390 WeakPolarHBondContact O-CB 3.43Å; A386-L390 WeakPolarHBondContact O-CG 3.49Å; A386-L390 PolarHBondContact O-N 3.11Å
387	A	65.3	Low	66.2	Low	36 Å²	36	63.8 Å²	63.8	30%	0.298	33%	0.328	S	S	.	.	H	α-helix	trans	-64.7	-33.5	175.2	0	0	0	0	0	113.1	S383 M384 K391	S383-A387 VanDerWaalsContact O-CB 3.27Å; S383-A387 WeakPolarHBondContact O-CB 3.15Å; S383-A387 PolarHBondContact O-N 3.16Å; M384-A387 PolarHBondContact O-N 2.92Å; A387-K391 WeakPolarHBondContact O-CB 3.33Å; A387-K391 WeakPolarHBondContact O-CD 3.43Å; A387-K391 WeakPolarHBondContact O-CG 3.43Å; A387-K391 PolarHBondContact O-N 3.45Å
388	E	68.5	Low	63.7	Low	78 Å²	78	67 Å²	67	36%	0.364	36%	0.355	S	S	.	.	H	α-helix	trans	-67.4	-42.2	171.2	-84.2	-138.2	159.5	0	0	112.5	M384 Q385 A386 K391 K392	M384-E388 PolarHBondContact O-N 3.17Å; Q385-E388 PolarHBondContact O-N 3.42Å; A386-E388 VanDerWaalsContact C-N 3.34Å; A386-E388 PolarHBondContact O-N 2.99Å; E388-K391 CarbonylContact O-C 3.55Å; E388-K391 PolarHBondContact O-N 3.16Å; E388-K392 WeakPolarHBondContact O-CG 3.22Å; E388-K392 PolarHBondContact O-N 2.85Å; E388-K392 IonicContact OE2-NZ 3.93Å; E388-K392 PolarHBondContact OE2-NZ 2.77Å
389	M	67.5	Low	61.2	Low	51 Å²	51	69.3 Å²	69.3	25%	0.251	38%	0.38	S	S	.	.	H	α-helix	trans	-65.1	-42.6	177.4	-76.2	-173.9	136.2	0	0	110.8	F369 Y378 Q385 A386 K391 K392 K393	F369-M389 HydrophobicContact CB-SD 4.36Å; F369-M389 HydrophobicContact CD1-CB 3.89Å; F369-M389 HydrophobicContact CD1-SD 4.36Å; F369-M389 HydrophobicContact CD2-CB 4.49Å; F369-M389 HydrophobicContact CD2-SD 3.62Å; F369-M389 HydrophobicContact CE1-CB 3.61Å; F369-M389 HydrophobicContact CE2-CB 4.24Å; F369-M389 HydrophobicContact CE2-SD 3.96Å; F369-M389 HydrophobicContact CG-CB 4.33Å; F369-M389 HydrophobicContact CG-SD 3.84Å; F369-M389 HydrophobicContact CZ-CB 3.82Å; F369-M389 HydrophobicContact CZ-SD 4.49Å; Y378-M389 HydrophobicContact CD1-CE 3.44Å; Y378-M389 VanDerWaalsContact CD1-CE 3.44Å; Y378-M389 HydrophobicContact CD1-SD 3.6Å; Y378-M389 VanDerWaalsContact CD1-SD 3.6Å; Y378-M389 HydrophobicContact CE1-CE 3.81Å; Y378-M389 HydrophobicContact CE1-SD 3.96Å; Y378-M389 HydrophobicContact CG-CE 3.86Å; Y378-M389 HydrophobicContact CG-SD 4.5Å; Q385-M389 WeakPolarHBondContact O-CG 3.4Å; Q385-M389 PolarHBondContact O-N 3.15Å; A386-M389 PolarHBondContact O-N 3.01Å; M389-K391 PolarHBondContact O-N 3.1Å; M389-K392 PolarHBondContact O-N 2.75Å; M389-K393 VanDerWaalsContact O-CB 3.31Å; M389-K393 WeakPolarHBondContact O-CB 3.49Å; M389-K393 PolarHBondContact O-N 2.78Å
390	L	62.8	Low	58.4	Low	79 Å²	79	76.4 Å²	76.4	41%	0.414	41%	0.413	S	S	.	.	H	α-helix	trans	-57.7	-44.9	169.2	-75.7	172.1	0	0	0	112.4	F369 A386 K392 K393 A394 P405	F369-L390 HydrophobicContact CE1-CD2 4.44Å; F369-L390 HydrophobicContact CE1-CG 4.2Å; A386-L390 WeakPolarHBondContact O-CB 3.43Å; A386-L390 WeakPolarHBondContact O-CG 3.49Å; A386-L390 PolarHBondContact O-N 3.11Å; L390-K392 VanDerWaalsContact C-N 3.3Å; L390-K392 PolarHBondContact O-N 2.89Å; L390-K393 PolarHBondContact O-N 2.86Å; L390-A394 WeakPolarHBondContact O-CB 3.21Å; L390-A394 PolarHBondContact O-N 3.35Å; L390-P405 HydrophobicContact CD2-CG 3.72Å; L390-P405 HydrophobicContact CG-CG 4.45Å
391	K	61.9	Low	55.7	Low	144 Å²	144	83.6 Å²	83.6	63%	0.626	45%	0.452	S	S	*	.	H	α-helix	trans	-68.8	-22.4	176.5	-74.8	166.9	-174.7	167.8	0	114.3	A387 E388 M389 K395	A387-K391 WeakPolarHBondContact O-CB 3.33Å; A387-K391 WeakPolarHBondContact O-CD 3.43Å; A387-K391 WeakPolarHBondContact O-CG 3.43Å; A387-K391 PolarHBondContact O-N 3.45Å; E388-K391 CarbonylContact O-C 3.55Å; E388-K391 PolarHBondContact O-N 3.16Å; M389-K391 PolarHBondContact O-N 3.1Å; K391-K395 WeakPolarHBondContact O-CG 2.89Å
392	K	58.6	Low	53	Low	109 Å²	109	84.9 Å²	84.9	47%	0.474	47%	0.473	S	S	.	.	H	α-helix	trans	-82.2	-43.6	171.7	-74.5	164.7	-172.9	151.6	0	110.4	E388 M389 L390 K395 Q396	E388-K392 WeakPolarHBondContact O-CG 3.22Å; E388-K392 PolarHBondContact O-N 2.85Å; E388-K392 IonicContact OE2-NZ 3.93Å; E388-K392 PolarHBondContact OE2-NZ 2.77Å; M389-K392 PolarHBondContact O-N 2.75Å; L390-K392 VanDerWaalsContact C-N 3.3Å; L390-K392 PolarHBondContact O-N 2.89Å; K392-K395 CarbonylContact O-C 3.48Å; K392-K395 WeakPolarHBondContact O-CA 3.43Å; K392-K395 WeakPolarHBondContact O-CB 3.48Å; K392-K395 PolarHBondContact O-N 2.87Å; K392-Q396 PolarHBondContact O-N 2.93Å
393	K	52.4	Low	50.6	Low	39 Å²	39	84.6 Å²	84.6	17%	0.17	47%	0.469	C	S	.	.	H	α-helix	trans	-61.1	-45.8	175.4	-170.6	162.6	-177.7	172.7	0	111.1	M389 L390 K395 Q396 D397 E403	M389-K393 VanDerWaalsContact O-CB 3.31Å; M389-K393 WeakPolarHBondContact O-CB 3.49Å; M389-K393 PolarHBondContact O-N 2.78Å; L390-K393 PolarHBondContact O-N 2.86Å; K393-K395 PolarHBondContact O-N 2.93Å; K393-Q396 CarbonylContact O-C 3.49Å; K393-Q396 PolarHBondContact O-N 2.8Å; K393-D397 WeakPolarHBondContact CE-OD2 3.18Å; K393-D397 VanDerWaalsContact CG-OD1 3.27Å; K393-D397 WeakPolarHBondContact CG-OD1 3.28Å; K393-D397 WeakPolarHBondContact CG-OD2 3.42Å; K393-D397 WeakPolarHBondContact O-CB 3.09Å; K393-D397 PolarHBondContact O-N 2.97Å; K393-E403 WeakPolarHBondContact CE-O 3.34Å; K393-E403 PolarHBondContact NZ-O 3.1Å
394	A	40.7	Very low	48.8	Very low	74 Å²	74	88.8 Å²	88.8	61%	0.612	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-12.5	171.1	0	0	0	0	0	115.3	L390	L390-A394 WeakPolarHBondContact O-CB 3.21Å; L390-A394 PolarHBondContact O-N 3.35Å
395	K	38.4	Very low	47.3	Very low	163 Å²	163	86.5 Å²	86.5	71%	0.709	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.2	-8.3	172.2	-70.6	179	177.5	-177	0	114.2	K391 K392 K393	K391-K395 WeakPolarHBondContact O-CG 2.89Å; K392-K395 CarbonylContact O-C 3.48Å; K392-K395 WeakPolarHBondContact O-CA 3.43Å; K392-K395 WeakPolarHBondContact O-CB 3.48Å; K392-K395 PolarHBondContact O-N 2.87Å; K393-K395 PolarHBondContact O-N 2.93Å
396	Q	40.3	Very low	46	Very low	144 Å²	144	86.6 Å²	86.6	67%	0.673	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.4	-37.4	177.9	-67.3	-178.1	-77.6	0	0	111	K392 K393 A398 A399	K392-Q396 PolarHBondContact O-N 2.93Å; K393-Q396 CarbonylContact O-C 3.49Å; K393-Q396 PolarHBondContact O-N 2.8Å; Q396-A398 PolarHBondContact O-N 2.68Å; Q396-A399 WeakPolarHBondContact O-CB 3.49Å; Q396-A399 PolarHBondContact O-N 2.83Å; Q396-A399 VanDerWaalsContact O-N 3.14Å
397	D	39.6	Very low	44.5	Very low	60 Å²	60	89.3 Å²	89.3	32%	0.321	49%	0.487	S	S	.	.	G	3₁₀ helix	trans	-73.3	-8.9	177.8	-70.4	19.6	0	0	0	113.7	K393 A399 H400	K393-D397 WeakPolarHBondContact CE-OD2 3.18Å; K393-D397 VanDerWaalsContact CG-OD1 3.27Å; K393-D397 WeakPolarHBondContact CG-OD1 3.28Å; K393-D397 WeakPolarHBondContact CG-OD2 3.42Å; K393-D397 WeakPolarHBondContact O-CB 3.09Å; K393-D397 PolarHBondContact O-N 2.97Å; D397-A399 PolarHBondContact O-N 2.81Å; D397-H400 PolarHBondContact O-N 3.33Å
398	A	33.1	Very low	43.2	Very low	71 Å²	71	89 Å²	89	59%	0.587	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-60	2.1	160.5	0	0	0	0	0	113.3	Q396	Q396-A398 PolarHBondContact O-N 2.68Å
399	A	34	Very low	41.4	Very low	78 Å²	78	85.7 Å²	85.7	65%	0.645	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-124.3	-17.1	174	0	0	0	0	0	115.8	Q396 D397	Q396-A399 WeakPolarHBondContact O-CB 3.49Å; Q396-A399 PolarHBondContact O-N 2.83Å; Q396-A399 VanDerWaalsContact O-N 3.14Å; D397-A399 PolarHBondContact O-N 2.81Å
400	H	29.4	Very low	39.8	Very low	149 Å²	149	83.5 Å²	83.5	69%	0.69	45%	0.454	S	S	*	.	S	Bend	trans	-148.5	145.7	-175.5	-96.1	33.7	0	0	0	112.8	D397	D397-H400 PolarHBondContact O-N 3.33Å
401	N	29.6	Very low	38.3	Very low	152.5 Å²	152.5	80 Å²	80	82%	0.816	44%	0.437	S	S	*	.			trans	-83.7	145.5	-164.9	-63.6	-19	0	0	0	113.7
402	G	26.4	Very low	36.6	Very low	68 Å²	68	73.7 Å²	73.7	70%	0.701	41%	0.413	S	S	*	.			trans	70.6	79.5	132.2	0	0	0	0	0	119.8
403	E	28.8	Very low	35.2	Very low	68.5 Å²	68.5	76 Å²	76	32%	0.32	42%	0.419	S	S	.	.			trans	-162.2	123	139.8	-118.4	177.7	-178.4	0	0	110.7	Q370 K393 R406	Q370-E403 VanDerWaalsContact CD-OE2 3.29Å; Q370-E403 PolarHBondContact NE2-OE2 3.08Å; K393-E403 WeakPolarHBondContact CE-O 3.34Å; K393-E403 PolarHBondContact NZ-O 3.1Å; E403-R406 IonicContact OE1-CZ 2.63Å; E403-R406 IonicContact OE1-NE 3Å; E403-R406 IonicContact OE1-NH2 3.73Å; E403-R406 PolarHBondContact OE1-NH2 2.86Å
404	Q	33.8	Very low	33.9	Very low	159.5 Å²	159.5	79.2 Å²	79.2	75%	0.745	45%	0.446	S	S	*	.	P	Polyproline II helix	trans	-72	149.6	169.3	-75.3	-164.6	-2.6	0	0	110.4	R406	Q404-R406 PolarHBondContact O-N 3.16Å
405	P	36.3	Very low	33.2	Very low	36 Å²	36	81 Å²	81	23%	0.234	45%	0.445	C	S	.	.	P	Polyproline II helix	trans	-66.5	118.4	170.8	29.3	-33.9	0	0	0	110.1	Q368 F369 L390 T407	Q368-P405 VanDerWaalsContact O-CA 3.24Å; Q368-P405 WeakPolarHBondContact O-CA 3.36Å; Q368-P405 WeakPolarHBondContact O-CB 3.2Å; F369-P405 HydrophobicContact CD1-CB 3.91Å; F369-P405 HydrophobicContact CE1-CB 3.75Å; F369-P405 HydrophobicContact CE1-CG 4Å; F369-P405 HydrophobicContact CZ-CB 4.24Å; L390-P405 HydrophobicContact CD2-CG 3.72Å; L390-P405 HydrophobicContact CG-CG 4.45Å; P405-T407 PolarHBondContact O-N 2.83Å
406	R	49.2	Very low	32.5	Very low	56.5 Å²	56.5	76.9 Å²	76.9	21%	0.213	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	144.8	174.8	-55.2	-176.8	-170.8	177.3	3.7	108.8	Q368 E403 Q404	Q368-R406 HydrophobicContact CB-CB 4.26Å; Q368-R406 WeakPolarHBondContact CB-O 3.15Å; Q368-R406 PolarHBondContact N-O 3.03Å; Q368-R406 PolarHBondContact O-N 2.83Å; E403-R406 IonicContact OE1-CZ 2.63Å; E403-R406 IonicContact OE1-NE 3Å; E403-R406 IonicContact OE1-NH2 3.73Å; E403-R406 PolarHBondContact OE1-NH2 2.86Å; Q404-R406 PolarHBondContact O-N 3.16Å
407	T	37.6	Very low	31.8	Very low	58.5 Å²	58.5	78.6 Å²	78.6	36%	0.359	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	129.2	-179.9	60.4	0	0	0	0	111.3	A366 Y367 P405	A366-T407 CarbonylContact O-C 3.56Å; A366-T407 VanDerWaalsContact O-CA 3.27Å; A366-T407 WeakPolarHBondContact O-CA 3.25Å; Y367-T407 HydrophobicContact CD1-CG2 3.86Å; Y367-T407 HydrophobicContact CE1-CG2 4.27Å; P405-T407 PolarHBondContact O-N 2.83Å
408	L	38.6	Very low	31.1	Very low	31.5 Å²	31.5	79.4 Å²	79.4	17%	0.165	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	114.5	179.8	-64.8	174.5	0	0	0	108.6	L316 A331 A366 Y379	L316-L408 HydrophobicContact CD1-CD1 4.25Å; A331-L408 HydrophobicContact CB-CD2 3.74Å; A366-L408 VanDerWaalsContact CA-O 3.27Å; A366-L408 WeakPolarHBondContact CA-O 3.4Å; A366-L408 WeakPolarHBondContact CB-O 3.21Å; A366-L408 PolarHBondContact N-O 3.26Å; A366-L408 PolarHBondContact O-N 2.84Å; Y379-L408 HydrophobicContact CE1-CD1 4.43Å
409	P	30.3	Very low	30.8	Very low	8 Å²	8	80.5 Å²	80.5	5%	0.052	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	146.9	174.5	0.1	6.9	0	0	0	112.4	V353 V354	V353-P409 WeakPolarHBondContact CB-O 3.12Å; V354-P409 HydrophobicContact CG2-CB 4.3Å; V354-P409 VanDerWaalsContact O-CB 3.27Å; V354-P409 WeakPolarHBondContact O-CB 3.46Å; V354-P409 VanDerWaalsContact O-CD 3.24Å; V354-P409 WeakPolarHBondContact O-CD 3.46Å; V354-P409 VanDerWaalsContact O-CG 3.25Å; V354-P409 WeakPolarHBondContact O-CG 3.49Å
410	I	33.8	Very low	30.4	Very low	4 Å²	4	79 Å²	79	2%	0.021	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	142.6	-171.9	-62.9	-175.5	0	0	0	108.7	L264 F298 Y300 I301 V353 L364 A366	L264-I410 HydrophobicContact CD2-CD1 4.22Å; F298-I410 HydrophobicContact CD1-CD1 3.55Å; F298-I410 HydrophobicContact CE1-CD1 3.42Å; F298-I410 VanDerWaalsContact CE1-CD1 3.42Å; Y300-I410 WeakPolarHBondContact O-CG2 3.41Å; I301-I410 HydrophobicContact CG2-CG2 3.98Å; V353-I410 HydrophobicContact CG1-CG1 4.24Å; L364-I410 PolarHBondContact N-O 3.44Å; L364-I410 PolarHBondContact O-N 3.23Å; A366-I410 HydrophobicContact CB-CD1 3.79Å; A366-I410 HydrophobicContact CB-CG1 4.28Å
411	S	30.5	Very low	30.2	Very low	6 Å²	6	74.4 Å²	74.4	4%	0.042	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	121.5	-174	65.9	0	0	0	0	112.9	L261 Y300	L261-S411 WeakPolarHBondContact CD1-O 3.49Å; L261-S411 VanDerWaalsContact CD2-O 3.29Å; L261-S411 WeakPolarHBondContact CD2-O 3.09Å; Y300-S411 CarbonylContact C-O 3.52Å; Y300-S411 WeakPolarHBondContact CB-O 3.3Å; Y300-S411 CarbonylContact O-C 3.54Å; Y300-S411 PolarHBondContact O-N 3.1Å; Y300-S411 VanDerWaalsContact O-N 3.08Å
412	G	27.5	Very low	30.1	Very low	12 Å²	12	69.2 Å²	69.2	12%	0.124	41%	0.409	C	S	.	.			trans	-171.2	159.1	162.6	0	0	0	0	0	115.6
413	R	28.6	Very low	30.4	Very low	158 Å²	158	67.9 Å²	67.9	60%	0.596	39%	0.385	S	S	*	.			trans	-99.5	119.3	-171.6	-168.8	-177.9	-165.3	164.3	3.9	110.4	Y300 N415	Y300-R413 WeakPolarHBondContact CE2-O 3.19Å; Y300-R413 VanDerWaalsContact CZ-O 3.31Å; Y300-R413 PolarHBondContact OH-O 2.85Å; R413-N415 VanDerWaalsContact C-N 3.31Å; R413-N415 VanDerWaalsContact CD-OD1 3.29Å; R413-N415 WeakPolarHBondContact CD-OD1 3.18Å; R413-N415 WeakPolarHBondContact CG-OD1 3.4Å; R413-N415 PolarHBondContact NE-OD1 2.9Å; R413-N415 PolarHBondContact O-N 3.11Å; R413-N415 VanDerWaalsContact O-N 3.13Å
414	S	24.4	Very low	30.5	Very low	106 Å²	106	70 Å²	70	74%	0.741	40%	0.398	S	S	*	.			trans	-69.7	92.4	170.2	116.3	0	0	0	0	110.2	S416	S414-S416 PolarHBondContact O-N 2.89Å
415	N	27.4	Very low	30.6	Very low	112 Å²	112	65.8 Å²	65.8	60%	0.599	39%	0.385	S	S	*	.			trans	-82.8	117.1	161.2	-86.3	12.9	0	0	0	108.2	R413 H417	R413-N415 VanDerWaalsContact C-N 3.31Å; R413-N415 VanDerWaalsContact CD-OD1 3.29Å; R413-N415 WeakPolarHBondContact CD-OD1 3.18Å; R413-N415 WeakPolarHBondContact CG-OD1 3.4Å; R413-N415 PolarHBondContact NE-OD1 2.9Å; R413-N415 PolarHBondContact O-N 3.11Å; R413-N415 VanDerWaalsContact O-N 3.13Å; N415-H417 PolarHBondContact O-N 3.27Å
416	S	23.7	Very low	30.6	Very low	75.5 Å²	75.5	67.7 Å²	67.7	53%	0.528	39%	0.39	S	S	.	.			trans	-68	127.3	169.7	47.6	0	0	0	0	110.8	S414	S414-S416 PolarHBondContact O-N 2.89Å
417	H	26	Very low	30	Very low	180.5 Å²	180.5	72.4 Å²	72.4	84%	0.836	41%	0.412	S	S	*	.	S	Bend	trans	-153	153.3	138.1	-97.1	40.5	0	0	0	109.1	N415	N415-H417 PolarHBondContact O-N 3.27Å
418	S	24.4	Very low	30.2	Very low	75.5 Å²	75.5	71.7 Å²	71.7	53%	0.528	41%	0.405	S	S	.	.			trans	63.4	90.5	176.9	-123	0	0	0	0	117.1	M594	S418-M594 WeakPolarHBondContact OG-CE 3.2Å
419	M	25.7	Very low	30.1	Very low	96 Å²	96	75.2 Å²	75.2	47%	0.473	43%	0.43	S	S	.	.			trans	-134.7	109.2	169.2	-55	-163.3	27.9	0	0	113.2	M594 R597 L602	M419-M594 PolarHBondContact N-SD 2.93Å; M419-R597 PolarHBondContact SD-NH2 2.97Å; M419-L602 HydrophobicContact CE-CD1 3.67Å; M419-L602 HydrophobicContact CE-CD2 3.58Å; M419-L602 HydrophobicContact CE-CG 4.22Å
420	S	26.2	Very low	30.7	Very low	46 Å²	46	76.1 Å²	76.1	32%	0.322	43%	0.433	S	S	.	.			trans	-101.7	123.4	174.1	41.7	0	0	0	0	112.6	M594 D600	S420-M594 PolarHBondContact OG-O 3.29Å; S420-D600 VanDerWaalsContact CB-OD1 3.26Å; S420-D600 WeakPolarHBondContact CB-OD1 3.4Å; S420-D600 WeakPolarHBondContact CB-OD2 3.26Å; S420-D600 VanDerWaalsContact OG-CB 3.28Å; S420-D600 WeakPolarHBondContact OG-CB 3.47Å; S420-D600 PolarHBondContact OG-OD1 2.79Å; S420-D600 PolarHBondContact OG-OD2 2.73Å
421	G	25.5	Very low	31.2	Very low	52 Å²	52	82.3 Å²	82.3	54%	0.536	46%	0.46	S	S	.	.	S	Bend	trans	80.8	70.1	165.1	0	0	0	0	0	117.6
422	G	27.2	Very low	31.9	Very low	44 Å²	44	85.9 Å²	85.9	45%	0.454	48%	0.476	S	S	.	.			trans	145.8	96.5	162.4	0	0	0	0	0	112.6	R597	G422-R597 PolarHBondContact O-NH1 2.78Å
423	L	32.3	Very low	32.6	Very low	39.5 Å²	39.5	90.6 Å²	90.6	21%	0.207	50%	0.502	C	S	.	.			trans	-78.2	121	-171.6	-75.1	166.3	0	0	0	112.8	F426 G556 V558 Y561	L423-F426 HydrophobicContact CD1-CE2 4.15Å; L423-F426 HydrophobicContact CD2-CE2 3.61Å; L423-F426 HydrophobicContact CD2-CZ 3.66Å; L423-F426 HydrophobicContact CG-CE2 4.49Å; L423-G556 WeakPolarHBondContact CD1-O 3.43Å; L423-V558 HydrophobicContact CD1-CB 3.98Å; L423-V558 HydrophobicContact CD1-CG1 3.83Å; L423-V558 WeakPolarHBondContact CD1-O 3.44Å; L423-Y561 HydrophobicContact CB-CD1 4.25Å; L423-Y561 HydrophobicContact CB-CE1 3.72Å; L423-Y561 HydrophobicContact CD1-CD1 3.75Å; L423-Y561 HydrophobicContact CD1-CE1 3.97Å; L423-Y561 HydrophobicContact CD2-CD1 3.61Å; L423-Y561 HydrophobicContact CD2-CE1 3.9Å; L423-Y561 HydrophobicContact CD2-CG 4.41Å; L423-Y561 HydrophobicContact CG-CD1 4.06Å; L423-Y561 HydrophobicContact CG-CE1 4.05Å
424	L	32.2	Very low	33.7	Very low	113 Å²	113	85 Å²	85	59%	0.592	49%	0.494	S	S	*	.			trans	-62.9	137	162.4	-70.5	168.5	0	0	0	109.2	F426 Y561	L424-F426 PolarHBondContact O-N 3.29Å; L424-Y561 PolarHBondContact O-OH 2.74Å; L424-Y561 VanDerWaalsContact O-OH 3.14Å
425	P	34.9	Very low	34.8	Very low	71.5 Å²	71.5	85.2 Å²	85.2	46%	0.464	49%	0.493	S	S	.	.			trans	-68.6	111.5	176.6	27.3	-33.1	0	0	0	109.9	K427 V551 T553	P425-K427 PolarHBondContact O-N 2.71Å; P425-V551 HydrophobicContact CB-CG1 3.66Å; P425-T553 HydrophobicContact CB-CG2 4.09Å
426	F	36.1	Very low	36.3	Very low	75.5 Å²	75.5	81.7 Å²	81.7	33%	0.331	48%	0.477	S	S	.	.			trans	-64.1	131.9	172.4	-80.5	-91.7	0	0	0	109.7	L423 L424 T553 Y561	L423-F426 HydrophobicContact CD1-CE2 4.15Å; L423-F426 HydrophobicContact CD2-CE2 3.61Å; L423-F426 HydrophobicContact CD2-CZ 3.66Å; L423-F426 HydrophobicContact CG-CE2 4.49Å; L424-F426 PolarHBondContact O-N 3.29Å; F426-T553 WeakPolarHBondContact O-CA 3.36Å; F426-T553 WeakPolarHBondContact O-CB 3.47Å; F426-T553 VanDerWaalsContact O-CG2 3.27Å; F426-T553 WeakPolarHBondContact O-CG2 3.43Å; F426-Y561 HydrophobicContact CB-CD1 4.34Å; F426-Y561 HydrophobicContact CB-CE1 3.29Å; F426-Y561 VanDerWaalsContact CB-CZ 3.46Å; F426-Y561 WeakPolarHBondContact CB-OH 3.34Å; F426-Y561 AromaticContact CD1-CE1 3.89Å; F426-Y561 HydrophobicContact CD1-CE1 3.89Å; F426-Y561 AromaticContact CD2-CD1 3.7Å; F426-Y561 HydrophobicContact CD2-CD1 3.7Å; F426-Y561 AromaticContact CD2-CE1 3.41Å; F426-Y561 HydrophobicContact CD2-CE1 3.41Å; F426-Y561 VanDerWaalsContact CD2-CE1 3.41Å; F426-Y561 HydrophobicContact CE1-CE1 4.48Å; F426-Y561 HydrophobicContact CE2-CD1 4.03Å; F426-Y561 HydrophobicContact CE2-CE1 4.06Å; F426-Y561 HydrophobicContact CG-CD1 4.08Å; F426-Y561 AromaticContact CG-CE1 3.3Å; F426-Y561 HydrophobicContact CG-CE1 3.3Å
427	K	37.5	Very low	38.4	Very low	155 Å²	155	79.7 Å²	79.7	67%	0.674	46%	0.459	S	S	*	.			trans	-106	109.6	177.4	-72	178.9	179.1	169.7	0	110	P425 V551 T553	P425-K427 PolarHBondContact O-N 2.71Å; K427-V551 HydrophobicContact CB-CG1 3.68Å; K427-V551 HydrophobicContact CD-CG1 4.22Å; K427-V551 HydrophobicContact CG-CG1 3.78Å; K427-V551 HydrophobicContact CG-CG2 4.38Å; K427-T553 HydrophobicContact CG-CG2 3.86Å
428	I	41.1	Very low	40.7	Very low	44.5 Å²	44.5	71.8 Å²	71.8	23%	0.228	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	120	165.5	-54	-172.2	0	0	0	107.9	F430 V551 I552 Y561 I563 I565	I428-F430 PolarHBondContact O-N 3.16Å; I428-V551 WeakPolarHBondContact O-CA 3.13Å; I428-I552 PolarHBondContact N-O 3.39Å; I428-I552 VanDerWaalsContact N-O 3.1Å; I428-I552 PolarHBondContact O-N 2.8Å; I428-Y561 HydrophobicContact CD1-CE2 3.62Å; I428-Y561 HydrophobicContact CG1-CE2 3.95Å; I428-Y561 VanDerWaalsContact CG1-OH 3.23Å; I428-Y561 WeakPolarHBondContact CG1-OH 3.46Å; I428-I563 HydrophobicContact CB-CD1 4.31Å; I428-I563 HydrophobicContact CD1-CB 4.08Å; I428-I563 HydrophobicContact CD1-CD1 3.91Å; I428-I563 HydrophobicContact CD1-CG1 3.99Å; I428-I563 HydrophobicContact CD1-CG2 3.57Å; I428-I563 HydrophobicContact CG1-CD1 4.3Å; I428-I565 HydrophobicContact CG2-CD1 3.56Å; I428-I565 HydrophobicContact CG2-CG1 4.3Å
429	P	37.6	Very low	43.1	Very low	104.5 Å²	104.5	68.8 Å²	68.8	68%	0.679	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.2	111.8	174.5	29.1	-31.9	0	0	0	109.9	K431 K550	P429-K431 PolarHBondContact O-N 3.41Å; P429-K550 CarbonylContact C-O 3.59Å; P429-K550 VanDerWaalsContact CA-O 3.24Å; P429-K550 WeakPolarHBondContact CA-O 3.06Å
430	F	42.6	Very low	45.6	Very low	27 Å²	27	64.5 Å²	64.5	12%	0.118	38%	0.381	C	S	.	.			trans	-97.3	117.8	-179.8	-171.9	-100.7	0	0	0	110.3	I428 H432 V439 L524 V549 K550 I565	I428-F430 PolarHBondContact O-N 3.16Å; F430-H432 HydrophobicContact CE1-CB 3.96Å; F430-H432 HydrophobicContact CZ-CB 4.21Å; F430-V439 HydrophobicContact CD2-CG2 4.46Å; F430-V439 HydrophobicContact CE2-CG2 3.95Å; F430-V439 HydrophobicContact CZ-CG2 3.86Å; F430-L524 HydrophobicContact CE1-CD1 4.46Å; F430-L524 HydrophobicContact CE1-CD2 4.12Å; F430-L524 HydrophobicContact CE2-CD1 4.22Å; F430-L524 HydrophobicContact CZ-CD1 4.1Å; F430-L524 HydrophobicContact CZ-CD2 3.71Å; F430-L524 HydrophobicContact CZ-CG 4.34Å; F430-V549 CarbonylContact C-O 3.56Å; F430-V549 HydrophobicContact CB-CB 4.01Å; F430-V549 WeakPolarHBondContact CB-O 3.29Å; F430-V549 HydrophobicContact CD1-CB 3.77Å; F430-V549 HydrophobicContact CD1-CG1 3.89Å; F430-V549 WeakPolarHBondContact CD1-O 3.26Å; F430-V549 HydrophobicContact CE1-CB 4.1Å; F430-V549 PolarHBondContact N-O 2.64Å; F430-K550 PolarHBondContact N-O 3.26Å; F430-K550 WeakPolarHBondContact O-CA 3.47Å; F430-I565 HydrophobicContact CD2-CD1 4.02Å; F430-I565 HydrophobicContact CE2-CD1 3.91Å; F430-I565 HydrophobicContact CE2-CG1 4.05Å
431	K	43	Very low	48.1	Very low	135 Å²	135	62.8 Å²	62.8	59%	0.587	37%	0.368	S	S	*	.			trans	-112.8	118.3	171.9	-125	-174.7	178.7	-175	0	109.9	P429 T433 E548	P429-K431 PolarHBondContact O-N 3.41Å; K431-T433 HydrophobicContact CD-CG2 4.41Å; K431-T433 HydrophobicContact CG-CG2 4.23Å; K431-T433 PolarHBondContact O-N 3.06Å; K431-E548 WeakPolarHBondContact CE-OE1 3.27Å
432	H	45.9	Very low	50.7	Low	81 Å²	81	64.1 Å²	64.1	38%	0.375	36%	0.36	S	S	.	.			trans	-76.6	80.6	-179.5	-163.2	-86.4	0	0	0	111.6	F430 G434 D527	F430-H432 HydrophobicContact CE1-CB 3.96Å; F430-H432 HydrophobicContact CZ-CB 4.21Å; H432-G434 PolarHBondContact CE1-O 2.92Å; H432-G434 PolarHBondContact NE2-O 3.37Å; H432-D527 IonicContact CE1-OD1 3.73Å; H432-D527 PolarHBondContact CE1-OD1 2.85Å; H432-D527 IonicContact NE2-OD1 2.67Å
433	T	42.4	Very low	53.1	Low	111 Å²	111	62.1 Å²	62.1	68%	0.681	34%	0.339	S	S	*	.			trans	-130.2	59.3	-171.9	61.4	0	0	0	0	112.3	K431 Q437	K431-T433 HydrophobicContact CD-CG2 4.41Å; K431-T433 HydrophobicContact CG-CG2 4.23Å; K431-T433 PolarHBondContact O-N 3.06Å; T433-Q437 PolarHBondContact O-NE2 2.83Å
434	G	51	Low	55.2	Low	41 Å²	41	61.6 Å²	61.6	42%	0.423	34%	0.339	S	S	.	.	S	Bend	trans	168.4	167.7	173.4	0	0	0	0	0	112	H432	H432-G434 PolarHBondContact CE1-O 2.92Å; H432-G434 PolarHBondContact NE2-O 3.37Å
435	P	47.9	Very low	57.1	Low	110 Å²	110	56.5 Å²	56.5	71%	0.714	31%	0.312	S	S	*	.	S	Bend	trans	-67.3	147.1	173.5	29.7	-34	0	0	0	110.9	Q437 D526	P435-Q437 WeakPolarHBondContact O-CG 3.29Å; P435-D526 WeakPolarHBondContact CB-OD1 3.33Å
436	S	59.2	Low	58.8	Low	37.5 Å²	37.5	56.3 Å²	56.3	26%	0.262	30%	0.304	S	S	.	.			trans	15	127.6	-179.8	-50.4	0	0	0	0	115.5	L524 P568	S436-L524 CarbonylContact C-O 3.57Å; S436-L524 VanDerWaalsContact CA-O 3.27Å; S436-L524 WeakPolarHBondContact CA-O 3.34Å; S436-L524 VanDerWaalsContact CB-O 3.24Å; S436-L524 WeakPolarHBondContact CB-O 3.28Å; S436-P568 VanDerWaalsContact O-CD 3.31Å; S436-P568 WeakPolarHBondContact O-CD 3.42Å; S436-P568 WeakPolarHBondContact O-CG 3.28Å
437	Q	67.8	Low	60.2	Low	34.5 Å²	34.5	57.5 Å²	57.5	16%	0.161	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	141.7	-179.7	-66.3	-172.2	-7.3	0	0	111	T433 P435 L524 I565	T433-Q437 PolarHBondContact O-NE2 2.83Å; P435-Q437 WeakPolarHBondContact O-CG 3.29Å; Q437-L524 PolarHBondContact N-O 2.95Å; Q437-L524 WeakPolarHBondContact O-CA 3.37Å; Q437-L524 VanDerWaalsContact O-CB 3.23Å; Q437-L524 WeakPolarHBondContact O-CB 3.45Å; Q437-L524 VanDerWaalsContact O-CD1 3.29Å; Q437-L524 WeakPolarHBondContact O-CD1 3.32Å; Q437-L524 WeakPolarHBondContact O-CG 3.07Å; Q437-L524 PolarHBondContact O-N 3.14Å; Q437-I565 HydrophobicContact CB-CG2 4.18Å; Q437-I565 HydrophobicContact CG-CG2 4.34Å
438	N	74.9	Confident	61.4	Low	13 Å²	13	53.6 Å²	53.6	7%	0.07	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	117.5	170.3	-66.9	-15.6	0	0	0	109.1	V440 T521 V523 I565 Q566	N438-V440 HydrophobicContact CB-CG2 4.49Å; N438-T521 HydrophobicContact CB-CG2 4.29Å; N438-V523 WeakPolarHBondContact OD1-CG1 3.43Å; N438-V523 WeakPolarHBondContact OD1-CG2 3.43Å; N438-I565 CarbonylContact O-C 3.59Å; N438-I565 WeakPolarHBondContact O-CA 3.4Å; N438-Q566 HydrophobicContact CB-CB 4.17Å; N438-Q566 WeakPolarHBondContact CB-O 3.29Å; N438-Q566 PolarHBondContact N-O 2.95Å; N438-Q566 PolarHBondContact O-N 2.78Å
439	V	73.3	Confident	62.5	Low	13.5 Å²	13.5	52.6 Å²	52.6	8%	0.082	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	108.1	168.4	176.1	0	0	0	0	107.7	F430 A522 L524 I552 I563 I565	F430-V439 HydrophobicContact CD2-CG2 4.46Å; F430-V439 HydrophobicContact CE2-CG2 3.95Å; F430-V439 HydrophobicContact CZ-CG2 3.86Å; V439-A522 HydrophobicContact CB-CB 4.4Å; V439-A522 PolarHBondContact N-O 3.31Å; V439-A522 PolarHBondContact O-N 2.83Å; V439-L524 HydrophobicContact CB-CD1 4.14Å; V439-L524 HydrophobicContact CG2-CD1 3.66Å; V439-L524 HydrophobicContact CG2-CG 4.47Å; V439-I552 HydrophobicContact CG1-CD1 3.88Å; V439-I563 HydrophobicContact CG1-CG2 3.97Å; V439-I565 HydrophobicContact CG2-CD1 4.48Å; V439-I565 HydrophobicContact CG2-CG1 4.24Å
440	V	80	Confident	63.8	Low	6 Å²	6	49.2 Å²	49.2	4%	0.036	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	123.1	177	-176	0	0	0	0	108.5	N438 E442 T521 I563 S564 Q566	N438-V440 HydrophobicContact CB-CG2 4.49Å; V440-E442 HydrophobicContact CG1-CG 4.07Å; V440-T521 HydrophobicContact CG2-CG2 4Å; V440-I563 CarbonylContact O-C 3.56Å; V440-I563 VanDerWaalsContact O-CA 3.29Å; V440-I563 WeakPolarHBondContact O-CA 3.38Å; V440-S564 PolarHBondContact N-O 2.83Å; V440-S564 PolarHBondContact O-N 2.88Å; V440-Q566 HydrophobicContact CG2-CG 4.24Å
441	L	78.2	Confident	65.1	Low	9.5 Å²	9.5	50.8 Å²	50.8	5%	0.05	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	105.8	176.6	170.6	71.7	0	0	0	108.4	L443 I454 I520 Y561 E562 I563	L441-L443 HydrophobicContact CD1-CD2 4Å; L441-L443 HydrophobicContact CD2-CD1 4.38Å; L441-L443 HydrophobicContact CD2-CD2 4.06Å; L441-L443 HydrophobicContact CD2-CG 4.36Å; L441-L443 HydrophobicContact CG-CD1 4.48Å; L441-L443 HydrophobicContact CG-CD2 3.89Å; L441-L443 HydrophobicContact CG-CG 4.05Å; L441-I454 HydrophobicContact CD2-CB 4.43Å; L441-I454 HydrophobicContact CD2-CD1 3.39Å; L441-I454 VanDerWaalsContact CD2-CD1 3.4Å; L441-I454 HydrophobicContact CD2-CG1 3.73Å; L441-I454 HydrophobicContact CD2-CG2 3.95Å; L441-I520 HydrophobicContact CB-CB 4.43Å; L441-I520 HydrophobicContact CD2-CD1 4.43Å; L441-I520 PolarHBondContact N-O 3.11Å; L441-I520 PolarHBondContact O-N 3.13Å; L441-Y561 HydrophobicContact CD1-CD2 3.78Å; L441-Y561 HydrophobicContact CD1-CG 4.23Å; L441-E562 CarbonylContact C-O 3.56Å; L441-E562 WeakPolarHBondContact CA-O 3.31Å; L441-I563 HydrophobicContact CD1-CD1 4.04Å; L441-I563 HydrophobicContact CD1-CG1 3.59Å
442	E	79.9	Confident	66.4	Low	80.5 Å²	80.5	44.4 Å²	44.4	38%	0.376	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	129.9	175.8	-52.1	-164.3	156.2	0	0	108.6	V440 N519 Y561 E562	V440-E442 HydrophobicContact CG1-CG 4.07Å; E442-N519 WeakPolarHBondContact CA-OD1 3.38Å; E442-N519 WeakPolarHBondContact CB-OD1 3.43Å; E442-N519 WeakPolarHBondContact CG-OD1 3.32Å; E442-N519 PolarHBondContact OE1-ND2 3.13Å; E442-Y561 CarbonylContact O-C 3.53Å; E442-Y561 WeakPolarHBondContact O-CA 3.32Å; E442-Y561 WeakPolarHBondContact O-CB 3.21Å; E442-E562 HydrophobicContact CB-CB 4.44Å; E442-E562 PolarHBondContact N-O 2.77Å; E442-E562 PolarHBondContact O-N 2.9Å
443	L	77.5	Confident	67.6	Low	2 Å²	2	42.6 Å²	42.6	1%	0.01	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	127.5	-174.3	-59.3	164	0	0	0	109.8	L441 L445 I452 I454 Q517 M518 I520 A554 V558	L441-L443 HydrophobicContact CD1-CD2 4Å; L441-L443 HydrophobicContact CD2-CD1 4.38Å; L441-L443 HydrophobicContact CD2-CD2 4.06Å; L441-L443 HydrophobicContact CD2-CG 4.36Å; L441-L443 HydrophobicContact CG-CD1 4.48Å; L441-L443 HydrophobicContact CG-CD2 3.89Å; L441-L443 HydrophobicContact CG-CG 4.05Å; L443-L445 HydrophobicContact CB-CD2 4.47Å; L443-I452 HydrophobicContact CD1-CD1 4.43Å; L443-I454 HydrophobicContact CD1-CD1 4.27Å; L443-Q517 CarbonylContact O-C 3.48Å; L443-Q517 VanDerWaalsContact O-CA 3.27Å; L443-Q517 WeakPolarHBondContact O-CA 3.17Å; L443-M518 HydrophobicContact CB-CB 4.38Å; L443-M518 VanDerWaalsContact CB-O 3.28Å; L443-M518 WeakPolarHBondContact CB-O 3.37Å; L443-M518 HydrophobicContact CD1-CE 3.61Å; L443-M518 HydrophobicContact CD1-CG 4.46Å; L443-M518 PolarHBondContact N-O 2.89Å; L443-M518 PolarHBondContact O-N 3.03Å; L443-I520 HydrophobicContact CD1-CD1 3.77Å; L443-I520 HydrophobicContact CD1-CG1 3.98Å; L443-A554 HydrophobicContact CD2-CB 4.08Å; L443-V558 HydrophobicContact CD2-CG1 4.04Å; L443-V558 HydrophobicContact CD2-CG2 4.2Å
444	S	76	Confident	68.9	Low	29 Å²	29	37.6 Å²	37.6	20%	0.203	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	134.5	158.8	-55.1	0	0	0	0	109.3	K516 E559 S560	S444-K516 CarbonylContact C-O 3.58Å; S444-K516 VanDerWaalsContact CA-O 3.29Å; S444-K516 WeakPolarHBondContact CA-O 3.35Å; S444-E559 PolarHBondContact O-N 2.74Å; S444-S560 VanDerWaalsContact CB-OG 3.27Å; S444-S560 WeakPolarHBondContact CB-OG 3.4Å; S444-S560 PolarHBondContact N-O 2.74Å; S444-S560 PolarHBondContact OG-OG 3.32Å
445	L	73.5	Confident	69.8	Low	6 Å²	6	36.8 Å²	36.8	3%	0.031	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	135.8	-177.9	-62.8	-179.9	0	0	0	111	L443 A449 I452 F470 I513 K516 M518 V558	L443-L445 HydrophobicContact CB-CD2 4.47Å; L445-A449 HydrophobicContact CB-CB 4.06Å; L445-A449 HydrophobicContact CD1-CB 4.44Å; L445-I452 HydrophobicContact CD2-CG2 3.7Å; L445-F470 HydrophobicContact CD1-CE1 4.37Å; L445-F470 HydrophobicContact CD1-CE2 3.9Å; L445-F470 HydrophobicContact CD1-CZ 3.72Å; L445-F470 HydrophobicContact CD2-CE2 4.24Å; L445-F470 HydrophobicContact CD2-CZ 4.22Å; L445-I513 HydrophobicContact CD1-CG2 4.41Å; L445-K516 PolarHBondContact N-O 3.15Å; L445-M518 HydrophobicContact CD1-CB 4.32Å; L445-M518 HydrophobicContact CD1-CE 4.34Å; L445-M518 HydrophobicContact CD1-SD 4.45Å; L445-V558 HydrophobicContact CD2-CG2 4.43Å
446	K	69.3	Low	70.7	Confident	66.5 Å²	66.5	33.1 Å²	33.1	29%	0.289	21%	0.209	S	C	.	.			trans	-64	140.1	173.4	-65.2	-173	174.7	-167.3	0	110.2	G448 A449 N557 V558 E559	K446-G448 PolarHBondContact O-N 3.11Å; K446-A449 WeakPolarHBondContact O-CA 3.4Å; K446-A449 VanDerWaalsContact O-CB 3.28Å; K446-A449 WeakPolarHBondContact O-CB 3.34Å; K446-A449 PolarHBondContact O-N 3.11Å; K446-N557 WeakPolarHBondContact CG-O 3.43Å; K446-N557 PolarHBondContact N-O 2.94Å; K446-V558 VanDerWaalsContact CE-O 3.23Å; K446-V558 WeakPolarHBondContact CE-O 3.37Å; K446-E559 HydrophobicContact CG-CB 3.82Å; K446-E559 HydrophobicContact CG-CG 4.44Å
447	A	66.1	Low	70.7	Confident	100.5 Å²	100.5	33 Å²	33	83%	0.831	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.2	128.2	176.6	0	0	0	0	0	112.2
448	G	62.8	Low	70.2	Confident	72.5 Å²	72.5	31.6 Å²	31.6	75%	0.747	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	75.4	22.5	-174.9	0	0	0	0	0	114.8	K446 S450	K446-G448 PolarHBondContact O-N 3.11Å; G448-S450 PolarHBondContact O-N 3.17Å
449	A	63	Low	69	Low	23.5 Å²	23.5	33.3 Å²	33.3	19%	0.194	21%	0.209	C	C	.	.			trans	-49	132.1	175.8	0	0	0	0	0	112.3	L445 K446 F470 N557	L445-A449 HydrophobicContact CB-CB 4.06Å; L445-A449 HydrophobicContact CD1-CB 4.44Å; K446-A449 WeakPolarHBondContact O-CA 3.4Å; K446-A449 VanDerWaalsContact O-CB 3.28Å; K446-A449 WeakPolarHBondContact O-CB 3.34Å; K446-A449 PolarHBondContact O-N 3.11Å; A449-F470 HydrophobicContact CB-CD2 3.93Å; A449-F470 HydrophobicContact CB-CE2 3.89Å; A449-F470 WeakPolarHBondContact O-CD2 3.38Å; A449-N557 HydrophobicContact CB-CB 3.56Å
450	S	66.9	Low	67.6	Low	34.5 Å²	34.5	38.2 Å²	38.2	24%	0.241	24%	0.243	C	C	.	.			trans	-118.2	-22.7	178.7	60.9	0	0	0	0	113.5	G448 N469 F470 N557	G448-S450 PolarHBondContact O-N 3.17Å; S450-N469 WeakPolarHBondContact O-CA 3.35Å; S450-N469 PolarHBondContact O-OD1 2.86Å; S450-F470 PolarHBondContact O-N 2.81Å; S450-N557 PolarHBondContact N-OD1 2.68Å; S450-N557 PolarHBondContact OG-OD1 3.02Å
451	K	68.9	Low	66	Low	60 Å²	60	40.8 Å²	40.8	26%	0.261	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	142	-176.3	176.7	165.4	171.4	160.6	0	112.9	I453 E467 G468 N557	K451-I453 VanDerWaalsContact CE-CG1 3.48Å; K451-I453 HydrophobicContact CG-CG1 4.48Å; K451-E467 VanDerWaalsContact CE-OE1 3.32Å; K451-E467 WeakPolarHBondContact CE-OE1 3.48Å; K451-E467 VanDerWaalsContact CE-OE2 3.26Å; K451-E467 WeakPolarHBondContact CE-OE2 3.4Å; K451-E467 IonicContact NZ-OE1 2.74Å; K451-E467 PolarHBondContact NZ-OE1 2.83Å; K451-E467 IonicContact NZ-OE2 3Å; K451-E467 PolarHBondContact NZ-OE2 2.84Å; K451-G468 CarbonylContact C-O 3.58Å; K451-G468 VanDerWaalsContact CA-O 3.22Å; K451-G468 WeakPolarHBondContact CA-O 3.18Å; K451-N557 PolarHBondContact N-OD1 2.82Å; K451-N557 WeakPolarHBondContact O-CB 3.21Å; K451-N557 PolarHBondContact O-N 3.06Å; K451-N557 PolarHBondContact O-OD1 3.17Å
452	I	70.8	Confident	64.9	Low	0 Å²	0	41.3 Å²	41.3	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	153.3	162.2	52.6	161.1	0	0	0	110.6	L443 L445 I454 E467 G468 F470 M518 I520 G555 V558	L443-I452 HydrophobicContact CD1-CD1 4.43Å; L445-I452 HydrophobicContact CD2-CG2 3.7Å; I452-I454 HydrophobicContact CD1-CD1 3.94Å; I452-E467 WeakPolarHBondContact O-CA 3.26Å; I452-G468 PolarHBondContact N-O 2.96Å; I452-G468 PolarHBondContact O-N 2.94Å; I452-F470 HydrophobicContact CB-CE2 4.46Å; I452-F470 HydrophobicContact CB-CZ 4.28Å; I452-F470 HydrophobicContact CD1-CE1 4.26Å; I452-F470 HydrophobicContact CD1-CZ 4.16Å; I452-F470 HydrophobicContact CG1-CE1 4.3Å; I452-F470 HydrophobicContact CG1-CE2 4.31Å; I452-F470 HydrophobicContact CG1-CZ 3.8Å; I452-F470 HydrophobicContact CG2-CE2 3.78Å; I452-F470 HydrophobicContact CG2-CZ 3.61Å; I452-M518 HydrophobicContact CD1-CE 3.58Å; I452-M518 HydrophobicContact CD1-SD 4.05Å; I452-M518 HydrophobicContact CG1-CE 4.41Å; I452-M518 HydrophobicContact CG2-CE 4.5Å; I452-I520 HydrophobicContact CD1-CD1 4.14Å; I452-G555 CarbonylContact C-O 3.39Å; I452-G555 WeakPolarHBondContact CA-O 3.4Å; I452-V558 HydrophobicContact CB-CG2 4.5Å; I452-V558 HydrophobicContact CG2-CG2 3.81Å
453	I	70.9	Confident	63.8	Low	43.5 Å²	43.5	38.4 Å²	38.4	22%	0.223	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	131.7	169.6	-52.2	175.1	0	0	0	107.5	K451 R465 L466 A554 G555	K451-I453 VanDerWaalsContact CE-CG1 3.48Å; K451-I453 HydrophobicContact CG-CG1 4.48Å; I453-R465 HydrophobicContact CG2-CG 4.14Å; I453-L466 CarbonylContact C-O 3.52Å; I453-L466 VanDerWaalsContact CA-O 3.23Å; I453-L466 WeakPolarHBondContact CA-O 3.31Å; I453-A554 CarbonylContact O-C 3.57Å; I453-A554 VanDerWaalsContact O-CA 3.3Å; I453-A554 WeakPolarHBondContact O-CA 3.19Å; I453-G555 PolarHBondContact N-O 2.75Å; I453-G555 PolarHBondContact O-N 3.02Å
454	I	70.1	Confident	63.2	Low	6.5 Å²	6.5	38.6 Å²	38.6	3%	0.033	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	119.2	171.3	-61	144.5	0	0	0	108.9	L441 L443 I452 L456 R465 L466 I520 I552 T553 A554	L441-I454 HydrophobicContact CD2-CB 4.43Å; L441-I454 HydrophobicContact CD2-CD1 3.39Å; L441-I454 VanDerWaalsContact CD2-CD1 3.4Å; L441-I454 HydrophobicContact CD2-CG1 3.73Å; L441-I454 HydrophobicContact CD2-CG2 3.95Å; L443-I454 HydrophobicContact CD1-CD1 4.27Å; I452-I454 HydrophobicContact CD1-CD1 3.94Å; I454-L456 HydrophobicContact CG2-CD2 4.23Å; I454-R465 CarbonylContact O-C 3.49Å; I454-R465 VanDerWaalsContact O-CA 3.31Å; I454-R465 WeakPolarHBondContact O-CA 3.27Å; I454-L466 HydrophobicContact CB-CB 4.09Å; I454-L466 HydrophobicContact CD1-CB 4.32Å; I454-L466 HydrophobicContact CD1-CD2 3.81Å; I454-L466 HydrophobicContact CD1-CG 4.45Å; I454-L466 PolarHBondContact N-O 3.45Å; I454-L466 PolarHBondContact O-N 2.81Å; I454-I520 HydrophobicContact CD1-CD1 3.52Å; I454-I552 HydrophobicContact CG2-CG2 4.13Å; I454-T553 CarbonylContact C-O 3.5Å; I454-T553 WeakPolarHBondContact CA-O 3.16Å; I454-A554 HydrophobicContact CG1-CB 3.97Å
455	D	69.8	Low	62.9	Low	23 Å²	23	39.6 Å²	39.6	12%	0.123	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	123.2	177.8	-68.8	-14.7	0	0	0	110.4	N457 V462 V463 W464 R465 I552 T553	D455-N457 PolarHBondContact O-ND2 2.86Å; D455-N457 VanDerWaalsContact O-ND2 3.1Å; D455-V462 HydrophobicContact CB-CG1 3.91Å; D455-V462 HydrophobicContact CB-CG2 4.42Å; D455-V463 HydrophobicContact CB-CG1 3.77Å; D455-W464 CarbonylContact C-O 3.52Å; D455-W464 VanDerWaalsContact CA-O 3.24Å; D455-W464 WeakPolarHBondContact CA-O 3.38Å; D455-R465 VanDerWaalsContact CG-NH2 3.32Å; D455-R465 WeakPolarHBondContact OD1-CB 3.31Å; D455-R465 WeakPolarHBondContact OD1-CG 3.26Å; D455-R465 IonicContact OD1-CZ 3.12Å; D455-R465 IonicContact OD1-NE 2.97Å; D455-R465 PolarHBondContact OD1-NE 2.75Å; D455-R465 IonicContact OD1-NH2 2.73Å; D455-R465 PolarHBondContact OD1-NH2 2.88Å; D455-R465 VanDerWaalsContact OD1-NH2 3.15Å; D455-R465 IonicContact OD2-CZ 3.73Å; D455-R465 IonicContact OD2-NE 2.67Å; D455-R465 IonicContact OD2-NH2 3.38Å; D455-R465 PolarHBondContact OD2-NH2 2.97Å; D455-I552 CarbonylContact O-C 3.6Å; D455-I552 WeakPolarHBondContact O-CA 3.33Å; D455-T553 WeakPolarHBondContact CB-OG1 3.39Å; D455-T553 PolarHBondContact N-O 2.94Å; D455-T553 PolarHBondContact O-N 2.94Å
456	L	67.1	Low	62.6	Low	32.5 Å²	32.5	39.7 Å²	39.7	17%	0.17	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	116	167.1	-49.9	129.9	0	0	0	108.5	I454 V463 W464 F531 V549 I552	I454-L456 HydrophobicContact CG2-CD2 4.23Å; L456-V463 CarbonylContact O-C 3.59Å; L456-V463 WeakPolarHBondContact O-CA 3.24Å; L456-V463 PolarHBondContact O-N 2.93Å; L456-W464 HydrophobicContact CB-CB 4.1Å; L456-W464 HydrophobicContact CD1-CB 3.97Å; L456-W464 HydrophobicContact CG-CB 4.38Å; L456-W464 PolarHBondContact N-O 2.99Å; L456-W464 PolarHBondContact O-N 2.8Å; L456-F531 HydrophobicContact CD1-CE1 4.32Å; L456-F531 HydrophobicContact CD1-CZ 4.09Å; L456-V549 HydrophobicContact CB-CG1 4.07Å; L456-V549 HydrophobicContact CB-CG2 4.34Å; L456-V549 HydrophobicContact CD2-CG1 4.39Å; L456-I552 HydrophobicContact CD2-CB 4.27Å; L456-I552 HydrophobicContact CD2-CD1 4.1Å; L456-I552 HydrophobicContact CD2-CG1 3.98Å; L456-I552 HydrophobicContact CD2-CG2 3.84Å; L456-I552 HydrophobicContact CG-CD1 4.48Å; L456-I552 HydrophobicContact CG-CG1 4.09Å
457	N	58.9	Low	62.6	Low	37 Å²	37	38.8 Å²	38.8	20%	0.198	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	128.8	-172.4	-58.1	-97.9	0	0	0	110.9	D455 T461 V462 V463 K550 V551	D455-N457 PolarHBondContact O-ND2 2.86Å; D455-N457 VanDerWaalsContact O-ND2 3.1Å; N457-T461 CarbonylContact C-O 3.5Å; N457-T461 VanDerWaalsContact CA-O 3.24Å; N457-T461 WeakPolarHBondContact CA-O 3.4Å; N457-V462 WeakPolarHBondContact CA-O 3.34Å; N457-V463 VanDerWaalsContact OD1-CG2 3.32Å; N457-V463 WeakPolarHBondContact OD1-CG2 3.25Å; N457-K550 PolarHBondContact O-N 3.09Å; N457-V551 HydrophobicContact CB-CB 4.27Å; N457-V551 WeakPolarHBondContact CB-O 3.5Å; N457-V551 PolarHBondContact N-O 2.93Å; N457-V551 PolarHBondContact ND2-O 2.95Å; N457-V551 PolarHBondContact O-N 3.11Å
458	S	55.9	Low	62.6	Low	4.5 Å²	4.5	34 Å²	34	3%	0.031	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	115.1	169	115.7	0	0	0	0	108.6	C460 T461 V462 V463 S547 E548	S458-C460 PolarHBondContact O-N 3.02Å; S458-C460 VanDerWaalsContact O-N 3.16Å; S458-T461 PolarHBondContact N-O 3.05Å; S458-T461 PolarHBondContact O-N 2.84Å; S458-T461 PolarHBondContact O-OG1 2.79Å; S458-V462 PolarHBondContact N-O 2.84Å; S458-V462 PolarHBondContact O-N 2.73Å; S458-V462 WeakPolarHBondContact OG-CB 3.39Å; S458-V462 WeakPolarHBondContact OG-CG1 3.46Å; S458-V463 VanDerWaalsContact CB-CG2 3.4Å; S458-S547 WeakPolarHBondContact CB-OG 3.48Å; S458-S547 PolarHBondContact OG-OG 3.34Å; S458-S547 VanDerWaalsContact OG-OG 3.1Å; S458-E548 VanDerWaalsContact CA-O 3.26Å; S458-E548 WeakPolarHBondContact CA-O 3.39Å; S458-E548 WeakPolarHBondContact CB-O 3.26Å; S458-E548 PolarHBondContact OG-O 3Å; S458-E548 VanDerWaalsContact OG-O 3.05Å
459	D	50.5	Low	62.8	Low	48.5 Å²	48.5	32.8 Å²	32.8	26%	0.259	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.2	116.2	179.1	-65.9	-38	0	0	0	114.8	T461 K550 L608 G611	D459-T461 PolarHBondContact O-N 2.87Å; D459-K550 WeakPolarHBondContact OD1-CD 3.22Å; D459-K550 VanDerWaalsContact OD1-CE 3.26Å; D459-K550 WeakPolarHBondContact OD1-CE 3.44Å; D459-K550 IonicContact OD1-NZ 3.33Å; D459-K550 PolarHBondContact OD1-NZ 3.05Å; D459-K550 WeakPolarHBondContact OD2-CE 3.49Å; D459-K550 IonicContact OD2-NZ 2.8Å; D459-K550 PolarHBondContact OD2-NZ 2.9Å; D459-L608 HydrophobicContact CB-CD1 3.61Å; D459-L608 HydrophobicContact CB-CD2 3.83Å; D459-L608 HydrophobicContact CB-CG 4.35Å; D459-L608 WeakPolarHBondContact O-CD2 3.22Å; D459-L608 WeakPolarHBondContact OD1-CD1 3.45Å; D459-G611 VanDerWaalsContact OD2-CA 3.25Å; D459-G611 WeakPolarHBondContact OD2-CA 3.44Å
460	C	44.8	Very low	62.8	Low	117 Å²	117	33.3 Å²	33.3	79%	0.791	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-0.8	10.1	-175.7	-60.5	0	0	0	0	115.9	S458 W613	S458-C460 PolarHBondContact O-N 3.02Å; S458-C460 VanDerWaalsContact O-N 3.16Å; C460-W613 VanDerWaalsContact SG-CH2 3.52Å; C460-W613 WeakPolarHBondContact SG-CZ2 3.4Å
461	T	45.4	Very low	62.5	Low	59.5 Å²	59.5	41.6 Å²	41.6	37%	0.365	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	60.1	-175.9	69.9	0	0	0	0	113.2	N457 S458 D459 V463 L495	N457-T461 CarbonylContact C-O 3.5Å; N457-T461 VanDerWaalsContact CA-O 3.24Å; N457-T461 WeakPolarHBondContact CA-O 3.4Å; S458-T461 PolarHBondContact N-O 3.05Å; S458-T461 PolarHBondContact O-N 2.84Å; S458-T461 PolarHBondContact O-OG1 2.79Å; D459-T461 PolarHBondContact O-N 2.87Å; T461-V463 PolarHBondContact O-N 3Å; T461-L495 HydrophobicContact CG2-CD1 3.75Å
462	V	54.1	Low	62.1	Low	19.5 Å²	19.5	41.8 Å²	41.8	12%	0.118	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	119.9	174.8	179.8	0	0	0	0	108.6	D455 N457 S458 W464 R465 N480 W500 P545	D455-V462 HydrophobicContact CB-CG1 3.91Å; D455-V462 HydrophobicContact CB-CG2 4.42Å; N457-V462 WeakPolarHBondContact CA-O 3.34Å; S458-V462 PolarHBondContact N-O 2.84Å; S458-V462 PolarHBondContact O-N 2.73Å; S458-V462 WeakPolarHBondContact OG-CB 3.39Å; S458-V462 WeakPolarHBondContact OG-CG1 3.46Å; V462-W464 WeakPolarHBondContact CG1-O 3.33Å; V462-R465 HydrophobicContact CG1-CB 4.33Å; V462-N480 HydrophobicContact CG1-CB 4.35Å; V462-N480 PolarHBondContact O-ND2 2.86Å; V462-W500 HydrophobicContact CB-CH2 4.19Å; V462-W500 HydrophobicContact CG1-CH2 3.85Å; V462-W500 HydrophobicContact CG1-CZ2 4.45Å; V462-P545 HydrophobicContact CG1-CG 4.01Å
463	V	58.2	Low	61.5	Low	20 Å²	20	48.2 Å²	48.2	12%	0.121	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	43.9	-179.9	-168.8	0	0	0	0	109.8	D455 L456 N457 S458 T461 N480 P545	D455-V463 HydrophobicContact CB-CG1 3.77Å; L456-V463 CarbonylContact O-C 3.59Å; L456-V463 WeakPolarHBondContact O-CA 3.24Å; L456-V463 PolarHBondContact O-N 2.93Å; N457-V463 VanDerWaalsContact OD1-CG2 3.32Å; N457-V463 WeakPolarHBondContact OD1-CG2 3.25Å; S458-V463 VanDerWaalsContact CB-CG2 3.4Å; T461-V463 PolarHBondContact O-N 3Å; V463-N480 WeakPolarHBondContact O-CB 3.35Å; V463-N480 PolarHBondContact O-N 3.04Å; V463-N480 VanDerWaalsContact O-N 3.16Å; V463-N480 PolarHBondContact O-ND2 2.85Å; V463-P545 HydrophobicContact CG1-CB 3.72Å; V463-P545 HydrophobicContact CG1-CG 3.75Å
464	W	64.4	Low	60.7	Low	7.5 Å²	7.5	47.9 Å²	47.9	3%	0.028	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	136.1	171.6	-70.1	60.1	0	0	0	108.8	D455 L456 V462 I477 L479 L481 V529 F531 Y542 L544	D455-W464 CarbonylContact C-O 3.52Å; D455-W464 VanDerWaalsContact CA-O 3.24Å; D455-W464 WeakPolarHBondContact CA-O 3.38Å; L456-W464 HydrophobicContact CB-CB 4.1Å; L456-W464 HydrophobicContact CD1-CB 3.97Å; L456-W464 HydrophobicContact CG-CB 4.38Å; L456-W464 PolarHBondContact N-O 2.99Å; L456-W464 PolarHBondContact O-N 2.8Å; V462-W464 WeakPolarHBondContact CG1-O 3.33Å; W464-I477 HydrophobicContact CE3-CG2 3.64Å; W464-I477 HydrophobicContact CZ3-CG2 3.71Å; W464-L479 HydrophobicContact CD2-CD2 3.72Å; W464-L479 HydrophobicContact CE3-CD2 3.25Å; W464-L479 VanDerWaalsContact CE3-CD2 3.4Å; W464-L479 HydrophobicContact CG-CD2 4.45Å; W464-L479 HydrophobicContact CH2-CD2 3.75Å; W464-L479 VanDerWaalsContact CH2-CD2 3.44Å; W464-L479 HydrophobicContact CZ2-CD2 3.66Å; W464-L479 HydrophobicContact CZ3-CD2 3.28Å; W464-L481 HydrophobicContact CH2-CD2 3.76Å; W464-L481 HydrophobicContact CZ2-CD2 3.5Å; W464-L481 HydrophobicContact CZ2-CG 4.37Å; W464-V529 HydrophobicContact CE3-CG1 4.16Å; W464-V529 HydrophobicContact CH2-CG1 3.31Å; W464-V529 HydrophobicContact CZ2-CG1 3.91Å; W464-V529 VanDerWaalsContact CZ2-CG1 3.45Å; W464-V529 HydrophobicContact CZ3-CG1 3.68Å; W464-F531 HydrophobicContact CE3-CE2 4.24Å; W464-F531 AromaticContact CE3-CZ 3.9Å; W464-F531 HydrophobicContact CE3-CZ 4.12Å; W464-F531 AromaticContact CH2-CE2 3.93Å; W464-F531 HydrophobicContact CH2-CE2 3.93Å; W464-F531 HydrophobicContact CH2-CZ 4.32Å; W464-F531 AromaticContact CZ3-CE2 3.36Å; W464-F531 HydrophobicContact CZ3-CE2 3.82Å; W464-F531 AromaticContact CZ3-CZ 3.54Å; W464-F531 HydrophobicContact CZ3-CZ 3.54Å; W464-Y542 HydrophobicContact CH2-CG 4.35Å; W464-Y542 HydrophobicContact CZ3-CD2 4.13Å; W464-Y542 HydrophobicContact CZ3-CG 4.28Å; W464-L544 HydrophobicContact CH2-CD2 4.42Å; W464-L544 HydrophobicContact CZ2-CD2 4.22Å
465	R	68.8	Low	60	Low	48.5 Å²	48.5	47.7 Å²	47.7	18%	0.183	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	129.4	169.1	168.1	168.3	-67.5	159.1	5.8	110.6	I453 I454 D455 V462 E467 I477 D478 W500	I453-R465 HydrophobicContact CG2-CG 4.14Å; I454-R465 CarbonylContact O-C 3.49Å; I454-R465 VanDerWaalsContact O-CA 3.31Å; I454-R465 WeakPolarHBondContact O-CA 3.27Å; D455-R465 VanDerWaalsContact CG-NH2 3.32Å; D455-R465 WeakPolarHBondContact OD1-CB 3.31Å; D455-R465 WeakPolarHBondContact OD1-CG 3.26Å; D455-R465 IonicContact OD1-CZ 3.12Å; D455-R465 IonicContact OD1-NE 2.97Å; D455-R465 PolarHBondContact OD1-NE 2.75Å; D455-R465 IonicContact OD1-NH2 2.73Å; D455-R465 PolarHBondContact OD1-NH2 2.88Å; D455-R465 VanDerWaalsContact OD1-NH2 3.15Å; D455-R465 IonicContact OD2-CZ 3.73Å; D455-R465 IonicContact OD2-NE 2.67Å; D455-R465 IonicContact OD2-NH2 3.38Å; D455-R465 PolarHBondContact OD2-NH2 2.97Å; V462-R465 HydrophobicContact CG1-CB 4.33Å; R465-E467 HydrophobicContact CG-CB 4.44Å; R465-I477 CarbonylContact O-C 3.55Å; R465-I477 WeakPolarHBondContact O-CA 3.37Å; R465-D478 HydrophobicContact CB-CB 4.12Å; R465-D478 HydrophobicContact CG-CB 4.43Å; R465-D478 PolarHBondContact N-O 3.16Å; R465-D478 PolarHBondContact O-N 3.09Å; R465-W500 HydrophobicContact CB-CH2 3.85Å; R465-W500 HydrophobicContact CB-CZ2 4.15Å; R465-W500 HydrophobicContact CB-CZ3 3.86Å; R465-W500 HydrophobicContact CG-CH2 4.43Å
466	L	68.9	Low	59.4	Low	8.5 Å²	8.5	48.3 Å²	48.3	5%	0.045	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	119.2	164.2	-164.4	74.9	0	0	0	108	I453 I454 L475 F476 I477 I520	I453-L466 CarbonylContact C-O 3.52Å; I453-L466 VanDerWaalsContact CA-O 3.23Å; I453-L466 WeakPolarHBondContact CA-O 3.31Å; I454-L466 HydrophobicContact CB-CB 4.09Å; I454-L466 HydrophobicContact CD1-CB 4.32Å; I454-L466 HydrophobicContact CD1-CD2 3.81Å; I454-L466 HydrophobicContact CD1-CG 4.45Å; I454-L466 PolarHBondContact N-O 3.45Å; I454-L466 PolarHBondContact O-N 2.81Å; L466-L475 HydrophobicContact CD1-CD2 3.86Å; L466-L475 HydrophobicContact CD1-CG 3.97Å; L466-L475 HydrophobicContact CD2-CD2 3.56Å; L466-L475 HydrophobicContact CG-CD2 4.1Å; L466-F476 CarbonylContact C-O 3.54Å; L466-F476 WeakPolarHBondContact CA-O 3.49Å; L466-I477 HydrophobicContact CD1-CB 4.39Å; L466-I477 HydrophobicContact CD1-CD1 3.6Å; L466-I477 VanDerWaalsContact CD1-CD1 3.44Å; L466-I477 HydrophobicContact CD1-CG1 3.56Å; L466-I477 HydrophobicContact CD1-CG2 4.25Å; L466-I520 HydrophobicContact CD2-CD1 3.76Å; L466-I520 HydrophobicContact CD2-CG2 4.31Å
467	E	69.3	Low	58.8	Low	47 Å²	47	46.8 Å²	46.8	22%	0.22	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	109.6	174.3	176.2	163.7	145.2	0	0	109.9	K451 I452 R465 F476	K451-E467 VanDerWaalsContact CE-OE1 3.32Å; K451-E467 WeakPolarHBondContact CE-OE1 3.48Å; K451-E467 VanDerWaalsContact CE-OE2 3.26Å; K451-E467 WeakPolarHBondContact CE-OE2 3.4Å; K451-E467 IonicContact NZ-OE1 2.74Å; K451-E467 PolarHBondContact NZ-OE1 2.83Å; K451-E467 IonicContact NZ-OE2 3Å; K451-E467 PolarHBondContact NZ-OE2 2.84Å; I452-E467 WeakPolarHBondContact O-CA 3.26Å; R465-E467 HydrophobicContact CG-CB 4.44Å; E467-F476 HydrophobicContact CB-CB 4.43Å; E467-F476 PolarHBondContact N-O 2.91Å; E467-F476 WeakPolarHBondContact O-CB 3.38Å; E467-F476 PolarHBondContact O-N 2.81Å
468	G	65.6	Low	58.5	Low	0 Å²	0	46 Å²	46	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	133.9	175.6	0	0	0	0	0	111.3	K451 I452	K451-G468 CarbonylContact C-O 3.58Å; K451-G468 VanDerWaalsContact CA-O 3.22Å; K451-G468 WeakPolarHBondContact CA-O 3.18Å; I452-G468 PolarHBondContact N-O 2.96Å; I452-G468 PolarHBondContact O-N 2.94Å
469	N	66.5	Low	58.1	Low	48 Å²	48	45.9 Å²	45.9	26%	0.257	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	102.2	171.7	-179.2	-14.3	0	0	0	109.8	S450 R471 T472 K473 L474	S450-N469 WeakPolarHBondContact O-CA 3.35Å; S450-N469 PolarHBondContact O-OD1 2.86Å; N469-R471 VanDerWaalsContact C-N 3.3Å; N469-R471 PolarHBondContact O-N 3.28Å; N469-R471 WeakPolarHBondContact OD1-CB 3.36Å; N469-R471 PolarHBondContact OD1-N 3.21Å; N469-R471 VanDerWaalsContact OD1-N 3.12Å; N469-T472 VanDerWaalsContact CB-OG1 3.31Å; N469-T472 WeakPolarHBondContact CB-OG1 3.25Å; N469-T472 PolarHBondContact ND2-OG1 2.8Å; N469-T472 PolarHBondContact O-N 3.17Å; N469-T472 VanDerWaalsContact O-N 3.15Å; N469-T472 PolarHBondContact O-OG1 3.04Å; N469-T472 PolarHBondContact OD1-N 2.8Å; N469-T472 PolarHBondContact OD1-OG1 2.81Å; N469-K473 PolarHBondContact O-N 2.93Å; N469-L474 PolarHBondContact N-O 3Å; N469-L474 PolarHBondContact O-N 2.9Å
470	F	63.1	Low	57.9	Low	34.5 Å²	34.5	45.9 Å²	45.9	15%	0.151	23%	0.228	C	C	.	.	G	3₁₀ helix	trans	-68	-27.8	-174.9	-53.9	-52.2	0	0	0	112.7	L445 A449 S450 I452 T472 K473 I513 M518	L445-F470 HydrophobicContact CD1-CE1 4.37Å; L445-F470 HydrophobicContact CD1-CE2 3.9Å; L445-F470 HydrophobicContact CD1-CZ 3.72Å; L445-F470 HydrophobicContact CD2-CE2 4.24Å; L445-F470 HydrophobicContact CD2-CZ 4.22Å; A449-F470 HydrophobicContact CB-CD2 3.93Å; A449-F470 HydrophobicContact CB-CE2 3.89Å; A449-F470 WeakPolarHBondContact O-CD2 3.38Å; S450-F470 PolarHBondContact O-N 2.81Å; I452-F470 HydrophobicContact CB-CE2 4.46Å; I452-F470 HydrophobicContact CB-CZ 4.28Å; I452-F470 HydrophobicContact CD1-CE1 4.26Å; I452-F470 HydrophobicContact CD1-CZ 4.16Å; I452-F470 HydrophobicContact CG1-CE1 4.3Å; I452-F470 HydrophobicContact CG1-CE2 4.31Å; I452-F470 HydrophobicContact CG1-CZ 3.8Å; I452-F470 HydrophobicContact CG2-CE2 3.78Å; I452-F470 HydrophobicContact CG2-CZ 3.61Å; F470-T472 PolarHBondContact O-N 2.9Å; F470-K473 PolarHBondContact O-N 3.2Å; F470-I513 HydrophobicContact CD1-CD1 3.85Å; F470-I513 HydrophobicContact CD1-CG2 3.76Å; F470-I513 HydrophobicContact CE1-CD1 4.06Å; F470-I513 HydrophobicContact CE1-CG2 3.68Å; F470-I513 HydrophobicContact CG-CG2 4.49Å; F470-I513 HydrophobicContact CZ-CG2 4.41Å; F470-M518 HydrophobicContact CE1-CE 3.91Å; F470-M518 HydrophobicContact CE1-SD 3.97Å; F470-M518 HydrophobicContact CZ-CE 3.72Å; F470-M518 HydrophobicContact CZ-SD 4.2Å
471	R	60.7	Low	57.6	Low	209 Å²	209	42.9 Å²	42.9	79%	0.789	20%	0.204	S	C	*	.	G	3₁₀ helix	trans	-68.8	-22.1	175.6	-70	-173.4	175.4	-170.1	0.4	113.2	N469	N469-R471 VanDerWaalsContact C-N 3.3Å; N469-R471 PolarHBondContact O-N 3.28Å; N469-R471 WeakPolarHBondContact OD1-CB 3.36Å; N469-R471 PolarHBondContact OD1-N 3.21Å; N469-R471 VanDerWaalsContact OD1-N 3.12Å
472	T	59.3	Low	57	Low	62.5 Å²	62.5	49.7 Å²	49.7	38%	0.383	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-105.1	-3.7	179.8	48.2	0	0	0	0	113.9	N469 F470 L474	N469-T472 VanDerWaalsContact CB-OG1 3.31Å; N469-T472 WeakPolarHBondContact CB-OG1 3.25Å; N469-T472 PolarHBondContact ND2-OG1 2.8Å; N469-T472 PolarHBondContact O-N 3.17Å; N469-T472 VanDerWaalsContact O-N 3.15Å; N469-T472 PolarHBondContact O-OG1 3.04Å; N469-T472 PolarHBondContact OD1-N 2.8Å; N469-T472 PolarHBondContact OD1-OG1 2.81Å; F470-T472 PolarHBondContact O-N 2.9Å; T472-L474 PolarHBondContact O-N 3.09Å
473	K	59	Low	56	Low	134.5 Å²	134.5	55.4 Å²	55.4	59%	0.585	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.4	37.6	-166.1	-65.2	-170.4	170.8	-168	0	113	N469 F470 T508 D510	N469-K473 PolarHBondContact O-N 2.93Å; F470-K473 PolarHBondContact O-N 3.2Å; K473-T508 PolarHBondContact O-N 2.65Å; K473-T508 PolarHBondContact O-OG1 2.88Å; K473-D510 IonicContact NZ-OD1 2.75Å; K473-D510 PolarHBondContact NZ-OD1 2.84Å
474	L	53.6	Low	54.6	Low	38.5 Å²	38.5	63.7 Å²	63.7	20%	0.202	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	132.7	-178.5	-67.8	177.9	0	0	0	110.9	N469 T472 F476 Q505	N469-L474 PolarHBondContact N-O 3Å; N469-L474 PolarHBondContact O-N 2.9Å; T472-L474 PolarHBondContact O-N 3.09Å; L474-F476 HydrophobicContact CB-CE2 3.82Å; L474-F476 HydrophobicContact CB-CZ 3.92Å; L474-F476 HydrophobicContact CD1-CE1 4.4Å; L474-F476 HydrophobicContact CD1-CE2 4.37Å; L474-F476 HydrophobicContact CD1-CZ 3.72Å; L474-F476 HydrophobicContact CG-CZ 4.46Å; L474-Q505 HydrophobicContact CD1-CG 4.47Å; L474-Q505 VanDerWaalsContact CD1-NE2 3.33Å; L474-Q505 HydrophobicContact CD2-CG 3.97Å; L474-Q505 VanDerWaalsContact CD2-NE2 3.35Å
475	L	56.2	Low	52.9	Low	1.5 Å²	1.5	67.5 Å²	67.5	1%	0.008	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	137.6	162.9	-120.4	89.9	0	0	0	109.1	L466 M506 T508 I533 V538	L466-L475 HydrophobicContact CD1-CD2 3.86Å; L466-L475 HydrophobicContact CD1-CG 3.97Å; L466-L475 HydrophobicContact CD2-CD2 3.56Å; L466-L475 HydrophobicContact CG-CD2 4.1Å; L475-M506 HydrophobicContact CB-CB 4.32Å; L475-M506 PolarHBondContact N-O 3.03Å; L475-M506 PolarHBondContact O-N 2.87Å; L475-T508 HydrophobicContact CB-CG2 4.32Å; L475-T508 HydrophobicContact CD1-CG2 3.43Å; L475-T508 VanDerWaalsContact CD1-CG2 3.43Å; L475-T508 HydrophobicContact CG-CG2 4.48Å; L475-I533 HydrophobicContact CD1-CD1 3.73Å; L475-I533 HydrophobicContact CD2-CD1 3.49Å; L475-I533 HydrophobicContact CG-CD1 4.25Å; L475-V538 HydrophobicContact CD2-CG2 4.34Å
476	F	56.3	Low	51	Low	36.5 Å²	36.5	70.7 Å²	70.7	16%	0.16	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	130.9	173.9	-58.5	-83.9	0	0	0	108.7	L466 E467 L474 Q503 A504 Q505	L466-F476 CarbonylContact C-O 3.54Å; L466-F476 WeakPolarHBondContact CA-O 3.49Å; E467-F476 HydrophobicContact CB-CB 4.43Å; E467-F476 PolarHBondContact N-O 2.91Å; E467-F476 WeakPolarHBondContact O-CB 3.38Å; E467-F476 PolarHBondContact O-N 2.81Å; L474-F476 HydrophobicContact CB-CE2 3.82Å; L474-F476 HydrophobicContact CB-CZ 3.92Å; L474-F476 HydrophobicContact CD1-CE1 4.4Å; L474-F476 HydrophobicContact CD1-CE2 4.37Å; L474-F476 HydrophobicContact CD1-CZ 3.72Å; L474-F476 HydrophobicContact CG-CZ 4.46Å; F476-Q503 HydrophobicContact CB-CG 4.44Å; F476-Q503 HydrophobicContact CD1-CG 4.28Å; F476-A504 CarbonylContact C-O 3.55Å; F476-A504 WeakPolarHBondContact CA-O 3.4Å; F476-Q505 HydrophobicContact CD1-CB 4.21Å; F476-Q505 HydrophobicContact CD1-CG 4.29Å; F476-Q505 HydrophobicContact CE1-CB 4.19Å; F476-Q505 HydrophobicContact CE1-CG 3.89Å
477	I	54.3	Low	49.1	Very low	1 Å²	1	78 Å²	78	1%	0.005	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	115.1	167.4	-45.3	-159.4	0	0	0	108.6	W464 R465 L466 L479 Q503 A504 M506 F531 Y542	W464-I477 HydrophobicContact CE3-CG2 3.64Å; W464-I477 HydrophobicContact CZ3-CG2 3.71Å; R465-I477 CarbonylContact O-C 3.55Å; R465-I477 WeakPolarHBondContact O-CA 3.37Å; L466-I477 HydrophobicContact CD1-CB 4.39Å; L466-I477 HydrophobicContact CD1-CD1 3.6Å; L466-I477 VanDerWaalsContact CD1-CD1 3.44Å; L466-I477 HydrophobicContact CD1-CG1 3.56Å; L466-I477 HydrophobicContact CD1-CG2 4.25Å; I477-L479 HydrophobicContact CG2-CD2 3.55Å; I477-L479 VanDerWaalsContact CG2-CD2 3.46Å; I477-L479 HydrophobicContact CG2-CG 4.01Å; I477-Q503 WeakPolarHBondContact O-CA 3.18Å; I477-A504 HydrophobicContact CB-CB 4.47Å; I477-A504 PolarHBondContact N-O 2.91Å; I477-A504 PolarHBondContact O-N 3.2Å; I477-M506 HydrophobicContact CB-CE 4.28Å; I477-M506 HydrophobicContact CD1-CE 3.53Å; I477-M506 VanDerWaalsContact CD1-CE 3.49Å; I477-M506 HydrophobicContact CD1-SD 3.65Å; I477-M506 WeakPolarHBondContact CD1-SD 3.34Å; I477-M506 HydrophobicContact CG1-CE 3.64Å; I477-M506 HydrophobicContact CG1-SD 3.73Å; I477-M506 VanDerWaalsContact CG1-SD 3.58Å; I477-F531 HydrophobicContact CD1-CB 4.44Å; I477-F531 HydrophobicContact CD1-CD2 3.82Å; I477-F531 HydrophobicContact CD1-CE2 4.14Å; I477-F531 HydrophobicContact CD1-CG 4.24Å; I477-Y542 HydrophobicContact CD1-CE2 4.45Å
478	D	54.6	Low	47.2	Very low	18.5 Å²	18.5	84.8 Å²	84.8	10%	0.099	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	112	173.4	-80.5	-31.4	0	0	0	109.5	R465 W500 Q503	R465-D478 HydrophobicContact CB-CB 4.12Å; R465-D478 HydrophobicContact CG-CB 4.43Å; R465-D478 PolarHBondContact N-O 3.16Å; R465-D478 PolarHBondContact O-N 3.09Å; D478-W500 HydrophobicContact CB-CB 4.41Å; D478-W500 HydrophobicContact CB-CD2 3.9Å; D478-W500 HydrophobicContact CB-CE3 3.69Å; D478-W500 HydrophobicContact CB-CG 4.15Å; D478-W500 HydrophobicContact CB-CH2 4.22Å; D478-W500 HydrophobicContact CB-CZ2 4.49Å; D478-W500 HydrophobicContact CB-CZ3 4.02Å; D478-W500 WeakPolarHBondContact O-CZ3 3.34Å; D478-Q503 WeakPolarHBondContact OD1-CA 3.02Å; D478-Q503 WeakPolarHBondContact OD1-CB 3.4Å; D478-Q503 VanDerWaalsContact OD1-CG 3.32Å; D478-Q503 WeakPolarHBondContact OD1-CG 3.44Å
479	L	45.9	Very low	45.5	Very low	2.5 Å²	2.5	89.2 Å²	89.2	1%	0.013	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	125.6	-172.5	-61.5	174.7	0	0	0	112.2	W464 I477 L481 K502 Y542	W464-L479 HydrophobicContact CD2-CD2 3.72Å; W464-L479 HydrophobicContact CE3-CD2 3.25Å; W464-L479 VanDerWaalsContact CE3-CD2 3.4Å; W464-L479 HydrophobicContact CG-CD2 4.45Å; W464-L479 HydrophobicContact CH2-CD2 3.75Å; W464-L479 VanDerWaalsContact CH2-CD2 3.44Å; W464-L479 HydrophobicContact CZ2-CD2 3.66Å; W464-L479 HydrophobicContact CZ3-CD2 3.28Å; I477-L479 HydrophobicContact CG2-CD2 3.55Å; I477-L479 VanDerWaalsContact CG2-CD2 3.46Å; I477-L479 HydrophobicContact CG2-CG 4.01Å; L479-L481 HydrophobicContact CB-CD1 4.05Å; L479-L481 HydrophobicContact CB-CG 4.12Å; L479-L481 HydrophobicContact CD1-CD1 4Å; L479-K502 HydrophobicContact CB-CB 4.34Å; L479-K502 HydrophobicContact CD1-CD 4.27Å; L479-K502 PolarHBondContact N-O 3.06Å; L479-K502 PolarHBondContact O-N 2.75Å; L479-Y542 HydrophobicContact CD1-CD1 3.56Å; L479-Y542 VanDerWaalsContact CD1-CD1 3.49Å; L479-Y542 HydrophobicContact CD1-CD2 4.07Å; L479-Y542 HydrophobicContact CD1-CE1 3.59Å; L479-Y542 VanDerWaalsContact CD1-CE1 3.46Å; L479-Y542 HydrophobicContact CD1-CE2 3.89Å; L479-Y542 HydrophobicContact CD1-CG 4.1Å; L479-Y542 HydrophobicContact CD2-CD2 4.43Å
480	N	46.1	Very low	43.6	Very low	50 Å²	50	98.1 Å²	98.1	27%	0.267	48%	0.479	S	S	.	.			trans	-97.8	81.3	168.6	-106.1	-33.1	0	0	0	110.3	V462 V463 W500	V462-N480 HydrophobicContact CG1-CB 4.35Å; V462-N480 PolarHBondContact O-ND2 2.86Å; V463-N480 WeakPolarHBondContact O-CB 3.35Å; V463-N480 PolarHBondContact O-N 3.04Å; V463-N480 VanDerWaalsContact O-N 3.16Å; V463-N480 PolarHBondContact O-ND2 2.85Å; N480-W500 HydrophobicContact CB-CE3 4.14Å; N480-W500 HydrophobicContact CB-CZ3 3.82Å; N480-W500 WeakPolarHBondContact ND2-CZ3 3.44Å
481	L	38.5	Very low	41.8	Very low	53.5 Å²	53.5	101.8 Å²	101.8	28%	0.28	50%	0.504	S	S	.	.			trans	-90	122.6	178.2	-75.3	164.8	0	0	0	111.6	W464 L479 K502 S543 P545	W464-L481 HydrophobicContact CH2-CD2 3.76Å; W464-L481 HydrophobicContact CZ2-CD2 3.5Å; W464-L481 HydrophobicContact CZ2-CG 4.37Å; L479-L481 HydrophobicContact CB-CD1 4.05Å; L479-L481 HydrophobicContact CB-CG 4.12Å; L479-L481 HydrophobicContact CD1-CD1 4Å; L481-K502 HydrophobicContact CD1-CD 4.05Å; L481-S543 WeakPolarHBondContact CD2-O 3.15Å; L481-P545 HydrophobicContact CD2-CG 4.24Å
482	W	32.7	Very low	40.1	Very low	202 Å²	202	99 Å²	99	77%	0.765	50%	0.5	S	S	*	.			trans	-109.4	105.8	171.3	-117.9	2.5	0	0	0	109.4
483	E	33	Very low	38.5	Very low	139 Å²	139	99.1 Å²	99.1	65%	0.65	51%	0.514	S	S	*	.			trans	-110.8	129.4	174	-74.2	-166.8	113	0	0	112.3	S543	E483-S543 VanDerWaalsContact OE1-CB 3.24Å; E483-S543 WeakPolarHBondContact OE1-CB 3.38Å; E483-S543 PolarHBondContact OE1-OG 3.22Å
484	K	29.9	Very low	36.9	Very low	195 Å²	195	100.6 Å²	100.6	85%	0.848	52%	0.521	S	S	*	.			trans	44.4	92.5	154.5	-63	176.6	-178	170.6	0	117.7
485	A	29.5	Very low	35.8	Very low	88 Å²	88	105.2 Å²	105.2	73%	0.727	55%	0.545	S	S	*	.			trans	-133.6	155.6	153.8	0	0	0	0	0	110.2
486	P	28.2	Very low	34.5	Very low	114.5 Å²	114.5	109.9 Å²	109.9	74%	0.744	57%	0.57	S	S	*	*			trans	-73.3	161	-160.7	-19.9	33.8	0	0	0	116.3	H488 A489	P486-H488 PolarHBondContact O-N 2.95Å; P486-A489 PolarHBondContact O-N 3.38Å
487	L	27.8	Very low	33.4	Very low	161 Å²	161	115 Å²	115	84%	0.843	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58	50.7	-177.4	-75.1	90.8	0	0	0	114
488	H	29.5	Very low	32.4	Very low	190.5 Å²	190.5	117.6 Å²	117.6	88%	0.882	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140	25.2	165.7	-70.7	-41.6	0	0	0	112.6	P486 R490	P486-H488 PolarHBondContact O-N 2.95Å; H488-R490 PolarHBondContact O-N 2.86Å
489	A	31.5	Very low	31.5	Very low	93.5 Å²	93.5	121.9 Å²	121.9	77%	0.773	65%	0.653	S	S	*	*			trans	-117.8	69.2	173.9	0	0	0	0	0	112.7	P486	P486-A489 PolarHBondContact O-N 3.38Å
490	R	26.5	Very low	31.3	Very low	233.5 Å²	233.5	126 Å²	126	88%	0.881	67%	0.668	S	S	*	*			trans	-114.4	57.5	179	-106.5	-176.9	-179.1	-177.8	0.5	112.2	H488	H488-R490 PolarHBondContact O-N 2.86Å
491	T	24.3	Very low	31.1	Very low	112 Å²	112	129.8 Å²	129.8	69%	0.687	68%	0.682	S	S	*	*	S	Bend	trans	-158.9	147.2	160.7	37.6	0	0	0	0	109.7	E103	E103-T491 HydrophobicContact CG-CG2 4.26Å; E103-T491 WeakPolarHBondContact OE1-CG2 3.27Å
492	E	25.9	Very low	31.4	Very low	150 Å²	150	132.1 Å²	132.1	70%	0.701	69%	0.69	S	S	*	*			trans	55.7	87.7	177.9	-65.4	-156	-162.6	0	0	118	K494 K663	E492-K494 PolarHBondContact O-N 2.8Å; E492-K663 IonicContact OE2-NZ 2.61Å; E492-K663 PolarHBondContact OE2-NZ 2.93Å
493	G	25	Very low	32.2	Very low	66 Å²	66	127.9 Å²	127.9	68%	0.68	68%	0.679	S	S	*	*			trans	-83	102.6	162.7	0	0	0	0	0	112.3
494	K	26.7	Very low	33.1	Very low	165 Å²	165	122 Å²	122	72%	0.717	65%	0.654	S	S	*	*			trans	-114.3	130.9	-178.6	-165.1	-179.4	-175.7	-177.3	0	110.2	E492 D496	E492-K494 PolarHBondContact O-N 2.8Å; K494-D496 PolarHBondContact O-N 3Å; K494-D496 VanDerWaalsContact O-N 3.09Å
495	L	28.8	Very low	34.2	Very low	135.5 Å²	135.5	119 Å²	119	71%	0.709	64%	0.643	S	S	*	*			trans	-65.9	113.5	177.4	-140.2	118.9	0	0	0	110.4	T461	T461-L495 HydrophobicContact CG2-CD1 3.75Å
496	D	29.9	Very low	35.4	Very low	100 Å²	100	115.4 Å²	115.4	54%	0.535	61%	0.612	S	S	.	*			trans	-102.1	115.7	180	-160.9	12.3	0	0	0	110.7	K494 G498	K494-D496 PolarHBondContact O-N 3Å; K494-D496 VanDerWaalsContact O-N 3.09Å; D496-G498 PolarHBondContact O-N 3.11Å
497	N	32.4	Very low	36.6	Very low	143 Å²	143	111.9 Å²	111.9	77%	0.765	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	53.8	-1.2	170.8	-62.7	-49.5	0	0	0	120.3	V499	N497-V499 PolarHBondContact O-N 2.76Å
498	G	33.5	Very low	37.8	Very low	57 Å²	57	104.7 Å²	104.7	59%	0.588	56%	0.559	S	S	*	*			trans	66.1	36.2	160.8	0	0	0	0	0	116.7	D496	D496-G498 PolarHBondContact O-N 3.11Å
499	V	36	Very low	39	Very low	108.5 Å²	108.5	101.3 Å²	101.3	66%	0.658	55%	0.548	S	S	*	.			trans	-103.6	122.5	-179.7	-179.5	0	0	0	0	111.4	N497 K501	N497-V499 PolarHBondContact O-N 2.76Å; V499-K501 PolarHBondContact O-N 2.76Å
500	W	41.6	Very low	40.2	Very low	89 Å²	89	103.1 Å²	103.1	34%	0.337	54%	0.544	S	S	.	.			trans	-66.2	131	170.9	-65.5	102.7	0	0	0	110.9	V462 R465 D478 N480	V462-W500 HydrophobicContact CB-CH2 4.19Å; V462-W500 HydrophobicContact CG1-CH2 3.85Å; V462-W500 HydrophobicContact CG1-CZ2 4.45Å; R465-W500 HydrophobicContact CB-CH2 3.85Å; R465-W500 HydrophobicContact CB-CZ2 4.15Å; R465-W500 HydrophobicContact CB-CZ3 3.86Å; R465-W500 HydrophobicContact CG-CH2 4.43Å; D478-W500 HydrophobicContact CB-CB 4.41Å; D478-W500 HydrophobicContact CB-CD2 3.9Å; D478-W500 HydrophobicContact CB-CE3 3.69Å; D478-W500 HydrophobicContact CB-CG 4.15Å; D478-W500 HydrophobicContact CB-CH2 4.22Å; D478-W500 HydrophobicContact CB-CZ2 4.49Å; D478-W500 HydrophobicContact CB-CZ3 4.02Å; D478-W500 WeakPolarHBondContact O-CZ3 3.34Å; N480-W500 HydrophobicContact CB-CE3 4.14Å; N480-W500 HydrophobicContact CB-CZ3 3.82Å; N480-W500 WeakPolarHBondContact ND2-CZ3 3.44Å
501	K	42.5	Very low	41.7	Very low	129.5 Å²	129.5	92.4 Å²	92.4	56%	0.563	51%	0.506	S	S	*	.			trans	-91.3	-26	-171.5	-74.3	-176.9	177.3	175.6	0	114.5	V499 R1105	V499-K501 PolarHBondContact O-N 2.76Å; K501-R1105 PolarHBondContact O-NH2 2.9Å
502	K	45.3	Very low	43.1	Very low	102 Å²	102	90.7 Å²	90.7	44%	0.443	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	99	-179.7	-165.6	179.6	-175.5	-177.3	0	111.3	L479 L481	L479-K502 HydrophobicContact CB-CB 4.34Å; L479-K502 HydrophobicContact CD1-CD 4.27Å; L479-K502 PolarHBondContact N-O 3.06Å; L479-K502 PolarHBondContact O-N 2.75Å; L481-K502 HydrophobicContact CD1-CD 4.05Å
503	Q	48.4	Very low	44.7	Very low	112.5 Å²	112.5	85.9 Å²	85.9	53%	0.526	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	123.4	164.5	-170.6	175.3	26.1	0	0	108.7	F476 I477 D478 R1080	F476-Q503 HydrophobicContact CB-CG 4.44Å; F476-Q503 HydrophobicContact CD1-CG 4.28Å; I477-Q503 WeakPolarHBondContact O-CA 3.18Å; D478-Q503 WeakPolarHBondContact OD1-CA 3.02Å; D478-Q503 WeakPolarHBondContact OD1-CB 3.4Å; D478-Q503 VanDerWaalsContact OD1-CG 3.32Å; D478-Q503 WeakPolarHBondContact OD1-CG 3.44Å; Q503-R1080 PolarHBondContact O-NH1 3.44Å
504	A	52.8	Low	46.2	Very low	16 Å²	16	88.3 Å²	88.3	13%	0.132	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	121.6	169.6	0	0	0	0	0	109.1	F476 I477 M506 Y542	F476-A504 CarbonylContact C-O 3.55Å; F476-A504 WeakPolarHBondContact CA-O 3.4Å; I477-A504 HydrophobicContact CB-CB 4.47Å; I477-A504 PolarHBondContact N-O 2.91Å; I477-A504 PolarHBondContact O-N 3.2Å; A504-M506 HydrophobicContact CB-CE 4.02Å; A504-Y542 HydrophobicContact CB-CE1 4.37Å; A504-Y542 VanDerWaalsContact CB-OH 3.24Å; A504-Y542 WeakPolarHBondContact CB-OH 3.26Å
505	Q	53.2	Low	47.5	Very low	131 Å²	131	82.8 Å²	82.8	61%	0.612	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	130.3	174	-178.8	178.7	-12	0	0	109.1	L474 F476	L474-Q505 HydrophobicContact CD1-CG 4.47Å; L474-Q505 VanDerWaalsContact CD1-NE2 3.33Å; L474-Q505 HydrophobicContact CD2-CG 3.97Å; L474-Q505 VanDerWaalsContact CD2-NE2 3.35Å; F476-Q505 HydrophobicContact CD1-CB 4.21Å; F476-Q505 HydrophobicContact CD1-CG 4.29Å; F476-Q505 HydrophobicContact CE1-CB 4.19Å; F476-Q505 HydrophobicContact CE1-CG 3.89Å
506	M	54.7	Low	49.2	Very low	13.5 Å²	13.5	84.5 Å²	84.5	7%	0.067	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	126.5	178.5	-65.2	164.1	-168.2	0	0	108.3	L475 I477 A504 V538 S539 Y542	L475-M506 HydrophobicContact CB-CB 4.32Å; L475-M506 PolarHBondContact N-O 3.03Å; L475-M506 PolarHBondContact O-N 2.87Å; I477-M506 HydrophobicContact CB-CE 4.28Å; I477-M506 HydrophobicContact CD1-CE 3.53Å; I477-M506 VanDerWaalsContact CD1-CE 3.49Å; I477-M506 HydrophobicContact CD1-SD 3.65Å; I477-M506 WeakPolarHBondContact CD1-SD 3.34Å; I477-M506 HydrophobicContact CG1-CE 3.64Å; I477-M506 HydrophobicContact CG1-SD 3.73Å; I477-M506 VanDerWaalsContact CG1-SD 3.58Å; A504-M506 HydrophobicContact CB-CE 4.02Å; M506-V538 VanDerWaalsContact CG-O 3.31Å; M506-V538 WeakPolarHBondContact CG-O 3.23Å; M506-S539 VanDerWaalsContact SD-CB 3.57Å; M506-Y542 HydrophobicContact CE-CE2 3.85Å; M506-Y542 VanDerWaalsContact CE-CE2 3.5Å; M506-Y542 WeakPolarHBondContact CE-OH 3.33Å
507	G	51.6	Low	51.2	Low	41.5 Å²	41.5	86.1 Å²	86.1	43%	0.428	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	139.1	164.8	0	0	0	0	0	108.9	N509	G507-N509 PolarHBondContact O-N 2.77Å; G507-N509 VanDerWaalsContact O-N 3.12Å
508	T	54.9	Low	53.3	Low	10 Å²	10	79.3 Å²	79.3	6%	0.061	43%	0.432	C	S	.	.			trans	-80	24.3	177.8	62.5	0	0	0	0	112.2	K473 L475 D510 A511 I513	K473-T508 PolarHBondContact O-N 2.65Å; K473-T508 PolarHBondContact O-OG1 2.88Å; L475-T508 HydrophobicContact CB-CG2 4.32Å; L475-T508 HydrophobicContact CD1-CG2 3.43Å; L475-T508 VanDerWaalsContact CD1-CG2 3.43Å; L475-T508 HydrophobicContact CG-CG2 4.48Å; T508-D510 PolarHBondContact O-N 2.86Å; T508-D510 VanDerWaalsContact O-N 3.11Å; T508-A511 WeakPolarHBondContact O-CB 3.29Å; T508-A511 PolarHBondContact O-N 2.85Å; T508-I513 HydrophobicContact CG2-CD1 4.02Å
509	N	54.2	Low	55.5	Low	119 Å²	119	79.2 Å²	79.2	64%	0.636	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-8	3.9	-171	-69.9	-6.9	0	0	0	113.2	G507 A511 K537	G507-N509 PolarHBondContact O-N 2.77Å; G507-N509 VanDerWaalsContact O-N 3.12Å; N509-A511 PolarHBondContact O-N 3.44Å; N509-K537 PolarHBondContact ND2-O 2.8Å
510	D	55.4	Low	57.6	Low	130.5 Å²	130.5	74.4 Å²	74.4	70%	0.698	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-33.9	11.5	-174.4	-56.8	-57.4	0	0	0	114.8	K473 T508 H536	K473-D510 IonicContact NZ-OD1 2.75Å; K473-D510 PolarHBondContact NZ-OD1 2.84Å; T508-D510 PolarHBondContact O-N 2.86Å; T508-D510 VanDerWaalsContact O-N 3.11Å; D510-H536 PolarHBondContact O-CE1 2.85Å; D510-H536 PolarHBondContact O-ND1 2.94Å
511	A	57.9	Low	59.5	Low	9.5 Å²	9.5	71.5 Å²	71.5	8%	0.079	38%	0.381	C	S	.	.			trans	-76	121.8	174.4	0	0	0	0	0	110.3	T508 N509 I513 H536	T508-A511 WeakPolarHBondContact O-CB 3.29Å; T508-A511 PolarHBondContact O-N 2.85Å; N509-A511 PolarHBondContact O-N 3.44Å; A511-I513 PolarHBondContact O-N 3.07Å; A511-I513 VanDerWaalsContact O-N 3.1Å; A511-H536 HydrophobicContact CB-CB 3.87Å
512	P	55.5	Low	61.2	Low	75 Å²	75	65.9 Å²	65.9	49%	0.487	36%	0.358	S	S	.	.			trans	-70	114.6	179.9	27.9	-32.4	0	0	0	109.9	D514 N534 H536	P512-D514 PolarHBondContact O-N 3.13Å; P512-N534 PolarHBondContact O-ND2 3Å; P512-H536 WeakPolarHBondContact CD-NE2 3.33Å
513	I	58.4	Low	62.9	Low	50 Å²	50	62.3 Å²	62.3	26%	0.256	35%	0.345	S	S	.	.			trans	-101.4	78.1	171.7	-51.8	178.6	0	0	0	107.4	L445 F470 T508 A511 M518	L445-I513 HydrophobicContact CD1-CG2 4.41Å; F470-I513 HydrophobicContact CD1-CD1 3.85Å; F470-I513 HydrophobicContact CD1-CG2 3.76Å; F470-I513 HydrophobicContact CE1-CD1 4.06Å; F470-I513 HydrophobicContact CE1-CG2 3.68Å; F470-I513 HydrophobicContact CG-CG2 4.49Å; F470-I513 HydrophobicContact CZ-CG2 4.41Å; T508-I513 HydrophobicContact CG2-CD1 4.02Å; A511-I513 PolarHBondContact O-N 3.07Å; A511-I513 VanDerWaalsContact O-N 3.1Å; I513-M518 HydrophobicContact CD1-SD 4.49Å; I513-M518 HydrophobicContact CG1-SD 4.35Å; I513-M518 HydrophobicContact CG2-SD 4.09Å
514	D	55.9	Low	64	Low	115.5 Å²	115.5	57.8 Å²	57.8	62%	0.618	32%	0.324	S	S	*	.			trans	-77.8	139.8	176.7	132.7	-28.4	0	0	0	111	P512 K516 N534	P512-D514 PolarHBondContact O-N 3.13Å; D514-K516 PolarHBondContact O-N 3.38Å; D514-N534 PolarHBondContact OD1-ND2 3.31Å
515	G	54.5	Low	64.8	Low	49.5 Å²	49.5	59.5 Å²	59.5	51%	0.51	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	20.3	-152.6	0	0	0	0	0	117.7
516	K	65.7	Low	65.4	Low	171.5 Å²	171.5	59 Å²	59	75%	0.746	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.6	-42.3	-179.9	-77	-174.4	175.9	179.7	0	114.3	S444 L445 D514	S444-K516 CarbonylContact C-O 3.58Å; S444-K516 VanDerWaalsContact CA-O 3.29Å; S444-K516 WeakPolarHBondContact CA-O 3.35Å; L445-K516 PolarHBondContact N-O 3.15Å; D514-K516 PolarHBondContact O-N 3.38Å
517	Q	71.9	Confident	65.9	Low	133.5 Å²	133.5	61.8 Å²	61.8	62%	0.624	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.1	146.4	-175.9	-76.8	-178.6	-24.4	0	0	111.9	L443	L443-Q517 CarbonylContact O-C 3.48Å; L443-Q517 VanDerWaalsContact O-CA 3.27Å; L443-Q517 WeakPolarHBondContact O-CA 3.17Å
518	M	75.2	Confident	66.8	Low	0.5 Å²	0.5	62.5 Å²	62.5	0%	0.002	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	122	-179.6	179.4	174.3	112.7	0	0	111.1	L443 L445 I452 F470 I513 I520 I533 N534	L443-M518 HydrophobicContact CB-CB 4.38Å; L443-M518 VanDerWaalsContact CB-O 3.28Å; L443-M518 WeakPolarHBondContact CB-O 3.37Å; L443-M518 HydrophobicContact CD1-CE 3.61Å; L443-M518 HydrophobicContact CD1-CG 4.46Å; L443-M518 PolarHBondContact N-O 2.89Å; L443-M518 PolarHBondContact O-N 3.03Å; L445-M518 HydrophobicContact CD1-CB 4.32Å; L445-M518 HydrophobicContact CD1-CE 4.34Å; L445-M518 HydrophobicContact CD1-SD 4.45Å; I452-M518 HydrophobicContact CD1-CE 3.58Å; I452-M518 HydrophobicContact CD1-SD 4.05Å; I452-M518 HydrophobicContact CG1-CE 4.41Å; I452-M518 HydrophobicContact CG2-CE 4.5Å; F470-M518 HydrophobicContact CE1-CE 3.91Å; F470-M518 HydrophobicContact CE1-SD 3.97Å; F470-M518 HydrophobicContact CZ-CE 3.72Å; F470-M518 HydrophobicContact CZ-SD 4.2Å; I513-M518 HydrophobicContact CD1-SD 4.49Å; I513-M518 HydrophobicContact CG1-SD 4.35Å; I513-M518 HydrophobicContact CG2-SD 4.09Å; M518-I520 HydrophobicContact CE-CD1 3.88Å; M518-I520 HydrophobicContact CE-CG1 4.16Å; M518-I520 HydrophobicContact CG-CG1 4.46Å; M518-I533 HydrophobicContact CE-CB 4.49Å; M518-I533 HydrophobicContact CE-CD1 3.57Å; M518-I533 HydrophobicContact CE-CG1 3.95Å; M518-I533 HydrophobicContact CE-CG2 3.74Å; M518-I533 HydrophobicContact CG-CG2 3.97Å; M518-I533 HydrophobicContact SD-CG2 4.15Å; M518-N534 WeakPolarHBondContact CA-OD1 3.39Å
519	N	80.2	Confident	67.7	Low	55.5 Å²	55.5	62.1 Å²	62.1	30%	0.297	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	123.5	179.5	-71.5	4	0	0	0	110	E442 I533 N534	E442-N519 WeakPolarHBondContact CA-OD1 3.38Å; E442-N519 WeakPolarHBondContact CB-OD1 3.43Å; E442-N519 WeakPolarHBondContact CG-OD1 3.32Å; E442-N519 PolarHBondContact OE1-ND2 3.13Å; N519-I533 CarbonylContact O-C 3.57Å; N519-I533 WeakPolarHBondContact O-CA 3.38Å; N519-N534 PolarHBondContact N-OD1 3.07Å; N519-N534 PolarHBondContact O-N 2.92Å
520	I	79.6	Confident	68.9	Low	7 Å²	7	57.1 Å²	57.1	4%	0.036	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	114.8	175.4	-48.7	-169.7	0	0	0	109	L441 L443 I452 I454 L466 M518 F531 Y532 I533	L441-I520 HydrophobicContact CB-CB 4.43Å; L441-I520 HydrophobicContact CD2-CD1 4.43Å; L441-I520 PolarHBondContact N-O 3.11Å; L441-I520 PolarHBondContact O-N 3.13Å; L443-I520 HydrophobicContact CD1-CD1 3.77Å; L443-I520 HydrophobicContact CD1-CG1 3.98Å; I452-I520 HydrophobicContact CD1-CD1 4.14Å; I454-I520 HydrophobicContact CD1-CD1 3.52Å; L466-I520 HydrophobicContact CD2-CD1 3.76Å; L466-I520 HydrophobicContact CD2-CG2 4.31Å; M518-I520 HydrophobicContact CE-CD1 3.88Å; M518-I520 HydrophobicContact CE-CG1 4.16Å; M518-I520 HydrophobicContact CG-CG1 4.46Å; I520-F531 HydrophobicContact CG2-CD1 4.38Å; I520-Y532 CarbonylContact C-O 3.53Å; I520-Y532 VanDerWaalsContact CA-O 3.31Å; I520-Y532 WeakPolarHBondContact CA-O 3.35Å; I520-Y532 WeakPolarHBondContact CG2-O 3.18Å; I520-I533 HydrophobicContact CD1-CD1 4.5Å; I520-I533 HydrophobicContact CG1-CG1 4.21Å; I520-I533 HydrophobicContact CG2-CG1 4.2Å
521	T	81.8	Confident	70	Confident	28 Å²	28	51.5 Å²	51.5	17%	0.172	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	119.7	176.4	-56.5	0	0	0	0	109.8	N438 V440 V523 F531 Y532	N438-T521 HydrophobicContact CB-CG2 4.29Å; V440-T521 HydrophobicContact CG2-CG2 4Å; T521-V523 HydrophobicContact CG2-CG2 4.01Å; T521-F531 CarbonylContact O-C 3.55Å; T521-F531 WeakPolarHBondContact O-CA 3.36Å; T521-Y532 PolarHBondContact N-O 2.95Å; T521-Y532 PolarHBondContact O-N 3.32Å
522	A	78.4	Confident	71.2	Confident	11.5 Å²	11.5	52.8 Å²	52.8	10%	0.095	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	103.4	166.8	0	0	0	0	0	108.6	V439 L524 V529 Q530 F531	V439-A522 HydrophobicContact CB-CB 4.4Å; V439-A522 PolarHBondContact N-O 3.31Å; V439-A522 PolarHBondContact O-N 2.83Å; A522-L524 WeakPolarHBondContact O-CD1 3.16Å; A522-L524 PolarHBondContact O-N 2.86Å; A522-V529 HydrophobicContact CB-CG2 3.97Å; A522-Q530 CarbonylContact C-O 3.59Å; A522-Q530 WeakPolarHBondContact CA-O 3.01Å; A522-F531 HydrophobicContact CB-CD1 3.93Å; A522-F531 HydrophobicContact CB-CE1 3.7Å; A522-F531 HydrophobicContact CB-CZ 4.2Å
523	V	80.2	Confident	72.2	Confident	28 Å²	28	49.3 Å²	49.3	17%	0.17	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	115.3	173.1	177.7	0	0	0	0	107.7	N438 T521 V529 Q530 Y532	N438-V523 WeakPolarHBondContact OD1-CG1 3.43Å; N438-V523 WeakPolarHBondContact OD1-CG2 3.43Å; T521-V523 HydrophobicContact CG2-CG2 4.01Å; V523-V529 CarbonylContact O-C 3.54Å; V523-V529 VanDerWaalsContact O-CA 3.29Å; V523-V529 WeakPolarHBondContact O-CA 3.36Å; V523-Q530 HydrophobicContact CB-CB 4.4Å; V523-Q530 PolarHBondContact N-O 3.05Å; V523-Q530 PolarHBondContact O-N 3.03Å; V523-Y532 HydrophobicContact CB-CE2 4.23Å; V523-Y532 HydrophobicContact CG2-CD2 3.9Å; V523-Y532 HydrophobicContact CG2-CE2 3.51Å; V523-Y532 VanDerWaalsContact CG2-CE2 3.44Å
524	L	72	Confident	73.2	Confident	16.5 Å²	16.5	49.1 Å²	49.1	9%	0.086	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	126.3	175	-53.6	138.7	0	0	0	108.8	F430 S436 Q437 V439 A522 L528 V529 L544	F430-L524 HydrophobicContact CE1-CD1 4.46Å; F430-L524 HydrophobicContact CE1-CD2 4.12Å; F430-L524 HydrophobicContact CE2-CD1 4.22Å; F430-L524 HydrophobicContact CZ-CD1 4.1Å; F430-L524 HydrophobicContact CZ-CD2 3.71Å; F430-L524 HydrophobicContact CZ-CG 4.34Å; S436-L524 CarbonylContact C-O 3.57Å; S436-L524 VanDerWaalsContact CA-O 3.27Å; S436-L524 WeakPolarHBondContact CA-O 3.34Å; S436-L524 VanDerWaalsContact CB-O 3.24Å; S436-L524 WeakPolarHBondContact CB-O 3.28Å; Q437-L524 PolarHBondContact N-O 2.95Å; Q437-L524 WeakPolarHBondContact O-CA 3.37Å; Q437-L524 VanDerWaalsContact O-CB 3.23Å; Q437-L524 WeakPolarHBondContact O-CB 3.45Å; Q437-L524 VanDerWaalsContact O-CD1 3.29Å; Q437-L524 WeakPolarHBondContact O-CD1 3.32Å; Q437-L524 WeakPolarHBondContact O-CG 3.07Å; Q437-L524 PolarHBondContact O-N 3.14Å; V439-L524 HydrophobicContact CB-CD1 4.14Å; V439-L524 HydrophobicContact CG2-CD1 3.66Å; V439-L524 HydrophobicContact CG2-CG 4.47Å; A522-L524 WeakPolarHBondContact O-CD1 3.16Å; A522-L524 PolarHBondContact O-N 2.86Å; L524-L528 CarbonylContact C-O 3.47Å; L524-L528 WeakPolarHBondContact CA-O 3.34Å; L524-V529 HydrophobicContact CD2-CB 4.1Å; L524-V529 HydrophobicContact CD2-CG2 3.96Å; L524-V529 HydrophobicContact CG-CB 4.35Å; L524-V529 HydrophobicContact CG-CG2 4.04Å; L524-L544 HydrophobicContact CD2-CD1 3.79Å; L524-L544 HydrophobicContact CD2-CD2 4.13Å; L524-L544 HydrophobicContact CD2-CG 4.47Å
525	D	70.5	Confident	74.2	Confident	53.5 Å²	53.5	44.8 Å²	44.8	29%	0.286	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	97.6	-167.4	174.8	39.3	0	0	0	108.3	D527 L528 K541	D525-D527 PolarHBondContact O-N 3.46Å; D525-D527 VanDerWaalsContact O-N 3.09Å; D525-L528 HydrophobicContact CB-CB 4.44Å; D525-L528 PolarHBondContact N-O 3.12Å; D525-L528 WeakPolarHBondContact O-CA 3.38Å; D525-L528 VanDerWaalsContact O-CB 3.27Å; D525-L528 WeakPolarHBondContact O-CB 3.3Å; D525-L528 PolarHBondContact O-N 2.86Å; D525-K541 IonicContact OD2-NZ 3.76Å; D525-K541 PolarHBondContact OD2-NZ 2.77Å
526	D	65.8	Low	75.2	Confident	119 Å²	119	46.2 Å²	46.2	64%	0.636	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	39.7	167.4	-172.8	-71.6	-14	0	0	0	115.1	P435 L528	P435-D526 WeakPolarHBondContact CB-OD1 3.33Å; D526-L528 VanDerWaalsContact C-N 3.31Å; D526-L528 PolarHBondContact O-N 2.77Å
527	D	65.2	Low	75.9	Confident	72 Å²	72	43.2 Å²	43.2	39%	0.385	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-14.6	7.2	-177.9	-81.7	-2.3	0	0	0	113.1	H432 D525 S543 L544 K546	H432-D527 IonicContact CE1-OD1 3.73Å; H432-D527 PolarHBondContact CE1-OD1 2.85Å; H432-D527 IonicContact NE2-OD1 2.67Å; D525-D527 PolarHBondContact O-N 3.46Å; D525-D527 VanDerWaalsContact O-N 3.09Å; D527-S543 CarbonylContact O-C 3.58Å; D527-S543 WeakPolarHBondContact O-CA 3.35Å; D527-L544 PolarHBondContact O-N 3.09Å; D527-K546 IonicContact OD2-NZ 3.05Å
528	L	69.4	Low	75.9	Confident	57 Å²	57	37.6 Å²	37.6	30%	0.298	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	152.1	-179.8	-58.8	173.4	0	0	0	113.1	L524 D525 D526 K541 Y542	L524-L528 CarbonylContact C-O 3.47Å; L524-L528 WeakPolarHBondContact CA-O 3.34Å; D525-L528 HydrophobicContact CB-CB 4.44Å; D525-L528 PolarHBondContact N-O 3.12Å; D525-L528 WeakPolarHBondContact O-CA 3.38Å; D525-L528 VanDerWaalsContact O-CB 3.27Å; D525-L528 WeakPolarHBondContact O-CB 3.3Å; D525-L528 PolarHBondContact O-N 2.86Å; D526-L528 VanDerWaalsContact C-N 3.31Å; D526-L528 PolarHBondContact O-N 2.77Å; L528-K541 HydrophobicContact CB-CB 4.35Å; L528-K541 HydrophobicContact CB-CD 4.27Å; L528-K541 HydrophobicContact CD1-CB 4.28Å; L528-K541 HydrophobicContact CD1-CD 3.7Å; L528-K541 HydrophobicContact CD2-CB 4.4Å; L528-Y542 CarbonylContact C-O 3.53Å; L528-Y542 VanDerWaalsContact CA-O 3.28Å; L528-Y542 WeakPolarHBondContact CA-O 3.34Å
529	V	73.9	Confident	75.5	Confident	2 Å²	2	38 Å²	38	1%	0.012	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	140.8	170.5	61.3	0	0	0	0	112.4	W464 A522 V523 L524 F531 K541 Y542 L544	W464-V529 HydrophobicContact CE3-CG1 4.16Å; W464-V529 HydrophobicContact CH2-CG1 3.31Å; W464-V529 HydrophobicContact CZ2-CG1 3.91Å; W464-V529 VanDerWaalsContact CZ2-CG1 3.45Å; W464-V529 HydrophobicContact CZ3-CG1 3.68Å; A522-V529 HydrophobicContact CB-CG2 3.97Å; V523-V529 CarbonylContact O-C 3.54Å; V523-V529 VanDerWaalsContact O-CA 3.29Å; V523-V529 WeakPolarHBondContact O-CA 3.36Å; L524-V529 HydrophobicContact CD2-CB 4.1Å; L524-V529 HydrophobicContact CD2-CG2 3.96Å; L524-V529 HydrophobicContact CG-CB 4.35Å; L524-V529 HydrophobicContact CG-CG2 4.04Å; V529-F531 HydrophobicContact CB-CE2 4.5Å; V529-F531 HydrophobicContact CG1-CE2 4.14Å; V529-F531 HydrophobicContact CG1-CZ 4.49Å; V529-F531 HydrophobicContact CG2-CD2 4.44Å; V529-F531 HydrophobicContact CG2-CE1 4.44Å; V529-F531 HydrophobicContact CG2-CE2 3.93Å; V529-F531 HydrophobicContact CG2-CZ 3.97Å; V529-K541 CarbonylContact O-C 3.55Å; V529-K541 WeakPolarHBondContact O-CA 3.44Å; V529-Y542 PolarHBondContact N-O 3.04Å; V529-Y542 PolarHBondContact O-N 2.79Å; V529-L544 HydrophobicContact CB-CD1 4.38Å; V529-L544 HydrophobicContact CB-CD2 3.94Å; V529-L544 HydrophobicContact CB-CG 4.23Å; V529-L544 HydrophobicContact CG1-CD2 3.71Å; V529-L544 HydrophobicContact CG1-CG 4.18Å
530	Q	80.7	Confident	75.2	Confident	13 Å²	13	38.9 Å²	38.9	6%	0.061	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	129.4	-177.1	-174	119.2	16.3	0	0	110.4	A522 V523 Y532 K537 S539 P540 K541	A522-Q530 CarbonylContact C-O 3.59Å; A522-Q530 WeakPolarHBondContact CA-O 3.01Å; V523-Q530 HydrophobicContact CB-CB 4.4Å; V523-Q530 PolarHBondContact N-O 3.05Å; V523-Q530 PolarHBondContact O-N 3.03Å; Q530-Y532 HydrophobicContact CB-CE2 4.35Å; Q530-Y532 HydrophobicContact CG-CD2 4.44Å; Q530-Y532 HydrophobicContact CG-CE2 3.82Å; Q530-Y532 VanDerWaalsContact NE2-CZ 3.35Å; Q530-Y532 PolarHBondContact NE2-OH 2.91Å; Q530-K537 VanDerWaalsContact NE2-CE 3.31Å; Q530-S539 WeakPolarHBondContact CG-O 3.29Å; Q530-S539 PolarHBondContact NE2-O 2.7Å; Q530-S539 PolarHBondContact NE2-OG 3.37Å; Q530-S539 VanDerWaalsContact NE2-OG 3.17Å; Q530-S539 PolarHBondContact OE1-O 2.73Å; Q530-P540 VanDerWaalsContact OE1-C 3.3Å; Q530-K541 HydrophobicContact CB-CG 4.18Å; Q530-K541 HydrophobicContact CG-CG 4.28Å
531	F	78	Confident	74.9	Confident	12.5 Å²	12.5	43.5 Å²	43.5	6%	0.055	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	139	-175	-64.5	-91.9	0	0	0	112.8	L456 W464 I477 I520 T521 A522 V529 V538 S539 Y542	L456-F531 HydrophobicContact CD1-CE1 4.32Å; L456-F531 HydrophobicContact CD1-CZ 4.09Å; W464-F531 HydrophobicContact CE3-CE2 4.24Å; W464-F531 AromaticContact CE3-CZ 3.9Å; W464-F531 HydrophobicContact CE3-CZ 4.12Å; W464-F531 AromaticContact CH2-CE2 3.93Å; W464-F531 HydrophobicContact CH2-CE2 3.93Å; W464-F531 HydrophobicContact CH2-CZ 4.32Å; W464-F531 AromaticContact CZ3-CE2 3.36Å; W464-F531 HydrophobicContact CZ3-CE2 3.82Å; W464-F531 AromaticContact CZ3-CZ 3.54Å; W464-F531 HydrophobicContact CZ3-CZ 3.54Å; I477-F531 HydrophobicContact CD1-CB 4.44Å; I477-F531 HydrophobicContact CD1-CD2 3.82Å; I477-F531 HydrophobicContact CD1-CE2 4.14Å; I477-F531 HydrophobicContact CD1-CG 4.24Å; I520-F531 HydrophobicContact CG2-CD1 4.38Å; T521-F531 CarbonylContact O-C 3.55Å; T521-F531 WeakPolarHBondContact O-CA 3.36Å; A522-F531 HydrophobicContact CB-CD1 3.93Å; A522-F531 HydrophobicContact CB-CE1 3.7Å; A522-F531 HydrophobicContact CB-CZ 4.2Å; V529-F531 HydrophobicContact CB-CE2 4.5Å; V529-F531 HydrophobicContact CG1-CE2 4.14Å; V529-F531 HydrophobicContact CG1-CZ 4.49Å; V529-F531 HydrophobicContact CG2-CD2 4.44Å; V529-F531 HydrophobicContact CG2-CE1 4.44Å; V529-F531 HydrophobicContact CG2-CE2 3.93Å; V529-F531 HydrophobicContact CG2-CZ 3.97Å; F531-V538 HydrophobicContact CB-CG2 3.92Å; F531-V538 WeakPolarHBondContact O-CG2 3.41Å; F531-V538 PolarHBondContact O-N 2.72Å; F531-S539 PolarHBondContact N-OG 2.88Å; F531-S539 PolarHBondContact O-N 2.85Å; F531-S539 VanDerWaalsContact O-N 3.16Å; F531-Y542 HydrophobicContact CE2-CD2 4.46Å
532	Y	82.1	Confident	74.2	Confident	37.5 Å²	37.5	43.3 Å²	43.3	15%	0.147	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	147.9	172.8	-58.1	-107.3	0	0	0	109.4	I520 T521 V523 Q530 G535 H536 K537 L577	I520-Y532 CarbonylContact C-O 3.53Å; I520-Y532 VanDerWaalsContact CA-O 3.31Å; I520-Y532 WeakPolarHBondContact CA-O 3.35Å; I520-Y532 WeakPolarHBondContact CG2-O 3.18Å; T521-Y532 PolarHBondContact N-O 2.95Å; T521-Y532 PolarHBondContact O-N 3.32Å; V523-Y532 HydrophobicContact CB-CE2 4.23Å; V523-Y532 HydrophobicContact CG2-CD2 3.9Å; V523-Y532 HydrophobicContact CG2-CE2 3.51Å; V523-Y532 VanDerWaalsContact CG2-CE2 3.44Å; Q530-Y532 HydrophobicContact CB-CE2 4.35Å; Q530-Y532 HydrophobicContact CG-CD2 4.44Å; Q530-Y532 HydrophobicContact CG-CE2 3.82Å; Q530-Y532 VanDerWaalsContact NE2-CZ 3.35Å; Q530-Y532 PolarHBondContact NE2-OH 2.91Å; Y532-G535 WeakPolarHBondContact CD1-O 3.39Å; Y532-H536 CarbonylContact C-O 3.26Å; Y532-H536 WeakPolarHBondContact CA-O 3.33Å; Y532-K537 VanDerWaalsContact CD1-CA 3.47Å; Y532-K537 HydrophobicContact CD1-CB 3.83Å; Y532-K537 HydrophobicContact CD1-CG 4.43Å; Y532-K537 HydrophobicContact CE1-CB 3.76Å; Y532-K537 HydrophobicContact CE1-CD 4.46Å; Y532-K537 HydrophobicContact CE1-CG 4.16Å; Y532-L577 HydrophobicContact CE1-CD1 4.41Å
533	I	77.4	Confident	73.4	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	124	173.2	-67.9	-179.7	0	0	0	108.4	L475 M518 N519 I520 G535 H536 V538	L475-I533 HydrophobicContact CD1-CD1 3.73Å; L475-I533 HydrophobicContact CD2-CD1 3.49Å; L475-I533 HydrophobicContact CG-CD1 4.25Å; M518-I533 HydrophobicContact CE-CB 4.49Å; M518-I533 HydrophobicContact CE-CD1 3.57Å; M518-I533 HydrophobicContact CE-CG1 3.95Å; M518-I533 HydrophobicContact CE-CG2 3.74Å; M518-I533 HydrophobicContact CG-CG2 3.97Å; M518-I533 HydrophobicContact SD-CG2 4.15Å; N519-I533 CarbonylContact O-C 3.57Å; N519-I533 WeakPolarHBondContact O-CA 3.38Å; I520-I533 HydrophobicContact CD1-CD1 4.5Å; I520-I533 HydrophobicContact CG1-CG1 4.21Å; I520-I533 HydrophobicContact CG2-CG1 4.2Å; I533-G535 PolarHBondContact O-N 3.34Å; I533-H536 PolarHBondContact N-O 2.89Å; I533-H536 WeakPolarHBondContact O-CB 3.2Å; I533-H536 PolarHBondContact O-N 3.09Å; I533-V538 HydrophobicContact CB-CG1 3.99Å; I533-V538 HydrophobicContact CD1-CG1 4.15Å; I533-V538 HydrophobicContact CD1-CG2 4.11Å; I533-V538 HydrophobicContact CG1-CG1 4.07Å; I533-V538 HydrophobicContact CG1-CG2 3.95Å
534	N	79.4	Confident	72.4	Confident	46 Å²	46	45.5 Å²	45.5	25%	0.246	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.2	42.7	-176.5	-67.9	-6.7	0	0	0	112	P512 D514 M518 N519 H536	P512-N534 PolarHBondContact O-ND2 3Å; D514-N534 PolarHBondContact OD1-ND2 3.31Å; M518-N534 WeakPolarHBondContact CA-OD1 3.39Å; N519-N534 PolarHBondContact N-OD1 3.07Å; N519-N534 PolarHBondContact O-N 2.92Å; N534-H536 PolarHBondContact O-CD2 2.87Å; N534-H536 VanDerWaalsContact O-CD2 3.22Å; N534-H536 PolarHBondContact O-N 3.16Å
535	G	77.4	Confident	71.4	Confident	25.5 Å²	25.5	45.6 Å²	45.6	26%	0.263	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.6	-22.8	-175.1	0	0	0	0	0	115.2	Y532 I533	Y532-G535 WeakPolarHBondContact CD1-O 3.39Å; I533-G535 PolarHBondContact O-N 3.34Å
536	H	75.2	Confident	70.5	Confident	79.5 Å²	79.5	52.1 Å²	52.1	37%	0.368	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	129.8	-177.9	-60.5	-90.3	0	0	0	112.6	D510 A511 P512 Y532 I533 N534 V538	D510-H536 PolarHBondContact O-CE1 2.85Å; D510-H536 PolarHBondContact O-ND1 2.94Å; A511-H536 HydrophobicContact CB-CB 3.87Å; P512-H536 WeakPolarHBondContact CD-NE2 3.33Å; Y532-H536 CarbonylContact C-O 3.26Å; Y532-H536 WeakPolarHBondContact CA-O 3.33Å; I533-H536 PolarHBondContact N-O 2.89Å; I533-H536 WeakPolarHBondContact O-CB 3.2Å; I533-H536 PolarHBondContact O-N 3.09Å; N534-H536 PolarHBondContact O-CD2 2.87Å; N534-H536 VanDerWaalsContact O-CD2 3.22Å; N534-H536 PolarHBondContact O-N 3.16Å; H536-V538 PolarHBondContact O-N 2.76Å
537	K	80.6	Confident	69.9	Low	109 Å²	109	48.2 Å²	48.2	47%	0.474	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	116.1	176.7	-176.1	176.8	-177.4	171.9	0	111.3	N509 Q530 Y532 E574	N509-K537 PolarHBondContact ND2-O 2.8Å; Q530-K537 VanDerWaalsContact NE2-CE 3.31Å; Y532-K537 VanDerWaalsContact CD1-CA 3.47Å; Y532-K537 HydrophobicContact CD1-CB 3.83Å; Y532-K537 HydrophobicContact CD1-CG 4.43Å; Y532-K537 HydrophobicContact CE1-CB 3.76Å; Y532-K537 HydrophobicContact CE1-CD 4.46Å; Y532-K537 HydrophobicContact CE1-CG 4.16Å; K537-E574 IonicContact NZ-OE1 3.17Å
538	V	70.4	Confident	69.5	Low	16 Å²	16	48.5 Å²	48.5	10%	0.097	25%	0.249	C	C	.	.			trans	-107.3	-18	-178.2	-65	0	0	0	0	114.2	L475 M506 F531 I533 H536	L475-V538 HydrophobicContact CD2-CG2 4.34Å; M506-V538 VanDerWaalsContact CG-O 3.31Å; M506-V538 WeakPolarHBondContact CG-O 3.23Å; F531-V538 HydrophobicContact CB-CG2 3.92Å; F531-V538 WeakPolarHBondContact O-CG2 3.41Å; F531-V538 PolarHBondContact O-N 2.72Å; I533-V538 HydrophobicContact CB-CG1 3.99Å; I533-V538 HydrophobicContact CD1-CG1 4.15Å; I533-V538 HydrophobicContact CD1-CG2 4.11Å; I533-V538 HydrophobicContact CG1-CG1 4.07Å; I533-V538 HydrophobicContact CG1-CG2 3.95Å; H536-V538 PolarHBondContact O-N 2.76Å
539	S	68.1	Low	68.9	Low	8.5 Å²	8.5	46.8 Å²	46.8	6%	0.059	24%	0.241	C	C	.	.	S	Bend	trans	-124.8	161.8	-177.3	88.6	0	0	0	0	114	M506 Q530 F531	M506-S539 VanDerWaalsContact SD-CB 3.57Å; Q530-S539 WeakPolarHBondContact CG-O 3.29Å; Q530-S539 PolarHBondContact NE2-O 2.7Å; Q530-S539 PolarHBondContact NE2-OG 3.37Å; Q530-S539 VanDerWaalsContact NE2-OG 3.17Å; Q530-S539 PolarHBondContact OE1-O 2.73Å; F531-S539 PolarHBondContact N-OG 2.88Å; F531-S539 PolarHBondContact O-N 2.85Å; F531-S539 VanDerWaalsContact O-N 3.16Å
540	P	73.5	Confident	68.1	Low	73.5 Å²	73.5	49.5 Å²	49.5	48%	0.477	25%	0.252	S	S	.	.			trans	-74.4	172	154.3	34	-35.8	0	0	0	111	Q530 Y542	Q530-P540 VanDerWaalsContact OE1-C 3.3Å; P540-Y542 HydrophobicContact CG-CD2 4.44Å; P540-Y542 HydrophobicContact CG-CE1 4.12Å; P540-Y542 HydrophobicContact CG-CE2 3.99Å; P540-Y542 WeakPolarHBondContact CG-OH 3.38Å; P540-Y542 VanDerWaalsContact O-CD2 3.24Å; P540-Y542 WeakPolarHBondContact O-CD2 3.46Å; P540-Y542 WeakPolarHBondContact O-CE2 3.21Å
541	K	74	Confident	67	Low	103.5 Å²	103.5	50.6 Å²	50.6	45%	0.45	26%	0.26	S	S	.	.			trans	-67.8	141	168.3	-67	-163.6	177.2	-173.8	0	111.1	D525 L528 V529 Q530	D525-K541 IonicContact OD2-NZ 3.76Å; D525-K541 PolarHBondContact OD2-NZ 2.77Å; L528-K541 HydrophobicContact CB-CB 4.35Å; L528-K541 HydrophobicContact CB-CD 4.27Å; L528-K541 HydrophobicContact CD1-CB 4.28Å; L528-K541 HydrophobicContact CD1-CD 3.7Å; L528-K541 HydrophobicContact CD2-CB 4.4Å; V529-K541 CarbonylContact O-C 3.55Å; V529-K541 WeakPolarHBondContact O-CA 3.44Å; Q530-K541 HydrophobicContact CB-CG 4.18Å; Q530-K541 HydrophobicContact CG-CG 4.28Å
542	Y	66.2	Low	66.3	Low	24 Å²	24	50.6 Å²	50.6	9%	0.094	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	138.8	178.6	-68.3	-71.6	0	0	0	112.2	W464 I477 L479 A504 M506 L528 V529 F531 P540 L544	W464-Y542 HydrophobicContact CH2-CG 4.35Å; W464-Y542 HydrophobicContact CZ3-CD2 4.13Å; W464-Y542 HydrophobicContact CZ3-CG 4.28Å; I477-Y542 HydrophobicContact CD1-CE2 4.45Å; L479-Y542 HydrophobicContact CD1-CD1 3.56Å; L479-Y542 VanDerWaalsContact CD1-CD1 3.49Å; L479-Y542 HydrophobicContact CD1-CD2 4.07Å; L479-Y542 HydrophobicContact CD1-CE1 3.59Å; L479-Y542 VanDerWaalsContact CD1-CE1 3.46Å; L479-Y542 HydrophobicContact CD1-CE2 3.89Å; L479-Y542 HydrophobicContact CD1-CG 4.1Å; L479-Y542 HydrophobicContact CD2-CD2 4.43Å; A504-Y542 HydrophobicContact CB-CE1 4.37Å; A504-Y542 VanDerWaalsContact CB-OH 3.24Å; A504-Y542 WeakPolarHBondContact CB-OH 3.26Å; M506-Y542 HydrophobicContact CE-CE2 3.85Å; M506-Y542 VanDerWaalsContact CE-CE2 3.5Å; M506-Y542 WeakPolarHBondContact CE-OH 3.33Å; L528-Y542 CarbonylContact C-O 3.53Å; L528-Y542 VanDerWaalsContact CA-O 3.28Å; L528-Y542 WeakPolarHBondContact CA-O 3.34Å; V529-Y542 PolarHBondContact N-O 3.04Å; V529-Y542 PolarHBondContact O-N 2.79Å; F531-Y542 HydrophobicContact CE2-CD2 4.46Å; P540-Y542 HydrophobicContact CG-CD2 4.44Å; P540-Y542 HydrophobicContact CG-CE1 4.12Å; P540-Y542 HydrophobicContact CG-CE2 3.99Å; P540-Y542 WeakPolarHBondContact CG-OH 3.38Å; P540-Y542 VanDerWaalsContact O-CD2 3.24Å; P540-Y542 WeakPolarHBondContact O-CD2 3.46Å; P540-Y542 WeakPolarHBondContact O-CE2 3.21Å; Y542-L544 PolarHBondContact O-N 2.88Å
543	S	62.2	Low	65.3	Low	56 Å²	56	50.1 Å²	50.1	39%	0.392	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	125.3	177	-44.7	0	0	0	0	113	L481 E483 D527	L481-S543 WeakPolarHBondContact CD2-O 3.15Å; E483-S543 VanDerWaalsContact OE1-CB 3.24Å; E483-S543 WeakPolarHBondContact OE1-CB 3.38Å; E483-S543 PolarHBondContact OE1-OG 3.22Å; D527-S543 CarbonylContact O-C 3.58Å; D527-S543 WeakPolarHBondContact O-CA 3.35Å
544	L	57.8	Low	64.7	Low	30.5 Å²	30.5	50.3 Å²	50.3	16%	0.16	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-71.3	129	171.3	-67.9	165.3	0	0	0	110.1	W464 L524 D527 V529 Y542	W464-L544 HydrophobicContact CH2-CD2 4.42Å; W464-L544 HydrophobicContact CZ2-CD2 4.22Å; L524-L544 HydrophobicContact CD2-CD1 3.79Å; L524-L544 HydrophobicContact CD2-CD2 4.13Å; L524-L544 HydrophobicContact CD2-CG 4.47Å; D527-L544 PolarHBondContact O-N 3.09Å; V529-L544 HydrophobicContact CB-CD1 4.38Å; V529-L544 HydrophobicContact CB-CD2 3.94Å; V529-L544 HydrophobicContact CB-CG 4.23Å; V529-L544 HydrophobicContact CG1-CD2 3.71Å; V529-L544 HydrophobicContact CG1-CG 4.18Å; Y542-L544 PolarHBondContact O-N 2.88Å
545	P	51.4	Low	64	Low	19 Å²	19	48.9 Å²	48.9	12%	0.123	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-63.3	142.6	164.1	2.5	2.9	0	0	0	109.4	V462 V463 L481 S547	V462-P545 HydrophobicContact CG1-CG 4.01Å; V463-P545 HydrophobicContact CG1-CB 3.72Å; V463-P545 HydrophobicContact CG1-CG 3.75Å; L481-P545 HydrophobicContact CD2-CG 4.24Å; P545-S547 PolarHBondContact O-N 2.86Å
546	K	52.6	Low	63.7	Low	189 Å²	189	49.7 Å²	49.7	82%	0.822	27%	0.268	S	S	*	.	S	Bend	trans	-71.3	36	-172.9	-57.6	-163.3	172.3	-149.3	0	115.2	D527	D527-K546 IonicContact OD2-NZ 3.05Å
547	S	53	Low	63.6	Low	37 Å²	37	48.2 Å²	48.2	26%	0.259	26%	0.263	S	S	.	.	S	Bend	trans	-113.9	128	-178.6	-7.5	0	0	0	0	109.8	S458 P545 V549	S458-S547 WeakPolarHBondContact CB-OG 3.48Å; S458-S547 PolarHBondContact OG-OG 3.34Å; S458-S547 VanDerWaalsContact OG-OG 3.1Å; P545-S547 PolarHBondContact O-N 2.86Å; S547-V549 PolarHBondContact O-N 2.92Å; S547-V549 VanDerWaalsContact O-N 3.16Å
548	E	56.9	Low	63.1	Low	78.5 Å²	78.5	43.1 Å²	43.1	37%	0.367	24%	0.241	S	C	.	.			trans	-56.9	117.7	177.1	-122.2	-176.6	-178.3	0	0	110.4	K431 S458 K550	K431-E548 WeakPolarHBondContact CE-OE1 3.27Å; S458-E548 VanDerWaalsContact CA-O 3.26Å; S458-E548 WeakPolarHBondContact CA-O 3.39Å; S458-E548 WeakPolarHBondContact CB-O 3.26Å; S458-E548 PolarHBondContact OG-O 3Å; S458-E548 VanDerWaalsContact OG-O 3.05Å; E548-K550 HydrophobicContact CB-CG 4.42Å; E548-K550 HydrophobicContact CG-CD 4.37Å; E548-K550 HydrophobicContact CG-CG 4.21Å; E548-K550 WeakPolarHBondContact O-CE 3.38Å; E548-K550 WeakPolarHBondContact O-CG 3.32Å; E548-K550 PolarHBondContact O-N 3.04Å; E548-K550 WeakPolarHBondContact OE2-CE 3.33Å; E548-K550 IonicContact OE2-NZ 3.08Å; E548-K550 PolarHBondContact OE2-NZ 2.81Å
549	V	56	Low	63.1	Low	20.5 Å²	20.5	46.5 Å²	46.5	12%	0.124	26%	0.255	C	S	.	.			trans	-66.7	124.6	168.4	176.4	0	0	0	0	107.9	F430 L456 S547 I552	F430-V549 CarbonylContact C-O 3.56Å; F430-V549 HydrophobicContact CB-CB 4.01Å; F430-V549 WeakPolarHBondContact CB-O 3.29Å; F430-V549 HydrophobicContact CD1-CB 3.77Å; F430-V549 HydrophobicContact CD1-CG1 3.89Å; F430-V549 WeakPolarHBondContact CD1-O 3.26Å; F430-V549 HydrophobicContact CE1-CB 4.1Å; F430-V549 PolarHBondContact N-O 2.64Å; L456-V549 HydrophobicContact CB-CG1 4.07Å; L456-V549 HydrophobicContact CB-CG2 4.34Å; L456-V549 HydrophobicContact CD2-CG1 4.39Å; S547-V549 PolarHBondContact O-N 2.92Å; S547-V549 VanDerWaalsContact O-N 3.16Å; V549-I552 HydrophobicContact CG1-CG1 4.2Å
550	K	56.4	Low	63.3	Low	59.5 Å²	59.5	48.2 Å²	48.2	26%	0.259	27%	0.268	S	S	.	.			trans	-114.9	-23.4	-173.1	-58.4	-169.9	-175.9	-178.8	0	113.6	P429 F430 N457 D459 E548 G611	P429-K550 CarbonylContact C-O 3.59Å; P429-K550 VanDerWaalsContact CA-O 3.24Å; P429-K550 WeakPolarHBondContact CA-O 3.06Å; F430-K550 PolarHBondContact N-O 3.26Å; F430-K550 WeakPolarHBondContact O-CA 3.47Å; N457-K550 PolarHBondContact O-N 3.09Å; D459-K550 WeakPolarHBondContact OD1-CD 3.22Å; D459-K550 VanDerWaalsContact OD1-CE 3.26Å; D459-K550 WeakPolarHBondContact OD1-CE 3.44Å; D459-K550 IonicContact OD1-NZ 3.33Å; D459-K550 PolarHBondContact OD1-NZ 3.05Å; D459-K550 WeakPolarHBondContact OD2-CE 3.49Å; D459-K550 IonicContact OD2-NZ 2.8Å; D459-K550 PolarHBondContact OD2-NZ 2.9Å; E548-K550 HydrophobicContact CB-CG 4.42Å; E548-K550 HydrophobicContact CG-CD 4.37Å; E548-K550 HydrophobicContact CG-CG 4.21Å; E548-K550 WeakPolarHBondContact O-CE 3.38Å; E548-K550 WeakPolarHBondContact O-CG 3.32Å; E548-K550 PolarHBondContact O-N 3.04Å; E548-K550 WeakPolarHBondContact OE2-CE 3.33Å; E548-K550 IonicContact OE2-NZ 3.08Å; E548-K550 PolarHBondContact OE2-NZ 2.81Å; K550-G611 PolarHBondContact NZ-O 3.14Å
551	V	58.5	Low	63.2	Low	35.5 Å²	35.5	46.1 Å²	46.1	22%	0.215	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	124.9	178	-168.2	0	0	0	0	110.2	P425 K427 I428 N457 T553	P425-V551 HydrophobicContact CB-CG1 3.66Å; K427-V551 HydrophobicContact CB-CG1 3.68Å; K427-V551 HydrophobicContact CD-CG1 4.22Å; K427-V551 HydrophobicContact CG-CG1 3.78Å; K427-V551 HydrophobicContact CG-CG2 4.38Å; I428-V551 WeakPolarHBondContact O-CA 3.13Å; N457-V551 HydrophobicContact CB-CB 4.27Å; N457-V551 WeakPolarHBondContact CB-O 3.5Å; N457-V551 PolarHBondContact N-O 2.93Å; N457-V551 PolarHBondContact ND2-O 2.95Å; N457-V551 PolarHBondContact O-N 3.11Å; V551-T553 HydrophobicContact CG1-CG2 3.74Å
552	I	63	Low	63.2	Low	13.5 Å²	13.5	47.4 Å²	47.4	7%	0.069	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	135.7	165.2	-57.5	178.8	0	0	0	107.4	I428 V439 I454 D455 L456 V549 I563	I428-I552 PolarHBondContact N-O 3.39Å; I428-I552 VanDerWaalsContact N-O 3.1Å; I428-I552 PolarHBondContact O-N 2.8Å; V439-I552 HydrophobicContact CG1-CD1 3.88Å; I454-I552 HydrophobicContact CG2-CG2 4.13Å; D455-I552 CarbonylContact O-C 3.6Å; D455-I552 WeakPolarHBondContact O-CA 3.33Å; L456-I552 HydrophobicContact CD2-CB 4.27Å; L456-I552 HydrophobicContact CD2-CD1 4.1Å; L456-I552 HydrophobicContact CD2-CG1 3.98Å; L456-I552 HydrophobicContact CD2-CG2 3.84Å; L456-I552 HydrophobicContact CG-CD1 4.48Å; L456-I552 HydrophobicContact CG-CG1 4.09Å; V549-I552 HydrophobicContact CG1-CG1 4.2Å; I552-I563 HydrophobicContact CB-CD1 3.73Å; I552-I563 HydrophobicContact CD1-CD1 4.25Å; I552-I563 HydrophobicContact CG1-CD1 4.47Å; I552-I563 HydrophobicContact CG2-CD1 3.61Å
553	T	60.7	Low	63.2	Low	26 Å²	26	47.4 Å²	47.4	16%	0.16	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	128	175.5	66.5	0	0	0	0	111.6	P425 F426 K427 I454 D455 V551	P425-T553 HydrophobicContact CB-CG2 4.09Å; F426-T553 WeakPolarHBondContact O-CA 3.36Å; F426-T553 WeakPolarHBondContact O-CB 3.47Å; F426-T553 VanDerWaalsContact O-CG2 3.27Å; F426-T553 WeakPolarHBondContact O-CG2 3.43Å; K427-T553 HydrophobicContact CG-CG2 3.86Å; I454-T553 CarbonylContact C-O 3.5Å; I454-T553 WeakPolarHBondContact CA-O 3.16Å; D455-T553 WeakPolarHBondContact CB-OG1 3.39Å; D455-T553 PolarHBondContact N-O 2.94Å; D455-T553 PolarHBondContact O-N 2.94Å; V551-T553 HydrophobicContact CG1-CG2 3.74Å
554	A	65.4	Low	63.6	Low	5.5 Å²	5.5	46.6 Å²	46.6	5%	0.045	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	151.6	170.8	0	0	0	0	0	111.4	L443 I453 I454 V558 Y561	L443-A554 HydrophobicContact CD2-CB 4.08Å; I453-A554 CarbonylContact O-C 3.57Å; I453-A554 VanDerWaalsContact O-CA 3.3Å; I453-A554 WeakPolarHBondContact O-CA 3.19Å; I454-A554 HydrophobicContact CG1-CB 3.97Å; A554-V558 HydrophobicContact CB-CG2 4.42Å; A554-Y561 HydrophobicContact CB-CD1 3.58Å; A554-Y561 HydrophobicContact CB-CD2 4.42Å; A554-Y561 HydrophobicContact CB-CE1 3.86Å; A554-Y561 HydrophobicContact CB-CG 4.24Å
555	G	65.2	Low	63.9	Low	17 Å²	17	48.7 Å²	48.7	18%	0.175	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.9	-175.3	-178	0	0	0	0	0	112.7	I452 I453	I452-G555 CarbonylContact C-O 3.39Å; I452-G555 WeakPolarHBondContact CA-O 3.4Å; I453-G555 PolarHBondContact N-O 2.75Å; I453-G555 PolarHBondContact O-N 3.02Å
556	G	71.1	Confident	64.8	Low	42.5 Å²	42.5	52.3 Å²	52.3	44%	0.438	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	95.6	-132.5	-169	0	0	0	0	0	111.2	L423 V558	L423-G556 WeakPolarHBondContact CD1-O 3.43Å; G556-V558 VanDerWaalsContact C-N 3.28Å; G556-V558 PolarHBondContact O-N 3.1Å
557	N	73	Confident	65	Low	47.5 Å²	47.5	48.1 Å²	48.1	25%	0.254	27%	0.274	S	S	.	.	S	Bend	trans	-88.5	29.2	178	-68.8	87.7	0	0	0	113	K446 A449 S450 K451	K446-N557 WeakPolarHBondContact CG-O 3.43Å; K446-N557 PolarHBondContact N-O 2.94Å; A449-N557 HydrophobicContact CB-CB 3.56Å; S450-N557 PolarHBondContact N-OD1 2.68Å; S450-N557 PolarHBondContact OG-OD1 3.02Å; K451-N557 PolarHBondContact N-OD1 2.82Å; K451-N557 WeakPolarHBondContact O-CB 3.21Å; K451-N557 PolarHBondContact O-N 3.06Å; K451-N557 PolarHBondContact O-OD1 3.17Å
558	V	68.8	Low	65.1	Low	2.5 Å²	2.5	49.3 Å²	49.3	2%	0.015	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	140.3	174.9	-175.2	0	0	0	0	109.7	L423 L443 L445 K446 I452 A554 G556 S560 Y561	L423-V558 HydrophobicContact CD1-CB 3.98Å; L423-V558 HydrophobicContact CD1-CG1 3.83Å; L423-V558 WeakPolarHBondContact CD1-O 3.44Å; L443-V558 HydrophobicContact CD2-CG1 4.04Å; L443-V558 HydrophobicContact CD2-CG2 4.2Å; L445-V558 HydrophobicContact CD2-CG2 4.43Å; K446-V558 VanDerWaalsContact CE-O 3.23Å; K446-V558 WeakPolarHBondContact CE-O 3.37Å; I452-V558 HydrophobicContact CB-CG2 4.5Å; I452-V558 HydrophobicContact CG2-CG2 3.81Å; A554-V558 HydrophobicContact CB-CG2 4.42Å; G556-V558 VanDerWaalsContact C-N 3.28Å; G556-V558 PolarHBondContact O-N 3.1Å; V558-S560 WeakPolarHBondContact CG1-O 3.36Å; V558-Y561 HydrophobicContact CG1-CD1 4.49Å
559	E	71.3	Confident	64.4	Low	87 Å²	87	50.4 Å²	50.4	41%	0.407	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	-51	176.6	-177.3	145.9	-128.2	0	0	111.3	S444 K446	S444-E559 PolarHBondContact O-N 2.74Å; K446-E559 HydrophobicContact CG-CB 3.82Å; K446-E559 HydrophobicContact CG-CG 4.44Å
560	S	71.8	Confident	63.5	Low	45 Å²	45	54.7 Å²	54.7	32%	0.315	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	161.2	172.7	77.9	0	0	0	0	109.6	S444 V558	S444-S560 VanDerWaalsContact CB-OG 3.27Å; S444-S560 WeakPolarHBondContact CB-OG 3.4Å; S444-S560 PolarHBondContact N-O 2.74Å; S444-S560 PolarHBondContact OG-OG 3.32Å; V558-S560 WeakPolarHBondContact CG1-O 3.36Å
561	Y	72.7	Confident	62.5	Low	29.5 Å²	29.5	61 Å²	61	12%	0.116	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	153.5	168.6	74	-87.9	0	0	0	111	L423 L424 F426 I428 L441 E442 A554 V558 I563	L423-Y561 HydrophobicContact CB-CD1 4.25Å; L423-Y561 HydrophobicContact CB-CE1 3.72Å; L423-Y561 HydrophobicContact CD1-CD1 3.75Å; L423-Y561 HydrophobicContact CD1-CE1 3.97Å; L423-Y561 HydrophobicContact CD2-CD1 3.61Å; L423-Y561 HydrophobicContact CD2-CE1 3.9Å; L423-Y561 HydrophobicContact CD2-CG 4.41Å; L423-Y561 HydrophobicContact CG-CD1 4.06Å; L423-Y561 HydrophobicContact CG-CE1 4.05Å; L424-Y561 PolarHBondContact O-OH 2.74Å; L424-Y561 VanDerWaalsContact O-OH 3.14Å; F426-Y561 HydrophobicContact CB-CD1 4.34Å; F426-Y561 HydrophobicContact CB-CE1 3.29Å; F426-Y561 VanDerWaalsContact CB-CZ 3.46Å; F426-Y561 WeakPolarHBondContact CB-OH 3.34Å; F426-Y561 AromaticContact CD1-CE1 3.89Å; F426-Y561 HydrophobicContact CD1-CE1 3.89Å; F426-Y561 AromaticContact CD2-CD1 3.7Å; F426-Y561 HydrophobicContact CD2-CD1 3.7Å; F426-Y561 AromaticContact CD2-CE1 3.41Å; F426-Y561 HydrophobicContact CD2-CE1 3.41Å; F426-Y561 VanDerWaalsContact CD2-CE1 3.41Å; F426-Y561 HydrophobicContact CE1-CE1 4.48Å; F426-Y561 HydrophobicContact CE2-CD1 4.03Å; F426-Y561 HydrophobicContact CE2-CE1 4.06Å; F426-Y561 HydrophobicContact CG-CD1 4.08Å; F426-Y561 AromaticContact CG-CE1 3.3Å; F426-Y561 HydrophobicContact CG-CE1 3.3Å; I428-Y561 HydrophobicContact CD1-CE2 3.62Å; I428-Y561 HydrophobicContact CG1-CE2 3.95Å; I428-Y561 VanDerWaalsContact CG1-OH 3.23Å; I428-Y561 WeakPolarHBondContact CG1-OH 3.46Å; L441-Y561 HydrophobicContact CD1-CD2 3.78Å; L441-Y561 HydrophobicContact CD1-CG 4.23Å; E442-Y561 CarbonylContact O-C 3.53Å; E442-Y561 WeakPolarHBondContact O-CA 3.32Å; E442-Y561 WeakPolarHBondContact O-CB 3.21Å; A554-Y561 HydrophobicContact CB-CD1 3.58Å; A554-Y561 HydrophobicContact CB-CD2 4.42Å; A554-Y561 HydrophobicContact CB-CE1 3.86Å; A554-Y561 HydrophobicContact CB-CG 4.24Å; V558-Y561 HydrophobicContact CG1-CD1 4.49Å; Y561-I563 HydrophobicContact CD2-CD1 4.2Å; Y561-I563 HydrophobicContact CD2-CG1 3.93Å; Y561-I563 HydrophobicContact CE2-CD1 3.85Å; Y561-I563 HydrophobicContact CE2-CG1 3.99Å
562	E	72.8	Confident	61.4	Low	130 Å²	130	63.4 Å²	63.4	61%	0.607	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.7	149	171	-173.7	153.1	-179.5	0	0	109.7	L441 E442	L441-E562 CarbonylContact C-O 3.56Å; L441-E562 WeakPolarHBondContact CA-O 3.31Å; E442-E562 HydrophobicContact CB-CB 4.44Å; E442-E562 PolarHBondContact N-O 2.77Å; E442-E562 PolarHBondContact O-N 2.9Å
563	I	67.6	Low	60.2	Low	24.5 Å²	24.5	67.9 Å²	67.9	13%	0.126	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	117.2	176.4	-57	-179.5	0	0	0	108.2	I428 V439 V440 L441 I552 Y561	I428-I563 HydrophobicContact CB-CD1 4.31Å; I428-I563 HydrophobicContact CD1-CB 4.08Å; I428-I563 HydrophobicContact CD1-CD1 3.91Å; I428-I563 HydrophobicContact CD1-CG1 3.99Å; I428-I563 HydrophobicContact CD1-CG2 3.57Å; I428-I563 HydrophobicContact CG1-CD1 4.3Å; V439-I563 HydrophobicContact CG1-CG2 3.97Å; V440-I563 CarbonylContact O-C 3.56Å; V440-I563 VanDerWaalsContact O-CA 3.29Å; V440-I563 WeakPolarHBondContact O-CA 3.38Å; L441-I563 HydrophobicContact CD1-CD1 4.04Å; L441-I563 HydrophobicContact CD1-CG1 3.59Å; I552-I563 HydrophobicContact CB-CD1 3.73Å; I552-I563 HydrophobicContact CD1-CD1 4.25Å; I552-I563 HydrophobicContact CG1-CD1 4.47Å; I552-I563 HydrophobicContact CG2-CD1 3.61Å; Y561-I563 HydrophobicContact CD2-CD1 4.2Å; Y561-I563 HydrophobicContact CD2-CG1 3.93Å; Y561-I563 HydrophobicContact CE2-CD1 3.85Å; Y561-I563 HydrophobicContact CE2-CG1 3.99Å
564	S	69.9	Low	59.3	Low	38 Å²	38	73.4 Å²	73.4	27%	0.266	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	147.5	169.8	64.1	0	0	0	0	110.8	V440 Q566	V440-S564 PolarHBondContact N-O 2.83Å; V440-S564 PolarHBondContact O-N 2.88Å; S564-Q566 PolarHBondContact OG-NE2 2.96Å
565	I	64.7	Low	58.1	Low	75.5 Å²	75.5	79 Å²	79	39%	0.387	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	118.4	167.5	-60.2	177.7	0	0	0	106.5	I428 F430 Q437 N438 V439	I428-I565 HydrophobicContact CG2-CD1 3.56Å; I428-I565 HydrophobicContact CG2-CG1 4.3Å; F430-I565 HydrophobicContact CD2-CD1 4.02Å; F430-I565 HydrophobicContact CE2-CD1 3.91Å; F430-I565 HydrophobicContact CE2-CG1 4.05Å; Q437-I565 HydrophobicContact CB-CG2 4.18Å; Q437-I565 HydrophobicContact CG-CG2 4.34Å; N438-I565 CarbonylContact O-C 3.59Å; N438-I565 WeakPolarHBondContact O-CA 3.4Å; V439-I565 HydrophobicContact CG2-CD1 4.48Å; V439-I565 HydrophobicContact CG2-CG1 4.24Å
566	Q	69.9	Low	57	Low	93.5 Å²	93.5	85 Å²	85	44%	0.437	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	129.2	176.8	-58.6	176.5	3.1	0	0	108.8	N438 V440 S564	N438-Q566 HydrophobicContact CB-CB 4.17Å; N438-Q566 WeakPolarHBondContact CB-O 3.29Å; N438-Q566 PolarHBondContact N-O 2.95Å; N438-Q566 PolarHBondContact O-N 2.78Å; V440-Q566 HydrophobicContact CG2-CG 4.24Å; S564-Q566 PolarHBondContact OG-NE2 2.96Å
567	S	56.4	Low	55.3	Low	102 Å²	102	86.8 Å²	86.8	71%	0.713	47%	0.466	S	S	*	.			trans	-71.9	134.5	168.1	-59.2	0	0	0	0	108.7	S569	S567-S569 PolarHBondContact O-N 3.09Å
568	P	54.1	Low	53.6	Low	61.5 Å²	61.5	89.3 Å²	89.3	40%	0.399	48%	0.483	S	S	.	.			trans	-70.6	98.9	179.7	28.5	-33.9	0	0	0	110.2	S436 S570	S436-P568 VanDerWaalsContact O-CD 3.31Å; S436-P568 WeakPolarHBondContact O-CD 3.42Å; S436-P568 WeakPolarHBondContact O-CG 3.28Å; P568-S570 PolarHBondContact O-N 2.79Å; P568-S570 VanDerWaalsContact O-N 3.07Å
569	S	42.7	Very low	52	Low	101.5 Å²	101.5	97 Å²	97	71%	0.71	52%	0.518	S	S	*	.			trans	-65.5	125	162.9	47.7	0	0	0	0	109.5	S567 K571	S567-S569 PolarHBondContact O-N 3.09Å; S569-K571 PolarHBondContact O-N 2.98Å
570	S	36.6	Very low	50.2	Low	110.5 Å²	110.5	102.9 Å²	102.9	77%	0.773	54%	0.543	S	S	*	.	S	Bend	trans	-5.5	114.2	174.5	54	0	0	0	0	115.6	P568	P568-S570 PolarHBondContact O-N 2.79Å; P568-S570 VanDerWaalsContact O-N 3.07Å
571	K	36.4	Very low	48.1	Very low	193.5 Å²	193.5	104.5 Å²	104.5	84%	0.841	55%	0.554	S	S	*	*			trans	50.7	91.5	170.5	-67.3	-175.7	175.5	-175.3	0	114.6	S569 D573	S569-K571 PolarHBondContact O-N 2.98Å; K571-D573 PolarHBondContact O-N 2.93Å; K571-D573 VanDerWaalsContact O-N 3.09Å
572	I	35.2	Very low	46	Very low	85 Å²	85	110.1 Å²	110.1	44%	0.436	59%	0.585	S	S	.	*			trans	-68.3	103.9	158.4	-58.1	172.8	0	0	0	106.9	L577	I572-L577 HydrophobicContact CG2-CD1 3.7Å; I572-L577 HydrophobicContact CG2-CG 4.16Å
573	D	38.2	Very low	43.9	Very low	108.5 Å²	108.5	110.7 Å²	110.7	58%	0.58	60%	0.597	S	S	*	*			trans	-70.9	141	167.6	-121.5	-39	0	0	0	109	K571 D575 E576	K571-D573 PolarHBondContact O-N 2.93Å; K571-D573 VanDerWaalsContact O-N 3.09Å; D573-D575 PolarHBondContact O-N 3.06Å; D573-D575 VanDerWaalsContact O-N 3.14Å; D573-E576 PolarHBondContact O-N 2.84Å
574	E	41	Very low	42	Very low	140.5 Å²	140.5	115.3 Å²	115.3	66%	0.657	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.9	-16.3	-174	-70.7	-163	139.7	0	0	112.5	K537	K537-E574 IonicContact NZ-OE1 3.17Å
575	D	40.7	Very low	40.2	Very low	124.5 Å²	124.5	120.3 Å²	120.3	67%	0.666	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-28.1	177	-69.6	-37.6	0	0	0	114.7	D573 L577 V578	D573-D575 PolarHBondContact O-N 3.06Å; D573-D575 VanDerWaalsContact O-N 3.14Å; D575-L577 VanDerWaalsContact C-N 3.3Å; D575-L577 PolarHBondContact O-N 3.21Å; D575-V578 WeakPolarHBondContact O-CB 3.39Å; D575-V578 PolarHBondContact O-N 2.92Å; D575-V578 VanDerWaalsContact O-N 3.1Å
576	E	41.1	Very low	38.6	Very low	142 Å²	142	123.2 Å²	123.2	66%	0.664	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.6	-25.1	-171.4	-158.4	-178.1	-161.8	0	0	112.6	D573 V578 Q579	D573-E576 PolarHBondContact O-N 2.84Å; E576-V578 PolarHBondContact O-N 2.92Å; E576-Q579 PolarHBondContact O-N 3.32Å
577	L	36.1	Very low	36.8	Very low	80.5 Å²	80.5	126.9 Å²	126.9	42%	0.421	69%	0.688	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69	-13.8	174.3	-85.7	166.7	0	0	0	113.9	Y532 I572 D575	Y532-L577 HydrophobicContact CE1-CD1 4.41Å; I572-L577 HydrophobicContact CG2-CD1 3.7Å; I572-L577 HydrophobicContact CG2-CG 4.16Å; D575-L577 VanDerWaalsContact C-N 3.3Å; D575-L577 PolarHBondContact O-N 3.21Å
578	V	37.1	Very low	35.6	Very low	100 Å²	100	130.9 Å²	130.9	61%	0.606	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-22.8	-176.7	-175.4	0	0	0	0	112.2	D575 E576 K580 S581	D575-V578 WeakPolarHBondContact O-CB 3.39Å; D575-V578 PolarHBondContact O-N 2.92Å; D575-V578 VanDerWaalsContact O-N 3.1Å; E576-V578 PolarHBondContact O-N 2.92Å; V578-K580 PolarHBondContact O-N 3.13Å; V578-S581 PolarHBondContact O-OG 2.77Å
579	Q	36.3	Very low	34.3	Very low	163 Å²	163	134.5 Å²	134.5	76%	0.762	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	-2.3	-168.4	-66.2	-171.2	-4.3	0	0	115.9	E576 S581	E576-Q579 PolarHBondContact O-N 3.32Å; Q579-S581 PolarHBondContact O-N 3.01Å
580	K	32.9	Very low	33.7	Very low	211 Å²	211	137.2 Å²	137.2	92%	0.917	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.2	26.7	-179.8	-110.7	175.5	-176.5	170	0	114.8	V578	V578-K580 PolarHBondContact O-N 3.13Å
581	S	27.1	Very low	33.4	Very low	79.5 Å²	79.5	138.3 Å²	138.3	56%	0.556	73%	0.725	S	S	*	*			trans	-102.2	154.6	174.7	60	0	0	0	0	111.7	V578 Q579	V578-S581 PolarHBondContact O-OG 2.77Å; Q579-S581 PolarHBondContact O-N 3.01Å
582	I	28.5	Very low	33.3	Very low	148 Å²	148	137.4 Å²	137.4	76%	0.759	72%	0.724	S	S	*	*			trans	76.4	116.9	175.7	-46.7	162.6	0	0	0	112.6
583	T	29.4	Very low	33.2	Very low	141 Å²	141	142.6 Å²	142.6	87%	0.865	75%	0.746	S	S	*	*				-134.3	122	91.7	13	0	0	0	0	111.6
584	T	27.2	Very low	32.7	Very low	122 Å²	122	141.9 Å²	141.9	75%	0.748	74%	0.741	S	S	*	*			trans	-99	127.8	174.6	-25.8	0	0	0	0	110
585	D	32.4	Very low	32.4	Very low	142 Å²	142	139.3 Å²	139.3	76%	0.759	74%	0.736	S	S	*	*			trans	-147	115.7	159.7	-108.2	-42.1	0	0	0	112.1
586	N	30.8	Very low	32	Very low	137 Å²	137	138.9 Å²	138.9	73%	0.733	74%	0.74	S	S	*	*			trans	29.5	119.3	147.5	-50.1	-55.8	0	0	0	120.4
587	I	31.9	Very low	31.8	Very low	172 Å²	172	139.4 Å²	139.4	88%	0.882	74%	0.736	S	S	*	*				-161.6	151.8	123	-97.2	151.6	0	0	0	108.7
588	E	31.4	Very low	31.8	Very low	185 Å²	185	141.4 Å²	141.4	86%	0.864	75%	0.751	S	S	*	*			trans	-77.5	168.6	-159	-67	162.2	116.1	0	0	116
589	T	26.3	Very low	32.3	Very low	138 Å²	138	141.5 Å²	141.5	85%	0.847	75%	0.747	S	S	*	*			trans	-75	127.6	176	48.8	0	0	0	0	112.4
590	D	31.4	Very low	32.9	Very low	157.5 Å²	157.5	138.8 Å²	138.8	84%	0.842	74%	0.738	S	S	*	*			trans	-140.4	156.4	149.2	-135.8	-26.9	0	0	0	111.8	E592	D590-E592 PolarHBondContact O-N 2.74Å
591	T	30.8	Very low	34.1	Very low	133.5 Å²	133.5	132.6 Å²	132.6	82%	0.819	71%	0.713	S	S	*	*			trans	-116.3	83.5	-160.2	-40	0	0	0	0	112.7
592	E	34.3	Very low	36	Very low	174.5 Å²	174.5	132.1 Å²	132.1	82%	0.815	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-104	136.9	176.9	-70.8	-159.2	131.5	0	0	113.8	D590 M594	D590-E592 PolarHBondContact O-N 2.74Å; E592-M594 PolarHBondContact O-N 3.13Å
593	E	31.4	Very low	38.3	Very low	194 Å²	194	127.5 Å²	127.5	91%	0.907	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-69.4	136.9	175.7	-71.5	-168.4	119.6	0	0	112.3	P595	E593-P595 WeakPolarHBondContact O-CD 3.43Å
594	M	28.6	Very low	40.6	Very low	94 Å²	94	124.2 Å²	124.2	46%	0.463	66%	0.656	S	S	.	*			trans	-84.7	122.2	-172.8	-73.4	-153.3	107.7	0	0	112.6	S418 M419 S420 E592 R597	S418-M594 WeakPolarHBondContact OG-CE 3.2Å; M419-M594 PolarHBondContact N-SD 2.93Å; S420-M594 PolarHBondContact OG-O 3.29Å; E592-M594 PolarHBondContact O-N 3.13Å; M594-R597 HydrophobicContact CE-CG 4.07Å; M594-R597 VanDerWaalsContact CE-NE 3.29Å; M594-R597 PolarHBondContact SD-NH2 2.69Å
595	P	34.1	Very low	43.1	Very low	87 Å²	87	119.7 Å²	119.7	57%	0.565	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-62	155.9	-178.8	-1.1	1.3	0	0	0	114.1	E593 R597	E593-P595 WeakPolarHBondContact O-CD 3.43Å; P595-R597 PolarHBondContact O-N 2.89Å
596	P	32.1	Very low	45.3	Very low	114.5 Å²	114.5	114.7 Å²	114.7	74%	0.744	60%	0.603	S	S	*	*			trans	-69.7	116.7	-175.9	27.5	-34.5	0	0	0	112.3	T598	P596-T598 PolarHBondContact O-N 3.41Å
597	R	37	Very low	47.7	Very low	154 Å²	154	108.5 Å²	108.5	58%	0.581	57%	0.57	S	S	*	*			trans	-61.9	123.4	175.8	-68.7	179.2	173.7	-170.4	-6	111	M419 G422 M594 P595 I599	M419-R597 PolarHBondContact SD-NH2 2.97Å; G422-R597 PolarHBondContact O-NH1 2.78Å; M594-R597 HydrophobicContact CE-CG 4.07Å; M594-R597 VanDerWaalsContact CE-NE 3.29Å; M594-R597 PolarHBondContact SD-NH2 2.69Å; P595-R597 PolarHBondContact O-N 2.89Å; R597-I599 PolarHBondContact O-N 2.98Å
598	T	37.2	Very low	49.9	Very low	121.5 Å²	121.5	104.6 Å²	104.6	75%	0.745	55%	0.55	S	S	*	*	P	Polyproline II helix	trans	-72.3	122.5	165.8	38.6	0	0	0	0	109.7	P596 D600 P624	P596-T598 PolarHBondContact O-N 3.41Å; T598-D600 PolarHBondContact O-N 3.22Å; T598-P624 HydrophobicContact CG2-CB 4.32Å
599	I	46.5	Very low	51.8	Low	102 Å²	102	98.7 Å²	98.7	52%	0.523	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-74	132.5	172.7	-58.4	173	0	0	0	107.9	R597	R597-I599 PolarHBondContact O-N 2.98Å
600	D	48.9	Very low	53.6	Low	106.5 Å²	106.5	99.6 Å²	99.6	57%	0.57	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-54	138.1	-172.6	-70.7	-72.6	0	0	0	113.5	S420 T598 L602	S420-D600 VanDerWaalsContact CB-OD1 3.26Å; S420-D600 WeakPolarHBondContact CB-OD1 3.4Å; S420-D600 WeakPolarHBondContact CB-OD2 3.26Å; S420-D600 VanDerWaalsContact OG-CB 3.28Å; S420-D600 WeakPolarHBondContact OG-CB 3.47Å; S420-D600 PolarHBondContact OG-OD1 2.79Å; S420-D600 PolarHBondContact OG-OD2 2.73Å; T598-D600 PolarHBondContact O-N 3.22Å; D600-L602 PolarHBondContact O-N 3.07Å
601	E	59.7	Low	54.8	Low	80.6667 Å²	80.6667	94.6 Å²	94.6	38%	0.377	51%	0.509	S	S	.	.	S	Bend	trans	-63.1	-4.2	-177	-57.8	-172	128.9	0	0	114.5	W603 R620 Y621	E601-W603 PolarHBondContact O-N 3Å; E601-R620 HydrophobicContact CB-CB 4.35Å; E601-R620 HydrophobicContact CB-CG 4.27Å; E601-R620 VanDerWaalsContact O-CA 3.27Å; E601-R620 WeakPolarHBondContact O-CA 3.37Å; E601-R620 WeakPolarHBondContact OE2-CD 3.49Å; E601-R620 IonicContact OE2-CZ 3.66Å; E601-R620 IonicContact OE2-NE 3.91Å; E601-R620 IonicContact OE2-NH1 2.7Å; E601-R620 PolarHBondContact OE2-NH1 2.63Å; E601-Y621 PolarHBondContact O-N 3.08Å; E601-Y621 VanDerWaalsContact O-N 3.09Å
602	L	66.7	Low	56.4	Low	69.3333 Å²	69.3333	94.7 Å²	94.7	36%	0.363	50%	0.501	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	101.6	-168.3	-165.1	73.8	0	0	0	112.2	M419 D600 N618 R620	M419-L602 HydrophobicContact CE-CD1 3.67Å; M419-L602 HydrophobicContact CE-CD2 3.58Å; M419-L602 HydrophobicContact CE-CG 4.22Å; D600-L602 PolarHBondContact O-N 3.07Å; L602-N618 HydrophobicContact CD1-CB 4.05Å; L602-N618 HydrophobicContact CG-CB 4.34Å; L602-R620 HydrophobicContact CD1-CG 4.16Å
603	W	75.9	Confident	58.2	Low	50.6667 Å²	50.6667	92.3 Å²	92.3	19%	0.192	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	141.2	172.3	-64.8	66.5	0	0	0	110	E601 N618 F619 L625 L633 M644 L646 I651	E601-W603 PolarHBondContact O-N 3Å; W603-N618 CarbonylContact O-C 3.54Å; W603-N618 VanDerWaalsContact O-CA 3.3Å; W603-N618 WeakPolarHBondContact O-CA 3.41Å; W603-F619 HydrophobicContact CB-CD1 4.29Å; W603-F619 HydrophobicContact CB-CD2 3.7Å; W603-F619 HydrophobicContact CB-CE1 3.93Å; W603-F619 HydrophobicContact CB-CE2 3.3Å; W603-F619 HydrophobicContact CB-CG 4.19Å; W603-F619 HydrophobicContact CB-CZ 3.43Å; W603-F619 VanDerWaalsContact CB-CZ 3.43Å; W603-F619 WeakPolarHBondContact CB-O 3.41Å; W603-F619 HydrophobicContact CD2-CE2 4.28Å; W603-F619 HydrophobicContact CE3-CE2 4.47Å; W603-F619 HydrophobicContact CG-CD2 4.33Å; W603-F619 AromaticContact CG-CE2 3.78Å; W603-F619 HydrophobicContact CG-CE2 3.78Å; W603-F619 HydrophobicContact CG-CZ 4.21Å; W603-F619 PolarHBondContact N-O 3.16Å; W603-F619 PolarHBondContact O-N 2.79Å; W603-F619 VanDerWaalsContact O-O 3.06Å; W603-L625 HydrophobicContact CH2-CD1 3.85Å; W603-L625 HydrophobicContact CH2-CG 4.37Å; W603-L625 HydrophobicContact CZ2-CD1 3.85Å; W603-L625 HydrophobicContact CZ2-CG 4.03Å; W603-L633 HydrophobicContact CH2-CD1 4.42Å; W603-L633 HydrophobicContact CZ3-CD1 4.32Å; W603-M644 HydrophobicContact CE3-CE 4.31Å; W603-M644 HydrophobicContact CZ3-CE 4.17Å; W603-L646 HydrophobicContact CH2-CD1 4.38Å; W603-L646 HydrophobicContact CH2-CD2 4.12Å; W603-L646 HydrophobicContact CZ2-CD2 3.96Å; W603-I651 HydrophobicContact CD2-CD1 4.09Å; W603-I651 HydrophobicContact CE3-CD1 3.71Å; W603-I651 HydrophobicContact CH2-CD1 3.93Å; W603-I651 HydrophobicContact CZ2-CD1 4.29Å; W603-I651 HydrophobicContact CZ3-CD1 3.63Å
604	T	77.2	Confident	60.3	Low	72 Å²	72	84.8 Å²	84.8	44%	0.442	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	118.3	179.2	-58.2	0	0	0	0	110.9	R616 V617 N618	T604-R616 HydrophobicContact CG2-CB 4.46Å; T604-V617 WeakPolarHBondContact CA-O 3.44Å; T604-N618 WeakPolarHBondContact CB-OD1 3.45Å; T604-N618 VanDerWaalsContact CG2-OD1 3.28Å; T604-N618 WeakPolarHBondContact CG2-OD1 3.27Å; T604-N618 PolarHBondContact OG1-OD1 2.93Å
605	F	79.9	Confident	62.4	Low	28.3333 Å²	28.3333	84 Å²	84	12%	0.124	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	142.7	158.6	-112	-53.6	0	0	0	109.4	R616 V617 F619 A642 M644 S652 Y655 L657	F605-R616 CarbonylContact O-C 3.58Å; F605-R616 VanDerWaalsContact O-CA 3.31Å; F605-R616 WeakPolarHBondContact O-CA 3.41Å; F605-V617 HydrophobicContact CB-CB 4.26Å; F605-V617 PolarHBondContact N-O 3.04Å; F605-V617 PolarHBondContact O-N 3.15Å; F605-F619 HydrophobicContact CB-CE1 4.26Å; F605-F619 HydrophobicContact CD2-CD1 4.42Å; F605-F619 AromaticContact CD2-CE1 3.72Å; F605-F619 HydrophobicContact CD2-CE1 3.72Å; F605-F619 HydrophobicContact CD2-CZ 4.38Å; F605-F619 HydrophobicContact CE2-CE1 4.41Å; F605-F619 AromaticContact CG-CE1 3.95Å; F605-F619 HydrophobicContact CG-CE1 4.12Å; F605-A642 HydrophobicContact CE2-CB 4.13Å; F605-A642 HydrophobicContact CZ-CB 4.15Å; F605-M644 HydrophobicContact CD1-SD 4.1Å; F605-M644 HydrophobicContact CD2-CG 4.38Å; F605-M644 HydrophobicContact CD2-SD 3.61Å; F605-M644 HydrophobicContact CE1-CG 4.13Å; F605-M644 HydrophobicContact CE1-SD 3.32Å; F605-M644 WeakPolarHBondContact CE1-SD 3.45Å; F605-M644 HydrophobicContact CE2-CG 4.3Å; F605-M644 HydrophobicContact CE2-SD 3.95Å; F605-M644 HydrophobicContact CZ-CB 4.27Å; F605-M644 HydrophobicContact CZ-CG 3.64Å; F605-M644 HydrophobicContact CZ-SD 3.34Å; F605-M644 WeakPolarHBondContact CZ-SD 3.33Å; F605-S652 VanDerWaalsContact CE2-CB 3.44Å; F605-S652 WeakPolarHBondContact CE2-OG 3.25Å; F605-Y655 HydrophobicContact CB-CD1 4.3Å; F605-Y655 HydrophobicContact CB-CD2 3.64Å; F605-Y655 HydrophobicContact CB-CE1 4.3Å; F605-Y655 HydrophobicContact CB-CE2 3.84Å; F605-Y655 HydrophobicContact CB-CG 4.01Å; F605-Y655 AromaticContact CD1-CD1 3.62Å; F605-Y655 HydrophobicContact CD1-CD1 3.76Å; F605-Y655 AromaticContact CD1-CD2 3.55Å; F605-Y655 HydrophobicContact CD1-CD2 3.55Å; F605-Y655 AromaticContact CD1-CE1 3.35Å; F605-Y655 HydrophobicContact CD1-CE1 3.85Å; F605-Y655 AromaticContact CD1-CE2 3.51Å; F605-Y655 HydrophobicContact CD1-CE2 3.51Å; F605-Y655 AromaticContact CD1-CG 3.45Å; F605-Y655 HydrophobicContact CD1-CG 3.85Å; F605-Y655 VanDerWaalsContact CD1-CG 3.45Å; F605-Y655 AromaticContact CD1-CZ 3.4Å; F605-Y655 VanDerWaalsContact CD2-CB 3.42Å; F605-Y655 HydrophobicContact CD2-CD1 4.38Å; F605-Y655 AromaticContact CD2-CD2 3.93Å; F605-Y655 HydrophobicContact CD2-CD2 4.17Å; F605-Y655 AromaticContact CD2-CG 3.67Å; F605-Y655 HydrophobicContact CD2-CG 3.84Å; F605-Y655 AromaticContact CE1-CD1 3.22Å; F605-Y655 HydrophobicContact CE1-CD1 3.92Å; F605-Y655 HydrophobicContact CE1-CD2 4.28Å; F605-Y655 AromaticContact CE1-CE1 3.33Å; F605-Y655 HydrophobicContact CE1-CE1 3.33Å; F605-Y655 HydrophobicContact CE1-CE2 4.35Å; F605-Y655 AromaticContact CE1-CG 3.72Å; F605-Y655 HydrophobicContact CE1-CG 4.21Å; F605-Y655 AromaticContact CE1-CZ 3.9Å; F605-Y655 VanDerWaalsContact CE2-CB 3.46Å; F605-Y655 HydrophobicContact CE2-CD1 4.48Å; F605-Y655 AromaticContact CE2-CG 4Å; F605-Y655 HydrophobicContact CE2-CG 4.18Å; F605-Y655 AromaticContact CG-CD1 3.95Å; F605-Y655 HydrophobicContact CG-CD1 4.05Å; F605-Y655 AromaticContact CG-CD2 3.82Å; F605-Y655 HydrophobicContact CG-CD2 3.82Å; F605-Y655 HydrophobicContact CG-CE1 4.44Å; F605-Y655 AromaticContact CG-CE2 3.97Å; F605-Y655 HydrophobicContact CG-CE2 4.2Å; F605-Y655 AromaticContact CG-CG 3.67Å; F605-Y655 HydrophobicContact CG-CG 3.67Å; F605-Y655 AromaticContact CZ-CD1 3.83Å; F605-Y655 HydrophobicContact CZ-CD1 3.83Å; F605-Y655 HydrophobicContact CZ-CE1 4.35Å; F605-Y655 HydrophobicContact CZ-CG 4.28Å; F605-L657 HydrophobicContact CE1-CD2 3.98Å; F605-L657 HydrophobicContact CZ-CD2 4.1Å
606	S	79.1	Confident	64.4	Low	36.6667 Å²	36.6667	87.1 Å²	87.1	26%	0.256	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	161.2	174.8	58.5	0	0	0	0	111.9	W613 Y655	S606-W613 VanDerWaalsContact OG-CE3 3.26Å; S606-W613 VanDerWaalsContact OG-CZ3 3.23Å; S606-W613 WeakPolarHBondContact OG-CZ3 3.39Å; S606-Y655 VanDerWaalsContact CA-OH 3.3Å; S606-Y655 WeakPolarHBondContact CA-OH 3.39Å; S606-Y655 PolarHBondContact O-OH 3.02Å
607	S	80.7	Confident	66.6	Low	7.33333 Å²	7.33333	84.1 Å²	84.1	5%	0.051	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	124.3	177.8	-71.4	0	0	0	0	110.6	I609 W613 T614 Y655 P658	S607-I609 PolarHBondContact O-N 3.02Å; S607-W613 CarbonylContact O-C 3.59Å; S607-W613 WeakPolarHBondContact O-CA 3.12Å; S607-T614 PolarHBondContact N-O 3Å; S607-T614 PolarHBondContact O-N 3Å; S607-T614 PolarHBondContact O-OG1 3.11Å; S607-Y655 VanDerWaalsContact CB-OH 3.28Å; S607-Y655 WeakPolarHBondContact CB-OH 3.28Å; S607-Y655 PolarHBondContact N-OH 3.06Å; S607-Y655 VanDerWaalsContact N-OH 3.07Å; S607-Y655 WeakPolarHBondContact OG-CE1 3.18Å; S607-Y655 PolarHBondContact OG-OH 2.99Å; S607-P658 WeakPolarHBondContact OG-CD 3.34Å
608	L	78.3	Confident	68.6	Low	89 Å²	89	80.7 Å²	80.7	47%	0.466	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	110.1	167.4	-174.6	67.8	0	0	0	108.9	D459 G611 Q612 W613	D459-L608 HydrophobicContact CB-CD1 3.61Å; D459-L608 HydrophobicContact CB-CD2 3.83Å; D459-L608 HydrophobicContact CB-CG 4.35Å; D459-L608 WeakPolarHBondContact O-CD2 3.22Å; D459-L608 WeakPolarHBondContact OD1-CD1 3.45Å; L608-G611 WeakPolarHBondContact CD1-O 3.35Å; L608-Q612 WeakPolarHBondContact CA-O 3.27Å; L608-W613 HydrophobicContact CB-CD2 4.45Å; L608-W613 HydrophobicContact CB-CE3 4.15Å; L608-W613 HydrophobicContact CB-CH2 4.37Å; L608-W613 HydrophobicContact CB-CZ3 4.12Å; L608-W613 HydrophobicContact CD1-CD2 3.95Å; L608-W613 HydrophobicContact CD1-CE3 4.43Å; L608-W613 HydrophobicContact CD1-CG 4.14Å; L608-W613 HydrophobicContact CD1-CZ2 4.45Å
609	I	72.1	Confident	70.6	Confident	60.6667 Å²	60.6667	75.9 Å²	75.9	31%	0.311	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	124.7	179.3	-54.4	-179.8	0	0	0	107.3	S607 G611 Q612 T614 P658	S607-I609 PolarHBondContact O-N 3.02Å; I609-G611 VanDerWaalsContact C-N 3.29Å; I609-G611 PolarHBondContact O-N 2.94Å; I609-G611 VanDerWaalsContact O-N 3.17Å; I609-Q612 PolarHBondContact N-O 2.92Å; I609-Q612 PolarHBondContact O-N 2.8Å; I609-T614 HydrophobicContact CB-CG2 4.43Å; I609-T614 WeakPolarHBondContact CD1-OG1 3.4Å; I609-T614 WeakPolarHBondContact CG1-OG1 3.36Å; I609-P658 HydrophobicContact CD1-CB 3.86Å; I609-P658 HydrophobicContact CD1-CG 4.37Å; I609-P658 HydrophobicContact CG1-CB 4.27Å; I609-P658 HydrophobicContact CG1-CG 4.42Å
610	N	64.7	Low	71.6	Confident	157.333 Å²	157.333	78.5 Å²	78.5	84%	0.841	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.9	37	179.8	-58.4	-9.9	0	0	0	114.3	Q612	N610-Q612 VanDerWaalsContact C-N 3.32Å; N610-Q612 PolarHBondContact O-N 3.02Å
611	G	56.4	Low	72.5	Confident	52.3333 Å²	52.3333	74.4 Å²	74.4	54%	0.54	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.1	-2.3	-177.9	0	0	0	0	0	115.3	D459 K550 L608 I609	D459-G611 VanDerWaalsContact OD2-CA 3.25Å; D459-G611 WeakPolarHBondContact OD2-CA 3.44Å; K550-G611 PolarHBondContact NZ-O 3.14Å; L608-G611 WeakPolarHBondContact CD1-O 3.35Å; I609-G611 VanDerWaalsContact C-N 3.29Å; I609-G611 PolarHBondContact O-N 2.94Å; I609-G611 VanDerWaalsContact O-N 3.17Å
612	Q	63.5	Low	72.3	Confident	136.667 Å²	136.667	80 Å²	80	64%	0.639	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.5	136.5	177.4	-67.5	-173.7	-16.5	0	0	112	L608 I609 N610 T614	L608-Q612 WeakPolarHBondContact CA-O 3.27Å; I609-Q612 PolarHBondContact N-O 2.92Å; I609-Q612 PolarHBondContact O-N 2.8Å; N610-Q612 VanDerWaalsContact C-N 3.32Å; N610-Q612 PolarHBondContact O-N 3.02Å; Q612-T614 VanDerWaalsContact C-N 3.3Å; Q612-T614 HydrophobicContact CB-CG2 4.34Å; Q612-T614 PolarHBondContact O-N 2.97Å
613	W	72.9	Confident	71.9	Confident	123.667 Å²	123.667	79.8 Å²	79.8	47%	0.468	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	104.5	172.3	-73.3	103.7	0	0	0	110.3	C460 S606 S607 L608	C460-W613 VanDerWaalsContact SG-CH2 3.52Å; C460-W613 WeakPolarHBondContact SG-CZ2 3.4Å; S606-W613 VanDerWaalsContact OG-CE3 3.26Å; S606-W613 VanDerWaalsContact OG-CZ3 3.23Å; S606-W613 WeakPolarHBondContact OG-CZ3 3.39Å; S607-W613 CarbonylContact O-C 3.59Å; S607-W613 WeakPolarHBondContact O-CA 3.12Å; L608-W613 HydrophobicContact CB-CD2 4.45Å; L608-W613 HydrophobicContact CB-CE3 4.15Å; L608-W613 HydrophobicContact CB-CH2 4.37Å; L608-W613 HydrophobicContact CB-CZ3 4.12Å; L608-W613 HydrophobicContact CD1-CD2 3.95Å; L608-W613 HydrophobicContact CD1-CE3 4.43Å; L608-W613 HydrophobicContact CD1-CG 4.14Å; L608-W613 HydrophobicContact CD1-CZ2 4.45Å
614	T	74.5	Confident	71	Confident	37.3333 Å²	37.3333	81 Å²	81	23%	0.229	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	169.1	179	63.1	0	0	0	0	111	S607 I609 Q612 R616	S607-T614 PolarHBondContact N-O 3Å; S607-T614 PolarHBondContact O-N 3Å; S607-T614 PolarHBondContact O-OG1 3.11Å; I609-T614 HydrophobicContact CB-CG2 4.43Å; I609-T614 WeakPolarHBondContact CD1-OG1 3.4Å; I609-T614 WeakPolarHBondContact CG1-OG1 3.36Å; Q612-T614 VanDerWaalsContact C-N 3.3Å; Q612-T614 HydrophobicContact CB-CG2 4.34Å; Q612-T614 PolarHBondContact O-N 2.97Å; T614-R616 VanDerWaalsContact C-N 3.3Å; T614-R616 PolarHBondContact O-N 3.02Å; T614-R616 VanDerWaalsContact O-N 3.15Å
615	N	72.6	Confident	70.3	Confident	77.3333 Å²	77.3333	80.3 Å²	80.3	41%	0.414	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	51	46	174.5	-57.1	-13.8	0	0	0	113	V617 Y655	N615-V617 PolarHBondContact O-N 2.94Å; N615-V617 VanDerWaalsContact O-N 3.15Å; N615-Y655 HydrophobicContact CB-CE2 4.22Å; N615-Y655 WeakPolarHBondContact CB-OH 3.27Å; N615-Y655 VanDerWaalsContact O-CE2 3.25Å; N615-Y655 WeakPolarHBondContact O-CE2 3.39Å; N615-Y655 PolarHBondContact O-OH 3.19Å; N615-Y655 VanDerWaalsContact O-OH 3.07Å
616	R	76.4	Confident	69.4	Low	151 Å²	151	81.5 Å²	81.5	57%	0.57	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.6	119.8	176.2	-69.7	-174.4	173.8	-178.7	-1.1	109.8	T604 F605 T614	T604-R616 HydrophobicContact CG2-CB 4.46Å; F605-R616 CarbonylContact O-C 3.58Å; F605-R616 VanDerWaalsContact O-CA 3.31Å; F605-R616 WeakPolarHBondContact O-CA 3.41Å; T614-R616 VanDerWaalsContact C-N 3.3Å; T614-R616 PolarHBondContact O-N 3.02Å; T614-R616 VanDerWaalsContact O-N 3.15Å
617	V	77.8	Confident	68.2	Low	52 Å²	52	85.3 Å²	85.3	32%	0.315	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	105.7	177.8	178.1	0	0	0	0	108.2	T604 F605 N615 P653 Y655	T604-V617 WeakPolarHBondContact CA-O 3.44Å; F605-V617 HydrophobicContact CB-CB 4.26Å; F605-V617 PolarHBondContact N-O 3.04Å; F605-V617 PolarHBondContact O-N 3.15Å; N615-V617 PolarHBondContact O-N 2.94Å; N615-V617 VanDerWaalsContact O-N 3.15Å; V617-P653 HydrophobicContact CG1-CG 3.69Å; V617-P653 VanDerWaalsContact CG1-CG 3.46Å; V617-Y655 HydrophobicContact CB-CD2 4.22Å; V617-Y655 HydrophobicContact CB-CE2 4.32Å; V617-Y655 HydrophobicContact CG2-CD2 3.96Å; V617-Y655 HydrophobicContact CG2-CE2 3.91Å
618	N	79.7	Confident	67.3	Low	82 Å²	82	88.7 Å²	88.7	44%	0.439	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	140.7	175.3	-65.3	-6.2	0	0	0	110.1	L602 W603 T604	L602-N618 HydrophobicContact CD1-CB 4.05Å; L602-N618 HydrophobicContact CG-CB 4.34Å; W603-N618 CarbonylContact O-C 3.54Å; W603-N618 VanDerWaalsContact O-CA 3.3Å; W603-N618 WeakPolarHBondContact O-CA 3.41Å; T604-N618 WeakPolarHBondContact CB-OD1 3.45Å; T604-N618 VanDerWaalsContact CG2-OD1 3.28Å; T604-N618 WeakPolarHBondContact CG2-OD1 3.27Å; T604-N618 PolarHBondContact OG1-OD1 2.93Å
619	F	78.6	Confident	66.5	Low	20.6667 Å²	20.6667	89.9 Å²	89.9	9%	0.091	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	145.8	173.3	56.9	-85.8	0	0	0	109.7	W603 F605 M644 I651 S652 P653	W603-F619 HydrophobicContact CB-CD1 4.29Å; W603-F619 HydrophobicContact CB-CD2 3.7Å; W603-F619 HydrophobicContact CB-CE1 3.93Å; W603-F619 HydrophobicContact CB-CE2 3.3Å; W603-F619 HydrophobicContact CB-CG 4.19Å; W603-F619 HydrophobicContact CB-CZ 3.43Å; W603-F619 VanDerWaalsContact CB-CZ 3.43Å; W603-F619 WeakPolarHBondContact CB-O 3.41Å; W603-F619 HydrophobicContact CD2-CE2 4.28Å; W603-F619 HydrophobicContact CE3-CE2 4.47Å; W603-F619 HydrophobicContact CG-CD2 4.33Å; W603-F619 AromaticContact CG-CE2 3.78Å; W603-F619 HydrophobicContact CG-CE2 3.78Å; W603-F619 HydrophobicContact CG-CZ 4.21Å; W603-F619 PolarHBondContact N-O 3.16Å; W603-F619 PolarHBondContact O-N 2.79Å; W603-F619 VanDerWaalsContact O-O 3.06Å; F605-F619 HydrophobicContact CB-CE1 4.26Å; F605-F619 HydrophobicContact CD2-CD1 4.42Å; F605-F619 AromaticContact CD2-CE1 3.72Å; F605-F619 HydrophobicContact CD2-CE1 3.72Å; F605-F619 HydrophobicContact CD2-CZ 4.38Å; F605-F619 HydrophobicContact CE2-CE1 4.41Å; F605-F619 AromaticContact CG-CE1 3.95Å; F605-F619 HydrophobicContact CG-CE1 4.12Å; F619-M644 HydrophobicContact CZ-SD 4.45Å; F619-I651 WeakPolarHBondContact CD2-O 3.39Å; F619-I651 HydrophobicContact CE2-CB 4.31Å; F619-I651 HydrophobicContact CE2-CD1 4.12Å; F619-I651 HydrophobicContact CE2-CG1 3.87Å; F619-I651 WeakPolarHBondContact CE2-O 3.38Å; F619-I651 HydrophobicContact CZ-CD1 4.37Å; F619-I651 HydrophobicContact CZ-CG1 4.24Å; F619-S652 VanDerWaalsContact CZ-CB 3.47Å; F619-P653 HydrophobicContact CD1-CG 4.46Å
620	R	68.1	Low	66.5	Low	157 Å²	157	94.8 Å²	94.8	59%	0.592	49%	0.491	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.7	142.1	173.9	-69.1	-168.1	-174.5	-152.5	5.8	110.8	E601 L602	E601-R620 HydrophobicContact CB-CB 4.35Å; E601-R620 HydrophobicContact CB-CG 4.27Å; E601-R620 VanDerWaalsContact O-CA 3.27Å; E601-R620 WeakPolarHBondContact O-CA 3.37Å; E601-R620 WeakPolarHBondContact OE2-CD 3.49Å; E601-R620 IonicContact OE2-CZ 3.66Å; E601-R620 IonicContact OE2-NE 3.91Å; E601-R620 IonicContact OE2-NH1 2.7Å; E601-R620 PolarHBondContact OE2-NH1 2.63Å; L602-R620 HydrophobicContact CD1-CG 4.16Å
621	Y	67.7	Low	66.9	Low	20.6667 Å²	20.6667	91.2 Å²	91.2	8%	0.081	47%	0.468	C	S	.	.			trans	-141.4	122.8	174.5	-176.4	-111.2	0	0	0	111.3	E601 I623 L646 E649 I651	E601-Y621 PolarHBondContact O-N 3.08Å; E601-Y621 VanDerWaalsContact O-N 3.09Å; Y621-I623 VanDerWaalsContact C-N 3.35Å; Y621-I623 HydrophobicContact CD1-CB 4.17Å; Y621-I623 HydrophobicContact CD1-CG1 4.36Å; Y621-I623 HydrophobicContact CE1-CB 3.57Å; Y621-I623 HydrophobicContact CE1-CD1 3.94Å; Y621-I623 HydrophobicContact CE1-CG1 3.62Å; Y621-I623 VanDerWaalsContact CE1-CG1 3.45Å; Y621-I623 HydrophobicContact CE2-CG1 4.34Å; Y621-I623 PolarHBondContact O-N 2.89Å; Y621-I623 VanDerWaalsContact OH-CD1 3.24Å; Y621-I623 WeakPolarHBondContact OH-CD1 3.36Å; Y621-L646 HydrophobicContact CD1-CD2 4.41Å; Y621-L646 HydrophobicContact CE1-CB 4.22Å; Y621-L646 HydrophobicContact CE1-CD2 3.88Å; Y621-E649 HydrophobicContact CE2-CG 4.3Å; Y621-E649 WeakPolarHBondContact OH-CB 3.19Å; Y621-E649 VanDerWaalsContact OH-CD 3.27Å; Y621-E649 VanDerWaalsContact OH-CG 3.27Å; Y621-E649 WeakPolarHBondContact OH-CG 3.41Å; Y621-E649 PolarHBondContact OH-OE1 3.22Å; Y621-E649 PolarHBondContact OH-OE2 2.87Å; Y621-E649 VanDerWaalsContact OH-OE2 3.1Å; Y621-I651 HydrophobicContact CD1-CB 4.03Å; Y621-I651 HydrophobicContact CD1-CG2 3.63Å; Y621-I651 VanDerWaalsContact CD1-CG2 3.47Å; Y621-I651 HydrophobicContact CD2-CB 3.87Å; Y621-I651 HydrophobicContact CD2-CG2 3.82Å; Y621-I651 HydrophobicContact CE1-CB 4.27Å; Y621-I651 HydrophobicContact CE1-CG2 3.39Å; Y621-I651 HydrophobicContact CE2-CB 4.15Å; Y621-I651 HydrophobicContact CE2-CG2 3.62Å; Y621-I651 HydrophobicContact CG-CB 3.79Å; Y621-I651 HydrophobicContact CG-CG2 3.82Å; Y621-I651 VanDerWaalsContact CZ-CG2 3.42Å
622	R	56	Low	67.7	Low	198 Å²	198	92.3 Å²	92.3	75%	0.747	46%	0.461	S	S	*	.			trans	-83.4	10.6	-165.5	-63.9	-171.6	-177.6	177.5	1.2	115.4	P624	R622-P624 VanDerWaalsContact O-CD 3.23Å; R622-P624 WeakPolarHBondContact O-CD 3.41Å
623	I	58.3	Low	68.5	Low	66 Å²	66	89.1 Å²	89.1	34%	0.338	45%	0.448	S	S	.	.	S	Bend	trans	-89.9	113.9	170.2	-60.3	-169	0	0	0	108.7	Y621 L625 L646	Y621-I623 VanDerWaalsContact C-N 3.35Å; Y621-I623 HydrophobicContact CD1-CB 4.17Å; Y621-I623 HydrophobicContact CD1-CG1 4.36Å; Y621-I623 HydrophobicContact CE1-CB 3.57Å; Y621-I623 HydrophobicContact CE1-CD1 3.94Å; Y621-I623 HydrophobicContact CE1-CG1 3.62Å; Y621-I623 VanDerWaalsContact CE1-CG1 3.45Å; Y621-I623 HydrophobicContact CE2-CG1 4.34Å; Y621-I623 PolarHBondContact O-N 2.89Å; Y621-I623 VanDerWaalsContact OH-CD1 3.24Å; Y621-I623 WeakPolarHBondContact OH-CD1 3.36Å; I623-L625 PolarHBondContact O-N 3.11Å; I623-L646 HydrophobicContact CB-CD2 4.11Å; I623-L646 HydrophobicContact CG2-CD2 3.9Å
624	P	55.5	Low	68.9	Low	75.6667 Å²	75.6667	86.1 Å²	86.1	49%	0.491	44%	0.441	S	S	.	.			trans	-64.5	120.2	174.1	10.5	-12.1	0	0	0	110.7	T598 R622 T626	T598-P624 HydrophobicContact CG2-CB 4.32Å; R622-P624 VanDerWaalsContact O-CD 3.23Å; R622-P624 WeakPolarHBondContact O-CD 3.41Å; P624-T626 HydrophobicContact CB-CG2 3.66Å; P624-T626 WeakPolarHBondContact O-CG2 3.38Å; P624-T626 PolarHBondContact O-N 2.93Å; P624-T626 PolarHBondContact O-OG1 2.62Å
625	L	63.2	Low	69.2	Low	56 Å²	56	87.7 Å²	87.7	29%	0.293	45%	0.45	S	S	.	.			trans	-69.9	105.7	163.2	-72.8	-178.2	0	0	0	108.8	W603 I623 S627 F631 L646	W603-L625 HydrophobicContact CH2-CD1 3.85Å; W603-L625 HydrophobicContact CH2-CG 4.37Å; W603-L625 HydrophobicContact CZ2-CD1 3.85Å; W603-L625 HydrophobicContact CZ2-CG 4.03Å; I623-L625 PolarHBondContact O-N 3.11Å; L625-S627 PolarHBondContact O-N 2.82Å; L625-F631 HydrophobicContact CD1-CE1 4.34Å; L625-F631 HydrophobicContact CD1-CZ 4.4Å; L625-F631 HydrophobicContact CD2-CB 4.18Å; L625-F631 HydrophobicContact CD2-CD1 3.72Å; L625-F631 HydrophobicContact CD2-CD2 4.25Å; L625-F631 HydrophobicContact CD2-CE1 4.1Å; L625-F631 HydrophobicContact CD2-CE2 4.36Å; L625-F631 HydrophobicContact CD2-CG 3.79Å; L625-F631 HydrophobicContact CD2-CZ 4.35Å; L625-L646 HydrophobicContact CD2-CD1 4.34Å; L625-L646 HydrophobicContact CD2-CD2 3.92Å; L625-L646 HydrophobicContact CG-CD2 4.32Å
626	T	60.9	Low	69.5	Low	53.3333 Å²	53.3333	87.8 Å²	87.8	33%	0.327	45%	0.454	S	S	.	.			trans	-94.4	128.9	-168.8	32.5	0	0	0	0	110.2	P624 G628 K629	P624-T626 HydrophobicContact CB-CG2 3.66Å; P624-T626 WeakPolarHBondContact O-CG2 3.38Å; P624-T626 PolarHBondContact O-N 2.93Å; P624-T626 PolarHBondContact O-OG1 2.62Å; T626-G628 PolarHBondContact O-N 2.95Å; T626-K629 WeakPolarHBondContact O-CB 3.39Å; T626-K629 PolarHBondContact O-N 3.12Å; T626-K629 VanDerWaalsContact O-N 3.11Å; T626-K629 WeakPolarHBondContact OG1-CD 3.39Å; T626-K629 WeakPolarHBondContact OG1-CE 3.45Å; T626-K629 PolarHBondContact OG1-NZ 2.85Å
627	S	54.3	Low	69.6	Low	118 Å²	118	83.3 Å²	83.3	83%	0.825	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	135	-176.6	-169.8	0	0	0	0	111.8	L625 K629	L625-S627 PolarHBondContact O-N 2.82Å; S627-K629 VanDerWaalsContact C-N 3.29Å; S627-K629 PolarHBondContact O-N 3.1Å
628	G	62.4	Low	69.3	Low	78 Å²	78	87.1 Å²	87.1	80%	0.804	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.5	-8.8	179.5	0	0	0	0	0	116.7	T626	T626-G628 PolarHBondContact O-N 2.95Å
629	K	61.4	Low	68.9	Low	114 Å²	114	90.4 Å²	90.4	50%	0.496	48%	0.475	S	S	.	.			trans	-90	140.1	-179	-63.2	-144.3	-173.5	169	0	113.2	T626 S627	T626-K629 WeakPolarHBondContact O-CB 3.39Å; T626-K629 PolarHBondContact O-N 3.12Å; T626-K629 VanDerWaalsContact O-N 3.11Å; T626-K629 WeakPolarHBondContact OG1-CD 3.39Å; T626-K629 WeakPolarHBondContact OG1-CE 3.45Å; T626-K629 PolarHBondContact OG1-NZ 2.85Å; S627-K629 VanDerWaalsContact C-N 3.29Å; S627-K629 PolarHBondContact O-N 3.1Å
630	E	71.2	Confident	68.7	Low	164.667 Å²	164.667	90.1 Å²	90.1	77%	0.769	48%	0.478	S	S	*	.			trans	-74.5	139.1	169.7	-63.9	-166.5	150.4	0	0	111.1	K673 Q865	E630-K673 IonicContact OE1-NZ 2.68Å; E630-K673 PolarHBondContact OE1-NZ 2.82Å; E630-K673 VanDerWaalsContact OE1-NZ 3.09Å; E630-Q865 PolarHBondContact OE1-NE2 2.9Å
631	F	72.6	Confident	69.4	Low	80.3333 Å²	80.3333	85.8 Å²	85.8	35%	0.352	47%	0.467	S	S	.	.			trans	-136.9	149.2	175.2	60	-93	0	0	0	111.1	L625 L633 L646 N647 V671	L625-F631 HydrophobicContact CD1-CE1 4.34Å; L625-F631 HydrophobicContact CD1-CZ 4.4Å; L625-F631 HydrophobicContact CD2-CB 4.18Å; L625-F631 HydrophobicContact CD2-CD1 3.72Å; L625-F631 HydrophobicContact CD2-CD2 4.25Å; L625-F631 HydrophobicContact CD2-CE1 4.1Å; L625-F631 HydrophobicContact CD2-CE2 4.36Å; L625-F631 HydrophobicContact CD2-CG 3.79Å; L625-F631 HydrophobicContact CD2-CZ 4.35Å; F631-L633 HydrophobicContact CD2-CB 4.28Å; F631-L633 HydrophobicContact CE2-CB 4.27Å; F631-L646 HydrophobicContact CB-CD1 4.11Å; F631-L646 HydrophobicContact CD2-CD1 3.6Å; F631-L646 HydrophobicContact CE2-CD1 4.4Å; F631-L646 HydrophobicContact CG-CD1 4.17Å; F631-N647 WeakPolarHBondContact CA-OD1 3.38Å; F631-V671 HydrophobicContact CZ-CG2 4.25Å
632	L	74.3	Confident	70.2	Confident	77 Å²	77	84.9 Å²	84.9	40%	0.403	46%	0.463	S	S	.	.			trans	-103.3	104.2	177.2	178.9	63.2	0	0	0	110.3	N634 L646 N647	L632-N634 WeakPolarHBondContact CD1-OD1 3.19Å; L632-N634 WeakPolarHBondContact CD2-ND2 3.44Å; L632-L646 CarbonylContact O-C 3.51Å; L632-L646 WeakPolarHBondContact O-CA 3.41Å; L632-N647 PolarHBondContact N-OD1 3.22Å; L632-N647 PolarHBondContact O-N 3.22Å
633	L	80.7	Confident	71.6	Confident	68 Å²	68	76.6 Å²	76.6	36%	0.356	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	112.5	174.1	-172.8	66.8	0	0	0	110.4	W603 F631 M644 S645 L646 I651	W603-L633 HydrophobicContact CH2-CD1 4.42Å; W603-L633 HydrophobicContact CZ3-CD1 4.32Å; F631-L633 HydrophobicContact CD2-CB 4.28Å; F631-L633 HydrophobicContact CE2-CB 4.27Å; L633-M644 HydrophobicContact CD1-CE 3.83Å; L633-M644 HydrophobicContact CD2-CE 3.98Å; L633-M644 HydrophobicContact CG-CE 4.28Å; L633-S645 WeakPolarHBondContact CA-O 3.11Å; L633-L646 HydrophobicContact CB-CD1 4.29Å; L633-L646 HydrophobicContact CD1-CD1 3.94Å; L633-I651 HydrophobicContact CD1-CD1 4.12Å
634	N	80	Confident	72.9	Confident	60.6667 Å²	60.6667	74.7 Å²	74.7	32%	0.324	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	125	-179.6	-74.7	-33.4	0	0	0	110.4	L632 M644 S645	L632-N634 WeakPolarHBondContact CD1-OD1 3.19Å; L632-N634 WeakPolarHBondContact CD2-ND2 3.44Å; N634-M644 CarbonylContact O-C 3.49Å; N634-M644 WeakPolarHBondContact O-CA 3.27Å; N634-S645 WeakPolarHBondContact CB-OG 3.41Å; N634-S645 PolarHBondContact N-O 3.1Å; N634-S645 PolarHBondContact O-N 3.01Å; N634-S645 PolarHBondContact O-OG 2.98Å
635	T	82	Confident	74.1	Confident	70.3333 Å²	70.3333	71.8 Å²	71.8	43%	0.431	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	110.6	172	-53.7	0	0	0	0	110.1	V637 A642 Q643 M644	T635-V637 HydrophobicContact CG2-CG2 4.37Å; T635-A642 HydrophobicContact CG2-CB 4.09Å; T635-Q643 CarbonylContact C-O 3.56Å; T635-Q643 WeakPolarHBondContact CA-O 3.23Å; T635-M644 HydrophobicContact CG2-CG 4.08Å; T635-M644 WeakPolarHBondContact OG1-CG 3.29Å
636	T	78.7	Confident	74.9	Confident	80.3333 Å²	80.3333	69.1 Å²	69.1	49%	0.493	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	128.6	172.5	53.9	0	0	0	0	109.8	A642 Q643	T636-A642 CarbonylContact O-C 3.43Å; T636-A642 VanDerWaalsContact O-CA 3.29Å; T636-A642 WeakPolarHBondContact O-CA 3.31Å; T636-Q643 PolarHBondContact N-O 2.88Å; T636-Q643 PolarHBondContact O-N 3.27Å; T636-Q643 WeakPolarHBondContact OG1-CB 3.17Å; T636-Q643 PolarHBondContact OG1-O 2.94Å
637	V	78	Confident	75.6	Confident	57.6667 Å²	57.6667	70.7 Å²	70.7	35%	0.349	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	116.7	175	-178.7	0	0	0	0	109.1	T635 L641 A642 L657 V662	T635-V637 HydrophobicContact CG2-CG2 4.37Å; V637-L641 CarbonylContact C-O 3.41Å; V637-L641 VanDerWaalsContact CA-O 3.31Å; V637-L641 WeakPolarHBondContact CA-O 3.43Å; V637-A642 HydrophobicContact CG2-CB 4.2Å; V637-L657 HydrophobicContact CB-CD1 4.49Å; V637-L657 HydrophobicContact CG1-CD1 3.74Å; V637-L657 HydrophobicContact CG2-CD1 3.94Å; V637-V662 HydrophobicContact CG2-CG2 4.2Å
638	Q	71.3	Confident	76.2	Confident	130 Å²	130	67.3 Å²	67.3	61%	0.607	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131	123.8	179.5	-145.3	180	-12.1	0	0	109.7	G640 L641	Q638-G640 PolarHBondContact O-N 3Å; Q638-G640 VanDerWaalsContact O-N 3.12Å; Q638-L641 PolarHBondContact N-O 2.86Å; Q638-L641 WeakPolarHBondContact O-CB 3.38Å; Q638-L641 PolarHBondContact O-N 2.95Å
639	N	72.7	Confident	76.7	Confident	151.667 Å²	151.667	68.9 Å²	68.9	81%	0.811	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	27.3	179.6	-60.9	-13.6	0	0	0	115.3
640	G	74.3	Confident	77.5	Confident	14.3333 Å²	14.3333	70.4 Å²	70.4	15%	0.148	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.9	0.3	-176.5	0	0	0	0	0	115.1	Q638 L657	Q638-G640 PolarHBondContact O-N 3Å; Q638-G640 VanDerWaalsContact O-N 3.12Å; G640-L657 WeakPolarHBondContact O-CB 3.27Å; G640-L657 PolarHBondContact O-N 3.05Å
641	L	81.7	Confident	77.9	Confident	67 Å²	67	63 Å²	63	35%	0.351	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	124.1	170.3	-59.9	173.5	0	0	0	109.6	V637 Q638 Y655 K656	V637-L641 CarbonylContact C-O 3.41Å; V637-L641 VanDerWaalsContact CA-O 3.31Å; V637-L641 WeakPolarHBondContact CA-O 3.43Å; Q638-L641 PolarHBondContact N-O 2.86Å; Q638-L641 WeakPolarHBondContact O-CB 3.38Å; Q638-L641 PolarHBondContact O-N 2.95Å; L641-Y655 CarbonylContact C-O 3.54Å; L641-Y655 VanDerWaalsContact CA-O 3.31Å; L641-Y655 WeakPolarHBondContact CA-O 3.44Å; L641-K656 HydrophobicContact CD2-CB 4.11Å; L641-K656 HydrophobicContact CD2-CG 4.16Å
642	A	84.7	Confident	78.4	Confident	1.33333 Å²	1.33333	59.8 Å²	59.8	1%	0.011	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	140.2	171.6	0	0	0	0	0	110.7	F605 T635 T636 V637 Q654 Y655 L657	F605-A642 HydrophobicContact CE2-CB 4.13Å; F605-A642 HydrophobicContact CZ-CB 4.15Å; T635-A642 HydrophobicContact CG2-CB 4.09Å; T636-A642 CarbonylContact O-C 3.43Å; T636-A642 VanDerWaalsContact O-CA 3.29Å; T636-A642 WeakPolarHBondContact O-CA 3.31Å; V637-A642 HydrophobicContact CG2-CB 4.2Å; A642-Q654 CarbonylContact O-C 3.5Å; A642-Q654 WeakPolarHBondContact O-CA 3.28Å; A642-Y655 PolarHBondContact N-O 2.87Å; A642-Y655 PolarHBondContact O-N 2.86Å; A642-L657 HydrophobicContact CB-CD1 4.14Å; A642-L657 HydrophobicContact CB-CD2 4.04Å; A642-L657 HydrophobicContact CB-CG 3.95Å
643	Q	85.8	Confident	78.8	Confident	25 Å²	25	58.8 Å²	58.8	12%	0.117	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	119.9	174.1	172.1	94.7	69.6	0	0	108.2	T635 T636 K650 S652 Q654	T635-Q643 CarbonylContact C-O 3.56Å; T635-Q643 WeakPolarHBondContact CA-O 3.23Å; T636-Q643 PolarHBondContact N-O 2.88Å; T636-Q643 PolarHBondContact O-N 3.27Å; T636-Q643 WeakPolarHBondContact OG1-CB 3.17Å; T636-Q643 PolarHBondContact OG1-O 2.94Å; Q643-K650 HydrophobicContact CG-CD 4.34Å; Q643-K650 HydrophobicContact CG-CG 4.35Å; Q643-S652 PolarHBondContact NE2-O 3.24Å; Q643-S652 PolarHBondContact NE2-OG 3.05Å; Q643-S652 VanDerWaalsContact NE2-OG 3.16Å; Q643-Q654 HydrophobicContact CB-CG 4.3Å
644	M	85.3	Confident	78.8	Confident	25 Å²	25	61.8 Å²	61.8	12%	0.123	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	146	176.9	-72.7	166.8	73.6	0	0	111.1	W603 F605 F619 L633 N634 T635 I651 S652	W603-M644 HydrophobicContact CE3-CE 4.31Å; W603-M644 HydrophobicContact CZ3-CE 4.17Å; F605-M644 HydrophobicContact CD1-SD 4.1Å; F605-M644 HydrophobicContact CD2-CG 4.38Å; F605-M644 HydrophobicContact CD2-SD 3.61Å; F605-M644 HydrophobicContact CE1-CG 4.13Å; F605-M644 HydrophobicContact CE1-SD 3.32Å; F605-M644 WeakPolarHBondContact CE1-SD 3.45Å; F605-M644 HydrophobicContact CE2-CG 4.3Å; F605-M644 HydrophobicContact CE2-SD 3.95Å; F605-M644 HydrophobicContact CZ-CB 4.27Å; F605-M644 HydrophobicContact CZ-CG 3.64Å; F605-M644 HydrophobicContact CZ-SD 3.34Å; F605-M644 WeakPolarHBondContact CZ-SD 3.33Å; F619-M644 HydrophobicContact CZ-SD 4.45Å; L633-M644 HydrophobicContact CD1-CE 3.83Å; L633-M644 HydrophobicContact CD2-CE 3.98Å; L633-M644 HydrophobicContact CG-CE 4.28Å; N634-M644 CarbonylContact O-C 3.49Å; N634-M644 WeakPolarHBondContact O-CA 3.27Å; T635-M644 HydrophobicContact CG2-CG 4.08Å; T635-M644 WeakPolarHBondContact OG1-CG 3.29Å; M644-I651 HydrophobicContact CB-CD1 4.15Å; M644-I651 HydrophobicContact CB-CG1 3.79Å; M644-I651 HydrophobicContact CE-CD1 4.33Å; M644-I651 PolarHBondContact O-N 3.11Å; M644-I651 VanDerWaalsContact O-N 3.1Å; M644-S652 WeakPolarHBondContact CB-OG 3.16Å; M644-S652 PolarHBondContact N-OG 2.98Å; M644-S652 PolarHBondContact O-N 3.32Å; M644-S652 PolarHBondContact O-OG 2.8Å
645	S	81.4	Confident	79	Confident	14.6667 Å²	14.6667	59.3 Å²	59.3	10%	0.103	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	142.3	171	50.3	0	0	0	0	110.8	L633 N634 E649	L633-S645 WeakPolarHBondContact CA-O 3.11Å; N634-S645 WeakPolarHBondContact CB-OG 3.41Å; N634-S645 PolarHBondContact N-O 3.1Å; N634-S645 PolarHBondContact O-N 3.01Å; N634-S645 PolarHBondContact O-OG 2.98Å; S645-E649 CarbonylContact C-O 3.53Å; S645-E649 VanDerWaalsContact C-O 3.32Å; S645-E649 WeakPolarHBondContact CA-O 3.38Å; S645-E649 VanDerWaalsContact CB-C 3.49Å; S645-E649 WeakPolarHBondContact CB-O 3.36Å
646	L	79.5	Confident	79.1	Confident	0.666667 Å²	0.666667	63.2 Å²	63.2	0%	0.003	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	125.6	179.8	-170	75.9	0	0	0	108.2	W603 Y621 I623 L625 F631 L632 L633 G648 E649 I651	W603-L646 HydrophobicContact CH2-CD1 4.38Å; W603-L646 HydrophobicContact CH2-CD2 4.12Å; W603-L646 HydrophobicContact CZ2-CD2 3.96Å; Y621-L646 HydrophobicContact CD1-CD2 4.41Å; Y621-L646 HydrophobicContact CE1-CB 4.22Å; Y621-L646 HydrophobicContact CE1-CD2 3.88Å; I623-L646 HydrophobicContact CB-CD2 4.11Å; I623-L646 HydrophobicContact CG2-CD2 3.9Å; L625-L646 HydrophobicContact CD2-CD1 4.34Å; L625-L646 HydrophobicContact CD2-CD2 3.92Å; L625-L646 HydrophobicContact CG-CD2 4.32Å; F631-L646 HydrophobicContact CB-CD1 4.11Å; F631-L646 HydrophobicContact CD2-CD1 3.6Å; F631-L646 HydrophobicContact CE2-CD1 4.4Å; F631-L646 HydrophobicContact CG-CD1 4.17Å; L632-L646 CarbonylContact O-C 3.51Å; L632-L646 WeakPolarHBondContact O-CA 3.41Å; L633-L646 HydrophobicContact CB-CD1 4.29Å; L633-L646 HydrophobicContact CD1-CD1 3.94Å; L646-G648 PolarHBondContact O-N 2.97Å; L646-E649 PolarHBondContact N-O 2.95Å; L646-E649 PolarHBondContact O-N 2.93Å; L646-E649 VanDerWaalsContact O-N 3.12Å; L646-I651 HydrophobicContact CB-CD1 4.37Å; L646-I651 HydrophobicContact CB-CG2 3.52Å; L646-I651 VanDerWaalsContact CB-CG2 3.42Å
647	N	74.8	Confident	79.1	Confident	86.6667 Å²	86.6667	61.3 Å²	61.3	46%	0.463	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.3	21.4	-176.9	-58.7	-31.1	0	0	0	114.3	F631 L632	F631-N647 WeakPolarHBondContact CA-OD1 3.38Å; L632-N647 PolarHBondContact N-OD1 3.22Å; L632-N647 PolarHBondContact O-N 3.22Å
648	G	67.4	Low	79	Confident	46.6667 Å²	46.6667	62.9 Å²	62.9	48%	0.481	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	104.2	-21.9	-178.5	0	0	0	0	0	115	L646	L646-G648 PolarHBondContact O-N 2.97Å
649	E	72.3	Confident	79	Confident	111.333 Å²	111.333	58.4 Å²	58.4	52%	0.52	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	137.5	179.2	-175.6	179.8	174.8	0	0	111.3	Y621 S645 L646 I651	Y621-E649 HydrophobicContact CE2-CG 4.3Å; Y621-E649 WeakPolarHBondContact OH-CB 3.19Å; Y621-E649 VanDerWaalsContact OH-CD 3.27Å; Y621-E649 VanDerWaalsContact OH-CG 3.27Å; Y621-E649 WeakPolarHBondContact OH-CG 3.41Å; Y621-E649 PolarHBondContact OH-OE1 3.22Å; Y621-E649 PolarHBondContact OH-OE2 2.87Å; Y621-E649 VanDerWaalsContact OH-OE2 3.1Å; S645-E649 CarbonylContact C-O 3.53Å; S645-E649 VanDerWaalsContact C-O 3.32Å; S645-E649 WeakPolarHBondContact CA-O 3.38Å; S645-E649 VanDerWaalsContact CB-C 3.49Å; S645-E649 WeakPolarHBondContact CB-O 3.36Å; L646-E649 PolarHBondContact N-O 2.95Å; L646-E649 PolarHBondContact O-N 2.93Å; L646-E649 VanDerWaalsContact O-N 3.12Å; E649-I651 WeakPolarHBondContact O-CG2 3.44Å; E649-I651 PolarHBondContact O-N 3.23Å
650	K	79.7	Confident	78.6	Confident	144.333 Å²	144.333	59.5 Å²	59.5	63%	0.628	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75	120.4	-179.3	-68.9	178.5	-178.2	179.1	0	110.5	Q643	Q643-K650 HydrophobicContact CG-CD 4.34Å; Q643-K650 HydrophobicContact CG-CG 4.35Å
651	I	79.5	Confident	78.1	Confident	10.6667 Å²	10.6667	64.6 Å²	64.6	6%	0.055	34%	0.341	C	S	.	.			trans	-100.7	-27.2	-174.2	72	172	0	0	0	113.8	W603 F619 Y621 L633 M644 L646 E649	W603-I651 HydrophobicContact CD2-CD1 4.09Å; W603-I651 HydrophobicContact CE3-CD1 3.71Å; W603-I651 HydrophobicContact CH2-CD1 3.93Å; W603-I651 HydrophobicContact CZ2-CD1 4.29Å; W603-I651 HydrophobicContact CZ3-CD1 3.63Å; F619-I651 WeakPolarHBondContact CD2-O 3.39Å; F619-I651 HydrophobicContact CE2-CB 4.31Å; F619-I651 HydrophobicContact CE2-CD1 4.12Å; F619-I651 HydrophobicContact CE2-CG1 3.87Å; F619-I651 WeakPolarHBondContact CE2-O 3.38Å; F619-I651 HydrophobicContact CZ-CD1 4.37Å; F619-I651 HydrophobicContact CZ-CG1 4.24Å; Y621-I651 HydrophobicContact CD1-CB 4.03Å; Y621-I651 HydrophobicContact CD1-CG2 3.63Å; Y621-I651 VanDerWaalsContact CD1-CG2 3.47Å; Y621-I651 HydrophobicContact CD2-CB 3.87Å; Y621-I651 HydrophobicContact CD2-CG2 3.82Å; Y621-I651 HydrophobicContact CE1-CB 4.27Å; Y621-I651 HydrophobicContact CE1-CG2 3.39Å; Y621-I651 HydrophobicContact CE2-CB 4.15Å; Y621-I651 HydrophobicContact CE2-CG2 3.62Å; Y621-I651 HydrophobicContact CG-CB 3.79Å; Y621-I651 HydrophobicContact CG-CG2 3.82Å; Y621-I651 VanDerWaalsContact CZ-CG2 3.42Å; L633-I651 HydrophobicContact CD1-CD1 4.12Å; M644-I651 HydrophobicContact CB-CD1 4.15Å; M644-I651 HydrophobicContact CB-CG1 3.79Å; M644-I651 HydrophobicContact CE-CD1 4.33Å; M644-I651 PolarHBondContact O-N 3.11Å; M644-I651 VanDerWaalsContact O-N 3.1Å; L646-I651 HydrophobicContact CB-CD1 4.37Å; L646-I651 HydrophobicContact CB-CG2 3.52Å; L646-I651 VanDerWaalsContact CB-CG2 3.42Å; E649-I651 WeakPolarHBondContact O-CG2 3.44Å; E649-I651 PolarHBondContact O-N 3.23Å
652	S	82.2	Confident	77.4	Confident	11.6667 Å²	11.6667	63.7 Å²	63.7	8%	0.082	34%	0.339	C	S	.	.	S	Bend	trans	-112.2	160.4	-170.9	72	0	0	0	0	112.5	F605 F619 Q643 M644	F605-S652 VanDerWaalsContact CE2-CB 3.44Å; F605-S652 WeakPolarHBondContact CE2-OG 3.25Å; F619-S652 VanDerWaalsContact CZ-CB 3.47Å; Q643-S652 PolarHBondContact NE2-O 3.24Å; Q643-S652 PolarHBondContact NE2-OG 3.05Å; Q643-S652 VanDerWaalsContact NE2-OG 3.16Å; M644-S652 WeakPolarHBondContact CB-OG 3.16Å; M644-S652 PolarHBondContact N-OG 2.98Å; M644-S652 PolarHBondContact O-N 3.32Å; M644-S652 PolarHBondContact O-OG 2.8Å
653	P	82.3	Confident	76.3	Confident	56.3333 Å²	56.3333	72.1 Å²	72.1	37%	0.366	38%	0.375	S	S	.	.			trans	-64.4	168.5	156.1	29.9	-34.9	0	0	0	111.1	V617 F619 Y655	V617-P653 HydrophobicContact CG1-CG 3.69Å; V617-P653 VanDerWaalsContact CG1-CG 3.46Å; F619-P653 HydrophobicContact CD1-CG 4.46Å; P653-Y655 PolarHBondContact O-N 2.96Å
654	Q	82.2	Confident	75.2	Confident	131.667 Å²	131.667	77.4 Å²	77.4	62%	0.615	40%	0.404	S	S	*	.			trans	-72	127.5	168	-70.5	-173.7	-5.1	0	0	110.2	A642 Q643	A642-Q654 CarbonylContact O-C 3.5Å; A642-Q654 WeakPolarHBondContact O-CA 3.28Å; Q643-Q654 HydrophobicContact CB-CG 4.3Å
655	Y	84	Confident	74.3	Confident	8 Å²	8	79.3 Å²	79.3	3%	0.031	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	125.5	-170.9	-178.2	-96.4	0	0	0	112.1	F605 S606 S607 N615 V617 L641 A642 P653 L657	F605-Y655 HydrophobicContact CB-CD1 4.3Å; F605-Y655 HydrophobicContact CB-CD2 3.64Å; F605-Y655 HydrophobicContact CB-CE1 4.3Å; F605-Y655 HydrophobicContact CB-CE2 3.84Å; F605-Y655 HydrophobicContact CB-CG 4.01Å; F605-Y655 AromaticContact CD1-CD1 3.62Å; F605-Y655 HydrophobicContact CD1-CD1 3.76Å; F605-Y655 AromaticContact CD1-CD2 3.55Å; F605-Y655 HydrophobicContact CD1-CD2 3.55Å; F605-Y655 AromaticContact CD1-CE1 3.35Å; F605-Y655 HydrophobicContact CD1-CE1 3.85Å; F605-Y655 AromaticContact CD1-CE2 3.51Å; F605-Y655 HydrophobicContact CD1-CE2 3.51Å; F605-Y655 AromaticContact CD1-CG 3.45Å; F605-Y655 HydrophobicContact CD1-CG 3.85Å; F605-Y655 VanDerWaalsContact CD1-CG 3.45Å; F605-Y655 AromaticContact CD1-CZ 3.4Å; F605-Y655 VanDerWaalsContact CD2-CB 3.42Å; F605-Y655 HydrophobicContact CD2-CD1 4.38Å; F605-Y655 AromaticContact CD2-CD2 3.93Å; F605-Y655 HydrophobicContact CD2-CD2 4.17Å; F605-Y655 AromaticContact CD2-CG 3.67Å; F605-Y655 HydrophobicContact CD2-CG 3.84Å; F605-Y655 AromaticContact CE1-CD1 3.22Å; F605-Y655 HydrophobicContact CE1-CD1 3.92Å; F605-Y655 HydrophobicContact CE1-CD2 4.28Å; F605-Y655 AromaticContact CE1-CE1 3.33Å; F605-Y655 HydrophobicContact CE1-CE1 3.33Å; F605-Y655 HydrophobicContact CE1-CE2 4.35Å; F605-Y655 AromaticContact CE1-CG 3.72Å; F605-Y655 HydrophobicContact CE1-CG 4.21Å; F605-Y655 AromaticContact CE1-CZ 3.9Å; F605-Y655 VanDerWaalsContact CE2-CB 3.46Å; F605-Y655 HydrophobicContact CE2-CD1 4.48Å; F605-Y655 AromaticContact CE2-CG 4Å; F605-Y655 HydrophobicContact CE2-CG 4.18Å; F605-Y655 AromaticContact CG-CD1 3.95Å; F605-Y655 HydrophobicContact CG-CD1 4.05Å; F605-Y655 AromaticContact CG-CD2 3.82Å; F605-Y655 HydrophobicContact CG-CD2 3.82Å; F605-Y655 HydrophobicContact CG-CE1 4.44Å; F605-Y655 AromaticContact CG-CE2 3.97Å; F605-Y655 HydrophobicContact CG-CE2 4.2Å; F605-Y655 AromaticContact CG-CG 3.67Å; F605-Y655 HydrophobicContact CG-CG 3.67Å; F605-Y655 AromaticContact CZ-CD1 3.83Å; F605-Y655 HydrophobicContact CZ-CD1 3.83Å; F605-Y655 HydrophobicContact CZ-CE1 4.35Å; F605-Y655 HydrophobicContact CZ-CG 4.28Å; S606-Y655 VanDerWaalsContact CA-OH 3.3Å; S606-Y655 WeakPolarHBondContact CA-OH 3.39Å; S606-Y655 PolarHBondContact O-OH 3.02Å; S607-Y655 VanDerWaalsContact CB-OH 3.28Å; S607-Y655 WeakPolarHBondContact CB-OH 3.28Å; S607-Y655 PolarHBondContact N-OH 3.06Å; S607-Y655 VanDerWaalsContact N-OH 3.07Å; S607-Y655 WeakPolarHBondContact OG-CE1 3.18Å; S607-Y655 PolarHBondContact OG-OH 2.99Å; N615-Y655 HydrophobicContact CB-CE2 4.22Å; N615-Y655 WeakPolarHBondContact CB-OH 3.27Å; N615-Y655 VanDerWaalsContact O-CE2 3.25Å; N615-Y655 WeakPolarHBondContact O-CE2 3.39Å; N615-Y655 PolarHBondContact O-OH 3.19Å; N615-Y655 VanDerWaalsContact O-OH 3.07Å; V617-Y655 HydrophobicContact CB-CD2 4.22Å; V617-Y655 HydrophobicContact CB-CE2 4.32Å; V617-Y655 HydrophobicContact CG2-CD2 3.96Å; V617-Y655 HydrophobicContact CG2-CE2 3.91Å; L641-Y655 CarbonylContact C-O 3.54Å; L641-Y655 VanDerWaalsContact CA-O 3.31Å; L641-Y655 WeakPolarHBondContact CA-O 3.44Å; A642-Y655 PolarHBondContact N-O 2.87Å; A642-Y655 PolarHBondContact O-N 2.86Å; P653-Y655 PolarHBondContact O-N 2.96Å; Y655-L657 HydrophobicContact CD1-CD2 4.09Å; Y655-L657 HydrophobicContact CD1-CG 4.49Å; Y655-L657 HydrophobicContact CE1-CD2 4.24Å; Y655-L657 PolarHBondContact O-N 3.1Å
656	K	83.2	Confident	73.5	Confident	152 Å²	152	84.2 Å²	84.2	66%	0.661	45%	0.446	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.5	109.8	-178	-170.3	-179.7	178.2	-172.6	0	111.2	L641	L641-K656 HydrophobicContact CD2-CB 4.11Å; L641-K656 HydrophobicContact CD2-CG 4.16Å
657	L	79.3	Confident	73.2	Confident	39.6667 Å²	39.6667	87.4 Å²	87.4	21%	0.208	47%	0.466	C	S	.	.			trans	-70.5	147.6	174	-64.1	178.4	0	0	0	111.1	F605 V637 G640 A642 Y655 G659 V662	F605-L657 HydrophobicContact CE1-CD2 3.98Å; F605-L657 HydrophobicContact CZ-CD2 4.1Å; V637-L657 HydrophobicContact CB-CD1 4.49Å; V637-L657 HydrophobicContact CG1-CD1 3.74Å; V637-L657 HydrophobicContact CG2-CD1 3.94Å; G640-L657 WeakPolarHBondContact O-CB 3.27Å; G640-L657 PolarHBondContact O-N 3.05Å; A642-L657 HydrophobicContact CB-CD1 4.14Å; A642-L657 HydrophobicContact CB-CD2 4.04Å; A642-L657 HydrophobicContact CB-CG 3.95Å; Y655-L657 HydrophobicContact CD1-CD2 4.09Å; Y655-L657 HydrophobicContact CD1-CG 4.49Å; Y655-L657 HydrophobicContact CE1-CD2 4.24Å; Y655-L657 PolarHBondContact O-N 3.1Å; L657-G659 WeakPolarHBondContact CB-O 3.44Å; L657-G659 PolarHBondContact O-N 3.07Å; L657-G659 VanDerWaalsContact O-N 3.13Å; L657-V662 HydrophobicContact CD1-CG2 4.17Å
658	P	75.8	Confident	72.8	Confident	91.3333 Å²	91.3333	89.3 Å²	89.3	59%	0.593	48%	0.481	S	S	*	.	S	Bend	trans	-72.8	-2.9	175.4	30.2	-35.2	0	0	0	113.6	S607 I609	S607-P658 WeakPolarHBondContact OG-CD 3.34Å; I609-P658 HydrophobicContact CD1-CB 3.86Å; I609-P658 HydrophobicContact CD1-CG 4.37Å; I609-P658 HydrophobicContact CG1-CB 4.27Å; I609-P658 HydrophobicContact CG1-CG 4.42Å
659	G	70.4	Confident	73	Confident	37 Å²	37	90 Å²	90	38%	0.381	49%	0.488	S	S	.	.	S	Bend	trans	-151	155.7	179.9	0	0	0	0	0	113	L657 I661	L657-G659 WeakPolarHBondContact CB-O 3.44Å; L657-G659 PolarHBondContact O-N 3.07Å; L657-G659 VanDerWaalsContact O-N 3.13Å; G659-I661 VanDerWaalsContact C-N 3.33Å; G659-I661 PolarHBondContact O-N 2.99Å
660	K	65.9	Low	73	Confident	175 Å²	175	91.9 Å²	91.9	76%	0.761	50%	0.502	S	S	*	.	S	Bend	trans	-79.8	-13.2	-176.8	-63.4	178.7	-178.5	175.4	0	114.4
661	I	63.1	Low	72.4	Confident	120.333 Å²	120.333	87.5 Å²	87.5	62%	0.617	49%	0.487	S	S	*	.			trans	-135.1	123.2	-173.3	-58.2	176.2	0	0	0	109.7	G659 K663	G659-I661 VanDerWaalsContact C-N 3.33Å; G659-I661 PolarHBondContact O-N 2.99Å; I661-K663 PolarHBondContact O-N 2.84Å
662	V	65.8	Low	71.8	Confident	48 Å²	48	94 Å²	94	29%	0.291	52%	0.515	S	S	.	.			trans	-82.1	112.7	171.1	180	0	0	0	0	108.8	V637 L657 N664 V665 H680	V637-V662 HydrophobicContact CG2-CG2 4.2Å; L657-V662 HydrophobicContact CD1-CG2 4.17Å; V662-N664 VanDerWaalsContact CG1-O 3.29Å; V662-N664 WeakPolarHBondContact CG1-O 3.43Å; V662-V665 HydrophobicContact CG1-CG2 3.65Å; V662-H680 PolarHBondContact O-CE1 3.36Å; V662-H680 PolarHBondContact O-NE2 3.12Å
663	K	62.1	Low	70.8	Confident	178.667 Å²	178.667	98.9 Å²	98.9	78%	0.777	54%	0.535	S	S	*	.			trans	-82.2	-38.1	-178.2	-68.2	178.6	-179.3	172.2	0	113	E492 I661	E492-K663 IonicContact OE2-NZ 2.61Å; E492-K663 PolarHBondContact OE2-NZ 2.93Å; I661-K663 PolarHBondContact O-N 2.84Å
664	N	62.2	Low	69.9	Low	135.333 Å²	135.333	98.5 Å²	98.5	72%	0.724	53%	0.533	S	S	*	.			trans	-138.8	153.4	179.5	-96	-4.2	0	0	0	109.4	V662	V662-N664 VanDerWaalsContact CG1-O 3.29Å; V662-N664 WeakPolarHBondContact CG1-O 3.43Å
665	V	68.3	Low	68.8	Low	66.3333 Å²	66.3333	96.3 Å²	96.3	40%	0.402	53%	0.528	S	S	.	.			trans	-129.8	130.2	168.6	176.6	0	0	0	0	107.8	V662 V676 V678	V662-V665 HydrophobicContact CG1-CG2 3.65Å; V665-V676 HydrophobicContact CB-CG1 3.88Å; V665-V676 HydrophobicContact CG1-CG1 3.67Å; V665-V678 HydrophobicContact CB-CG2 4.19Å; V665-V678 HydrophobicContact CG2-CG1 4.17Å; V665-V678 HydrophobicContact CG2-CG2 3.78Å
666	T	63.8	Low	67.6	Low	116.333 Å²	116.333	98.5 Å²	98.5	71%	0.714	54%	0.542	S	S	*	.			trans	-122.9	142.3	178.6	15.9	0	0	0	0	109.4	T668	T666-T668 HydrophobicContact CG2-CG2 4.24Å
667	V	72.5	Confident	66.1	Low	68 Å²	68	95.4 Å²	95.4	41%	0.412	53%	0.533	S	S	.	.			trans	-122.9	129.8	175.7	-179.2	0	0	0	0	107.3	V671 C674 V676	V667-V671 HydrophobicContact CG1-CB 4.29Å; V667-V671 HydrophobicContact CG1-CG2 4.31Å; V667-C674 HydrophobicContact CG1-CB 4.43Å; V667-V676 HydrophobicContact CG2-CG2 3.96Å
668	T	66.1	Low	65	Low	127.333 Å²	127.333	96.1 Å²	96.1	78%	0.781	54%	0.538	S	S	*	.			trans	-143.8	158.7	-175.9	51.1	0	0	0	0	109.9	T666	T666-T668 HydrophobicContact CG2-CG2 4.24Å
669	G	71.8	Confident	63.8	Low	61 Å²	61	95.4 Å²	95.4	63%	0.629	53%	0.532	S	S	*	.	S	Bend	trans	110.5	-165.9	-171.8	0	0	0	0	0	111.4	V671	G669-V671 PolarHBondContact O-N 2.99Å
670	D	72.4	Confident	62.9	Low	150.667 Å²	150.667	98.2 Å²	98.2	81%	0.806	54%	0.535	S	S	*	.	S	Bend	trans	-75.9	48.4	-172.9	-58.7	-51.4	0	0	0	114
671	V	68.1	Low	61.7	Low	52.6667 Å²	52.6667	95.2 Å²	95.2	32%	0.319	53%	0.525	S	S	.	.			trans	-109.9	115.5	-179.4	-166.4	0	0	0	0	109.6	F631 V667 G669 K673 C674 Q867	F631-V671 HydrophobicContact CZ-CG2 4.25Å; V667-V671 HydrophobicContact CG1-CB 4.29Å; V667-V671 HydrophobicContact CG1-CG2 4.31Å; G669-V671 PolarHBondContact O-N 2.99Å; V671-K673 WeakPolarHBondContact CG1-O 3.46Å; V671-K673 PolarHBondContact O-N 2.88Å; V671-C674 HydrophobicContact CG1-CB 4.09Å; V671-Q867 HydrophobicContact CB-CG 4.43Å; V671-Q867 HydrophobicContact CG1-CB 4.31Å; V671-Q867 VanDerWaalsContact CG1-CD 3.47Å; V671-Q867 HydrophobicContact CG1-CG 3.58Å
672	K	65.3	Low	60.4	Low	146.667 Å²	146.667	96.3 Å²	96.3	64%	0.638	53%	0.526	S	S	*	.	S	Bend	trans	-67.2	-48.3	-168.8	-97.5	-178.9	169.5	-174.1	0	117.3	I851 Q852 G853 Q854 Q867 E868 E869	K672-I851 VanDerWaalsContact O-CG2 3.31Å; K672-I851 WeakPolarHBondContact O-CG2 3.41Å; K672-Q852 CarbonylContact O-C 3.54Å; K672-G853 WeakPolarHBondContact CD-O 3.34Å; K672-G853 PolarHBondContact NZ-O 3.31Å; K672-Q854 PolarHBondContact NZ-O 2.73Å; K672-Q867 VanDerWaalsContact C-OE1 3.23Å; K672-Q867 HydrophobicContact CB-CB 3.86Å; K672-E868 VanDerWaalsContact CB-N 3.33Å; K672-E868 WeakPolarHBondContact CB-O 3.25Å; K672-E869 HydrophobicContact CB-CB 4.48Å; K672-E869 PolarHBondContact NZ-O 3.11Å
673	K	61.7	Low	58.8	Low	115.333 Å²	115.333	103.8 Å²	103.8	50%	0.501	55%	0.549	S	S	.	.			trans	176.6	163.4	-171.4	-178.3	-157.8	169.3	-152.7	0	110.1	E630 V671 I851 P866 Q867 E868	E630-K673 IonicContact OE1-NZ 2.68Å; E630-K673 PolarHBondContact OE1-NZ 2.82Å; E630-K673 VanDerWaalsContact OE1-NZ 3.09Å; V671-K673 WeakPolarHBondContact CG1-O 3.46Å; V671-K673 PolarHBondContact O-N 2.88Å; K673-I851 WeakPolarHBondContact CD-O 3.44Å; K673-I851 WeakPolarHBondContact CE-O 3.49Å; K673-I851 WeakPolarHBondContact CG-O 3.49Å; K673-P866 VanDerWaalsContact C-C 3.43Å; K673-P866 CarbonylContact C-O 3.54Å; K673-P866 VanDerWaalsContact CA-O 3.23Å; K673-P866 WeakPolarHBondContact CA-O 3.43Å; K673-P866 WeakPolarHBondContact CD-O 3.46Å; K673-P866 WeakPolarHBondContact CE-O 3.37Å; K673-P866 HydrophobicContact CG-CB 4.37Å; K673-P866 WeakPolarHBondContact CG-O 3.46Å; K673-P866 PolarHBondContact NZ-O 3.38Å; K673-P866 VanDerWaalsContact O-CB 3.31Å; K673-P866 WeakPolarHBondContact O-CB 3.19Å; K673-Q867 WeakPolarHBondContact CD-O 3.25Å; K673-Q867 PolarHBondContact NZ-O 2.74Å; K673-E868 HydrophobicContact CB-CB 4.24Å; K673-E868 HydrophobicContact CD-CB 3.36Å; K673-E868 HydrophobicContact CG-CB 4.35Å
674	C	63.3	Low	57.2	Low	48 Å²	48	100.7 Å²	100.7	32%	0.324	54%	0.54	S	S	.	.			trans	-160.4	171.5	174.6	104.2	0	0	0	0	117.9	V667 V671 P866 Q867	V667-C674 HydrophobicContact CG1-CB 4.43Å; V671-C674 HydrophobicContact CG1-CB 4.09Å; C674-P866 HydrophobicContact CB-CB 3.43Å; C674-P866 VanDerWaalsContact CB-CB 3.43Å; C674-P866 HydrophobicContact CB-CG 2.69Å; C674-P866 PolarHBondContact N-O 3.13Å; C674-P866 WeakPolarHBondContact O-CA 3.48Å; C674-P866 WeakPolarHBondContact O-CB 3.33Å; C674-P866 VanDerWaalsContact O-CG 3.25Å; C674-P866 WeakPolarHBondContact O-CG 3.43Å; C674-P866 VanDerWaalsContact O-N 3.09Å; C674-P866 WeakPolarHBondContact SG-CD 3.46Å; C674-P866 WeakPolarHBondContact SG-CG 3.23Å; C674-Q867 VanDerWaalsContact N-CD 3.33Å
675	T	59.3	Low	55.6	Low	84 Å²	84	100 Å²	100	52%	0.515	54%	0.535	S	S	.	.			trans	-128.2	138.4	149.1	-64.3	0	0	0	0	109.1	K863 Q864 Q865 P866	T675-K863 CarbonylContact C-O 3.55Å; T675-Q864 CarbonylContact O-C 3.56Å; T675-Q864 WeakPolarHBondContact O-CA 3.33Å; T675-Q864 VanDerWaalsContact O-CB 3.28Å; T675-Q864 WeakPolarHBondContact O-CB 3.22Å; T675-Q865 CarbonylContact O-C 3.56Å; T675-Q865 WeakPolarHBondContact O-CA 3.23Å; T675-Q865 PolarHBondContact O-N 2.83Å; T675-P866 VanDerWaalsContact N-N 3.14Å; T675-P866 WeakPolarHBondContact O-CD 3.02Å
676	V	58.2	Low	53.6	Low	54.3333 Å²	54.3333	105.4 Å²	105.4	33%	0.329	55%	0.553	S	S	.	*			trans	-113.3	120.3	-167.7	-176.1	0	0	0	0	112.1	V665 V667 V678 K863	V665-V676 HydrophobicContact CB-CG1 3.88Å; V665-V676 HydrophobicContact CG1-CG1 3.67Å; V667-V676 HydrophobicContact CG2-CG2 3.96Å; V676-V678 HydrophobicContact CG1-CG2 4.12Å; V676-K863 CarbonylContact C-O 3.54Å; V676-K863 WeakPolarHBondContact CA-O 3.25Å; V676-K863 PolarHBondContact N-O 2.93Å
677	N	52.7	Low	52	Low	87.3333 Å²	87.3333	104 Å²	104	47%	0.467	54%	0.54	S	S	.	.			trans	-95.4	101.1	179.5	-73	-49.8	0	0	0	112.7	A862 K863 Q864	N677-A862 CarbonylContact C-O 3.53Å; N677-A862 WeakPolarHBondContact CA-O 3.47Å; N677-A862 WeakPolarHBondContact CB-O 3.33Å; N677-A862 PolarHBondContact OD1-O 2.76Å; N677-K863 VanDerWaalsContact OD1-C 3.23Å; N677-K863 WeakPolarHBondContact OD1-CA 3.49Å; N677-K863 PolarHBondContact OD1-N 3.38Å; N677-Q864 VanDerWaalsContact CG-O 3.26Å; N677-Q864 PolarHBondContact ND2-O 2.89Å; N677-Q864 VanDerWaalsContact ND2-O 3.13Å; N677-Q864 PolarHBondContact OD1-N 2.84Å; N677-Q864 PolarHBondContact OD1-O 3.31Å
678	V	56.3	Low	49.9	Very low	53.6667 Å²	53.6667	108.9 Å²	108.9	33%	0.325	56%	0.558	S	S	.	*			trans	-105.8	119.5	178.4	-168.7	0	0	0	0	111.6	V665 V676 H680 R725 D861 A862	V665-V678 HydrophobicContact CB-CG2 4.19Å; V665-V678 HydrophobicContact CG2-CG1 4.17Å; V665-V678 HydrophobicContact CG2-CG2 3.78Å; V676-V678 HydrophobicContact CG1-CG2 4.12Å; V678-H680 VanDerWaalsContact CG1-CE1 3.41Å; V678-H680 WeakPolarHBondContact CG1-CE1 3.23Å; V678-R725 VanDerWaalsContact O-CZ 3.25Å; V678-R725 PolarHBondContact O-NH1 3.23Å; V678-R725 PolarHBondContact O-NH2 2.89Å; V678-D861 VanDerWaalsContact O-CB 3.26Å; V678-D861 WeakPolarHBondContact O-CB 3.31Å; V678-A862 PolarHBondContact N-O 3.5Å; V678-A862 WeakPolarHBondContact O-CB 3.17Å
679	V	50.1	Low	48.2	Very low	76.6667 Å²	76.6667	110 Å²	110	47%	0.465	56%	0.555	S	S	.	*			trans	-118.6	94.3	-166.2	-174.4	0	0	0	0	113	M681 D860 D861	V679-M681 PolarHBondContact O-N 3.13Å; V679-D860 WeakPolarHBondContact CG1-O 3.15Å; V679-D861 VanDerWaalsContact CG1-N 3.29Å
680	H	51.9	Low	46.2	Very low	95.6667 Å²	95.6667	115.3 Å²	115.3	44%	0.443	56%	0.557	S	S	.	*			trans	-101	108.4	173.1	-48.5	61.4	0	0	0	111.7	V662 V678 K682 D860	V662-H680 PolarHBondContact O-CE1 3.36Å; V662-H680 PolarHBondContact O-NE2 3.12Å; V678-H680 VanDerWaalsContact CG1-CE1 3.41Å; V678-H680 WeakPolarHBondContact CG1-CE1 3.23Å; H680-K682 VanDerWaalsContact C-N 3.34Å; H680-K682 PolarHBondContact O-N 3.08Å; H680-D860 VanDerWaalsContact N-N 3.16Å
681	M	39.9	Very low	44.3	Very low	112 Å²	112	113.7 Å²	113.7	55%	0.552	55%	0.549	S	S	*	.			trans	-37.5	118.1	163.1	-80.2	-161.5	-150.2	0	0	116.1	V679 A839 D858 T859 D860	V679-M681 PolarHBondContact O-N 3.13Å; M681-A839 HydrophobicContact CE-CB 3.79Å; M681-A839 HydrophobicContact SD-CB 4.4Å; M681-D858 CarbonylContact O-C 3.58Å; M681-D858 WeakPolarHBondContact O-CA 3.41Å; M681-T859 VanDerWaalsContact CA-C 3.46Å; M681-T859 WeakPolarHBondContact CB-O 3.24Å; M681-T859 PolarHBondContact O-N 2.98Å; M681-D860 VanDerWaalsContact CA-OD2 3.26Å; M681-D860 WeakPolarHBondContact CA-OD2 3.47Å; M681-D860 VanDerWaalsContact CB-CA 3.48Å; M681-D860 HydrophobicContact CB-CB 3.51Å; M681-D860 WeakPolarHBondContact CB-OD1 3.43Å; M681-D860 WeakPolarHBondContact CB-OD2 3.24Å; M681-D860 HydrophobicContact CG-CB 4.35Å; M681-D860 WeakPolarHBondContact CG-OD1 3.37Å; M681-D860 VanDerWaalsContact CG-OD2 3.28Å; M681-D860 WeakPolarHBondContact CG-OD2 3.45Å; M681-D860 PolarHBondContact N-OD2 2.76Å
682	K	37.2	Very low	42.6	Very low	145 Å²	145	115.5 Å²	115.5	63%	0.63	56%	0.562	S	S	*	*			trans	-96	96.4	171	-70.6	-174.9	173.1	-178.5	0	111.9	H680 I684 E856 D858	H680-K682 VanDerWaalsContact C-N 3.34Å; H680-K682 PolarHBondContact O-N 3.08Å; K682-I684 HydrophobicContact CB-CD1 4.35Å; K682-I684 HydrophobicContact CB-CG1 4.27Å; K682-I684 PolarHBondContact O-N 3.47Å; K682-E856 WeakPolarHBondContact CD-O 3.25Å; K682-E856 WeakPolarHBondContact CE-O 3.31Å; K682-E856 PolarHBondContact NZ-O 3.08Å; K682-D858 WeakPolarHBondContact CE-OD1 3.46Å; K682-D858 VanDerWaalsContact CG-OD1 3.32Å; K682-D858 WeakPolarHBondContact CG-OD1 3.39Å; K682-D858 IonicContact NZ-OD1 3.85Å
683	R	31	Very low	41.1	Very low	204 Å²	204	116.7 Å²	116.7	77%	0.77	57%	0.569	S	S	*	*			trans	-172.7	111.3	177.7	-85.1	169	179.7	-168.3	-2.1	113.8
684	I	28.4	Very low	39.8	Very low	114 Å²	114	116.5 Å²	116.5	59%	0.585	58%	0.578	S	S	*	*			trans	-122	123.1	167.8	-59	174	0	0	0	107.1	K682 K686	K682-I684 HydrophobicContact CB-CD1 4.35Å; K682-I684 HydrophobicContact CB-CG1 4.27Å; K682-I684 PolarHBondContact O-N 3.47Å; I684-K686 HydrophobicContact CG2-CG 4.45Å
685	I	29.2	Very low	38.3	Very low	122 Å²	122	119.9 Å²	119.9	63%	0.626	60%	0.597	S	S	*	*			trans	-77.6	117.7	161.8	-57.3	174.9	0	0	0	109.4	W708	I685-W708 HydrophobicContact CD1-CH2 4.29Å; I685-W708 HydrophobicContact CD1-CZ2 4.17Å
686	K	27	Very low	36.9	Very low	178.667 Å²	178.667	124.4 Å²	124.4	78%	0.777	61%	0.612	S	S	*	*			trans	-62.9	130.5	166.3	-72.4	-175.4	173.7	-140.3	0	110.6	I684	I684-K686 HydrophobicContact CG2-CG 4.45Å
687	L	28.7	Very low	35.6	Very low	87 Å²	87	130.4 Å²	130.4	46%	0.455	64%	0.637	S	S	.	*			trans	-114.8	166.1	138.8	-73.3	144.6	0	0	0	108.6	Q706	L687-Q706 VanDerWaalsContact CD2-OE1 3.31Å
688	H	29.9	Very low	34.5	Very low	170.333 Å²	170.333	131.6 Å²	131.6	79%	0.789	65%	0.649	S	S	*	*			trans	-75	156.3	-178.6	-93.1	-30.1	0	0	0	111.8
689	E	29.9	Very low	33.1	Very low	152 Å²	152	132.6 Å²	132.6	71%	0.71	66%	0.663	S	S	*	*			trans	-99.9	143.5	157.4	-149.9	160.6	-163.9	0	0	109.6
690	Y	30.5	Very low	32.1	Very low	170.667 Å²	170.667	133.6 Å²	133.6	67%	0.669	67%	0.669	S	S	*	*			trans	-111.5	135.9	-174.7	171	-96.7	0	0	0	108.9	P692	Y690-P692 HydrophobicContact CD1-CB 4.41Å; Y690-P692 HydrophobicContact CD1-CG 4.35Å; Y690-P692 HydrophobicContact CE1-CB 3.61Å; Y690-P692 HydrophobicContact CE1-CG 3.89Å
691	D	32.1	Very low	31.1	Very low	118 Å²	118	133.8 Å²	133.8	63%	0.631	68%	0.677	S	S	*	*			trans	-106.9	117.3	-175.2	-161.6	-1.7	0	0	0	110.3	E693	D691-E693 VanDerWaalsContact C-N 3.29Å; D691-E693 PolarHBondContact O-N 3.1Å; D691-E693 PolarHBondContact OD1-N 3.2Å
692	P	31.5	Very low	30.6	Very low	91 Å²	91	132.4 Å²	132.4	59%	0.591	68%	0.677	S	S	*	*			trans	-96.7	39.2	-168.7	36	-34.3	0	0	0	116.5	Y690	Y690-P692 HydrophobicContact CD1-CB 4.41Å; Y690-P692 HydrophobicContact CD1-CG 4.35Å; Y690-P692 HydrophobicContact CE1-CB 3.61Å; Y690-P692 HydrophobicContact CE1-CG 3.89Å
693	E	35.4	Very low	30.2	Very low	171.667 Å²	171.667	129 Å²	129	80%	0.802	67%	0.668	S	S	*	*			trans	-112.5	44.7	178.2	-70.4	-160.8	139.9	0	0	112.8	D691	D691-E693 VanDerWaalsContact C-N 3.29Å; D691-E693 PolarHBondContact O-N 3.1Å; D691-E693 PolarHBondContact OD1-N 3.2Å
694	T	33.3	Very low	30.4	Very low	110.333 Å²	110.333	122.6 Å²	122.6	68%	0.677	65%	0.651	S	S	*	*			trans	-128.4	119.9	176.4	17	0	0	0	0	110
695	V	30.9	Very low	30.7	Very low	120 Å²	120	123.3 Å²	123.3	73%	0.727	65%	0.652	S	S	*	*			trans	-124.8	120.7	153.6	175.4	0	0	0	0	110.6
696	E	30.7	Very low	30.9	Very low	179 Å²	179	123.4 Å²	123.4	84%	0.836	65%	0.65	S	S	*	*			trans	-132.6	170.2	143.2	-76.5	-154.3	155.5	0	0	113.6
697	E	31.2	Very low	31.2	Very low	180.333 Å²	180.333	118.4 Å²	118.4	84%	0.843	64%	0.642	S	S	*	*			trans	88	155.2	163.1	-75.2	-140	125	0	0	117.6	A699	E697-A699 PolarHBondContact O-N 2.86Å
698	P	29	Very low	31.9	Very low	112 Å²	112	120 Å²	120	73%	0.727	64%	0.642	S	S	*	*			trans	-100.7	144.8	-155.2	38.6	-36.2	0	0	0	116.5
699	A	26.9	Very low	32.2	Very low	74.3333 Å²	74.3333	118.2 Å²	118.2	61%	0.614	64%	0.638	S	S	*	*			trans	60.3	138.8	171.3	0	0	0	0	0	118	E697 K735	E697-A699 PolarHBondContact O-N 2.86Å; A699-K735 HydrophobicContact CB-CD 4.4Å
700	T	29.4	Very low	32.6	Very low	98 Å²	98	115.9 Å²	115.9	60%	0.601	63%	0.628	S	S	*	*			trans	-141.6	124.5	-179.4	2.1	0	0	0	0	114.8	V734 K735 A832	T700-V734 HydrophobicContact CG2-CB 4.24Å; T700-V734 HydrophobicContact CG2-CG1 3.99Å; T700-K735 PolarHBondContact OG1-N 2.78Å; T700-A832 HydrophobicContact CG2-CB 3.55Å
701	V	30.7	Very low	32.8	Very low	99 Å²	99	115.8 Å²	115.8	60%	0.6	63%	0.633	S	S	*	*			trans	-75.8	137.5	170.9	-155.8	0	0	0	0	113.7	T703	V701-T703 VanDerWaalsContact C-N 3.32Å; V701-T703 PolarHBondContact O-N 2.85Å; V701-T703 PolarHBondContact O-OG1 3.32Å; V701-T703 VanDerWaalsContact O-OG1 3.13Å
702	P	29.2	Very low	33	Very low	84 Å²	84	118.6 Å²	118.6	55%	0.545	64%	0.642	S	S	.	*			trans	-92.8	127	169.8	31.4	-32	0	0	0	115.2	T704	P702-T704 PolarHBondContact O-N 3.12Å
703	T	30.2	Very low	33.2	Very low	73.3333 Å²	73.3333	121.6 Å²	121.6	45%	0.45	65%	0.646	S	S	.	*			trans	-103.9	105.1	158.6	-50.2	0	0	0	0	110.8	V701 E705	V701-T703 VanDerWaalsContact C-N 3.32Å; V701-T703 PolarHBondContact O-N 2.85Å; V701-T703 PolarHBondContact O-OG1 3.32Å; V701-T703 VanDerWaalsContact O-OG1 3.13Å; T703-E705 HydrophobicContact CG2-CB 3.91Å; T703-E705 HydrophobicContact CG2-CG 4.11Å; T703-E705 PolarHBondContact O-N 3.04Å
704	T	35.1	Very low	33.4	Very low	68.6667 Å²	68.6667	119.4 Å²	119.4	42%	0.421	63%	0.631	S	S	.	*			trans	-75.9	85.1	172.5	-36.3	0	0	0	0	110.9	P702 Q706 A828 I831 A832	P702-T704 PolarHBondContact O-N 3.12Å; T704-Q706 VanDerWaalsContact C-N 3.26Å; T704-Q706 HydrophobicContact CG2-CB 4.11Å; T704-Q706 HydrophobicContact CG2-CG 3.76Å; T704-Q706 PolarHBondContact O-N 2.77Å; T704-A828 VanDerWaalsContact O-CA 3.23Å; T704-A828 WeakPolarHBondContact O-CA 3.45Å; T704-A828 VanDerWaalsContact O-CB 3.25Å; T704-A828 WeakPolarHBondContact O-CB 3.48Å; T704-I831 VanDerWaalsContact CB-CD1 3.48Å; T704-I831 HydrophobicContact CG2-CD1 3.57Å; T704-I831 HydrophobicContact CG2-CG1 4.22Å; T704-I831 PolarHBondContact OG1-O 3.19Å; T704-A832 PolarHBondContact OG1-N 2.88Å
705	E	32.8	Very low	33.3	Very low	128.667 Å²	128.667	124.2 Å²	124.2	60%	0.601	64%	0.643	S	S	*	*			trans	-98.8	68	171.6	-131.9	-179.1	172.9	0	0	111.6	T703 A707 T826 A828	T703-E705 HydrophobicContact CG2-CB 3.91Å; T703-E705 HydrophobicContact CG2-CG 4.11Å; T703-E705 PolarHBondContact O-N 3.04Å; E705-A707 PolarHBondContact O-N 2.96Å; E705-T826 HydrophobicContact CG-CG2 3.42Å; E705-T826 VanDerWaalsContact CG-CG2 3.42Å; E705-A828 HydrophobicContact CG-CB 4.44Å
706	Q	35	Very low	33.6	Very low	124.333 Å²	124.333	121.3 Å²	121.3	58%	0.581	64%	0.637	S	S	*	*			trans	-112.9	101.2	174.2	-77.9	-173.4	-34.7	0	0	111.1	L687 T704 N824 T826 V827 A834	L687-Q706 VanDerWaalsContact CD2-OE1 3.31Å; T704-Q706 VanDerWaalsContact C-N 3.26Å; T704-Q706 HydrophobicContact CG2-CB 4.11Å; T704-Q706 HydrophobicContact CG2-CG 3.76Å; T704-Q706 PolarHBondContact O-N 2.77Å; Q706-N824 PolarHBondContact O-ND2 3.36Å; Q706-N824 VanDerWaalsContact O-ND2 3.14Å; Q706-N824 PolarHBondContact O-OD1 3.02Å; Q706-T826 WeakPolarHBondContact O-CA 3.49Å; Q706-V827 PolarHBondContact N-O 2.99Å; Q706-V827 PolarHBondContact O-N 2.87Å; Q706-A834 HydrophobicContact CB-CB 4.39Å; Q706-A834 PolarHBondContact OE1-O 3.44Å
707	A	33.1	Very low	33.7	Very low	73.6667 Å²	73.6667	118.9 Å²	118.9	61%	0.609	64%	0.637	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-112.7	113.1	178	0	0	0	0	0	113.8	E705 N709 V825	E705-A707 PolarHBondContact O-N 2.96Å; A707-N709 PolarHBondContact O-N 2.98Å; A707-V825 CarbonylContact C-O 3.51Å; A707-V825 VanDerWaalsContact CA-O 3.29Å; A707-V825 WeakPolarHBondContact CA-O 3.48Å
708	W	43.3	Very low	34	Very low	120 Å²	120	114.7 Å²	114.7	46%	0.455	63%	0.633	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.8	77.1	175.8	-116.8	79.4	0	0	0	112	I685 E710 V822 N824 V825 V836 V838	I685-W708 HydrophobicContact CD1-CH2 4.29Å; I685-W708 HydrophobicContact CD1-CZ2 4.17Å; W708-E710 VanDerWaalsContact C-N 3.3Å; W708-E710 HydrophobicContact CE3-CG 3.7Å; W708-E710 HydrophobicContact CH2-CB 3.53Å; W708-E710 HydrophobicContact CH2-CG 3.71Å; W708-E710 HydrophobicContact CZ2-CB 4.28Å; W708-E710 HydrophobicContact CZ2-CG 4.28Å; W708-E710 HydrophobicContact CZ3-CB 3.76Å; W708-E710 HydrophobicContact CZ3-CG 4.38Å; W708-E710 PolarHBondContact O-N 2.8Å; W708-V822 HydrophobicContact CE3-CG1 4.31Å; W708-V822 HydrophobicContact CZ3-CB 4.24Å; W708-V822 HydrophobicContact CZ3-CG1 3.92Å; W708-N824 CarbonylContact O-C 3.4Å; W708-N824 WeakPolarHBondContact O-CA 3.4Å; W708-N824 PolarHBondContact O-OD1 3.34Å; W708-V825 HydrophobicContact CB-CB 4.44Å; W708-V825 HydrophobicContact CE3-CG2 4.35Å; W708-V825 PolarHBondContact N-O 2.59Å; W708-V825 PolarHBondContact O-N 2.88Å; W708-V836 HydrophobicContact CB-CB 4.19Å; W708-V836 HydrophobicContact CB-CG1 3.99Å; W708-V838 HydrophobicContact CD2-CB 4.15Å; W708-V838 HydrophobicContact CD2-CG2 3.67Å; W708-V838 HydrophobicContact CE3-CB 4.01Å; W708-V838 HydrophobicContact CE3-CG2 3.44Å; W708-V838 VanDerWaalsContact CE3-CG2 3.44Å; W708-V838 HydrophobicContact CG-CG2 4.34Å; W708-V838 HydrophobicContact CH2-CB 3.72Å; W708-V838 HydrophobicContact CH2-CG1 4.04Å; W708-V838 HydrophobicContact CH2-CG2 4.12Å; W708-V838 HydrophobicContact CZ2-CB 3.85Å; W708-V838 HydrophobicContact CZ2-CG2 4.31Å; W708-V838 HydrophobicContact CZ3-CB 3.8Å; W708-V838 HydrophobicContact CZ3-CG1 4.07Å; W708-V838 HydrophobicContact CZ3-CG2 3.69Å
709	N	35.6	Very low	34.5	Very low	132.333 Å²	132.333	118.2 Å²	118.2	71%	0.708	64%	0.637	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-87.1	74.4	179.1	-80.6	-10.2	0	0	0	113.1	A707 Q711 N824	A707-N709 PolarHBondContact O-N 2.98Å; N709-Q711 PolarHBondContact O-N 2.96Å; N709-Q711 VanDerWaalsContact O-N 3.13Å; N709-N824 WeakPolarHBondContact OD1-CB 3.41Å; N709-N824 PolarHBondContact OD1-ND2 3.46Å; N709-N824 VanDerWaalsContact OD1-ND2 3.17Å
710	E	38.9	Very low	35.2	Very low	104.667 Å²	104.667	117.8 Å²	117.8	49%	0.489	63%	0.63	S	S	.	*			trans	-86.5	56.3	175.8	-93.2	-160.5	151.1	0	0	113.5	W708 Y714 R821 K823 H840	W708-E710 VanDerWaalsContact C-N 3.3Å; W708-E710 HydrophobicContact CE3-CG 3.7Å; W708-E710 HydrophobicContact CH2-CB 3.53Å; W708-E710 HydrophobicContact CH2-CG 3.71Å; W708-E710 HydrophobicContact CZ2-CB 4.28Å; W708-E710 HydrophobicContact CZ2-CG 4.28Å; W708-E710 HydrophobicContact CZ3-CB 3.76Å; W708-E710 HydrophobicContact CZ3-CG 4.38Å; W708-E710 PolarHBondContact O-N 2.8Å; E710-Y714 WeakPolarHBondContact OE1-CE2 3.22Å; E710-R821 VanDerWaalsContact CD-NH2 3.3Å; E710-R821 IonicContact OE1-CZ 2.75Å; E710-R821 IonicContact OE1-NH1 2.66Å; E710-R821 IonicContact OE1-NH2 2.75Å; E710-R821 PolarHBondContact OE1-NH2 2.81Å; E710-R821 IonicContact OE2-CZ 3.36Å; E710-R821 VanDerWaalsContact OE2-CZ 3.32Å; E710-R821 IonicContact OE2-NE 2.77Å; E710-R821 PolarHBondContact OE2-NE 2.88Å; E710-R821 IonicContact OE2-NH1 3.73Å; E710-R821 PolarHBondContact OE2-NH1 3.01Å; E710-R821 IonicContact OE2-NH2 3.83Å; E710-R821 PolarHBondContact OE2-NH2 3.13Å; E710-K823 PolarHBondContact N-O 2.85Å; E710-H840 IonicContact OE1-CE1 3.53Å; E710-H840 PolarHBondContact OE1-CE1 2.81Å; E710-H840 IonicContact OE1-ND1 3.28Å
711	Q	34.3	Very low	36.2	Very low	168.333 Å²	168.333	115.7 Å²	115.7	79%	0.787	62%	0.619	S	S	*	*			trans	-106.8	9.8	173.7	-96.3	-178.3	-8.3	0	0	114.4	N709 K713	N709-Q711 PolarHBondContact O-N 2.96Å; N709-Q711 VanDerWaalsContact O-N 3.13Å; Q711-K713 VanDerWaalsContact C-N 3.32Å; Q711-K713 PolarHBondContact O-N 2.96Å
712	E	36.8	Very low	37.7	Very low	176.333 Å²	176.333	112.3 Å²	112.3	82%	0.824	60%	0.598	S	S	*	*	S	Bend	trans	-82.8	11.1	179.1	-60.7	-158.1	140.9	0	0	116.7	Y714	E712-Y714 PolarHBondContact O-N 3.06Å
713	K	36.4	Very low	40	Very low	155.333 Å²	155.333	109.8 Å²	109.8	68%	0.675	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	7.3	-179.6	-99	-175.7	176.4	-175.8	0	117.7	Q711	Q711-K713 VanDerWaalsContact C-N 3.32Å; Q711-K713 PolarHBondContact O-N 2.96Å
714	Y	38.4	Very low	42.5	Very low	124.333 Å²	124.333	106.4 Å²	106.4	49%	0.488	56%	0.559	S	S	.	*			trans	-125.6	72.4	167.4	-77.8	-76.1	0	0	0	113.1	E710 E712 G716 V722 I851	E710-Y714 WeakPolarHBondContact OE1-CE2 3.22Å; E712-Y714 PolarHBondContact O-N 3.06Å; Y714-G716 PolarHBondContact O-N 2.78Å; Y714-G716 VanDerWaalsContact O-N 3.11Å; Y714-V722 HydrophobicContact CD1-CG2 4.34Å; Y714-V722 HydrophobicContact CE1-CG1 4.4Å; Y714-V722 HydrophobicContact CE1-CG2 3.91Å; Y714-V722 HydrophobicContact CE2-CG1 4.12Å; Y714-I851 HydrophobicContact CD1-CD1 4.39Å; Y714-I851 HydrophobicContact CE1-CD1 4.27Å; Y714-I851 HydrophobicContact CE1-CG1 4.01Å
715	K	31.2	Very low	44.8	Very low	212 Å²	212	108.1 Å²	108.1	92%	0.922	56%	0.558	S	S	*	*			trans	-83.6	102.4	161.6	-72.6	-174.2	176.1	-178.8	0	109.3
716	G	36.4	Very low	47.5	Very low	58.6667 Å²	58.6667	103 Å²	103	61%	0.605	54%	0.536	S	S	*	.	S	Bend	trans	-177.5	142.1	178	0	0	0	0	0	112.2	Y714 A718	Y714-G716 PolarHBondContact O-N 2.78Å; Y714-G716 VanDerWaalsContact O-N 3.11Å; G716-A718 PolarHBondContact O-N 2.83Å; G716-A718 VanDerWaalsContact O-N 3.16Å
717	P	34.1	Very low	50.1	Low	129 Å²	129	97.1 Å²	97.1	84%	0.838	51%	0.509	S	S	*	.			trans	-73.3	128.9	-168.9	28.1	-34.7	0	0	0	113.8	K719	P717-K719 PolarHBondContact O-N 3.07Å
718	A	36.6	Very low	52.7	Low	92.3333 Å²	92.3333	96.3 Å²	96.3	76%	0.763	49%	0.492	S	S	*	.	S	Bend	trans	-90.9	85.4	-173.4	0	0	0	0	0	114.6	G716 S720	G716-A718 PolarHBondContact O-N 2.83Å; G716-A718 VanDerWaalsContact O-N 3.16Å; A718-S720 PolarHBondContact O-N 2.92Å
719	K	40.4	Very low	54.8	Low	185.667 Å²	185.667	90.6 Å²	90.6	81%	0.807	47%	0.471	S	S	*	.			trans	-114	30.2	174.7	-83.4	-179.8	-177.5	-174.5	0	115.6	P717 S721	P717-K719 PolarHBondContact O-N 3.07Å; K719-S721 PolarHBondContact O-N 2.85Å
720	S	40.4	Very low	57.2	Low	65.3333 Å²	65.3333	86.3 Å²	86.3	46%	0.457	45%	0.449	S	S	.	.			trans	-99.3	107.1	170.2	104.2	0	0	0	0	112	A718 V722 K842	A718-S720 PolarHBondContact O-N 2.92Å; S720-V722 PolarHBondContact O-N 2.83Å; S720-K842 WeakPolarHBondContact OG-CE 3.42Å
721	S	51.1	Low	59.5	Low	54 Å²	54	81.4 Å²	81.4	38%	0.378	43%	0.426	S	S	.	.			trans	-69.2	109.3	174.5	-178.6	0	0	0	0	110.7	K719 R843	K719-S721 PolarHBondContact O-N 2.85Å; S721-R843 WeakPolarHBondContact O-CA 3.12Å; S721-R843 WeakPolarHBondContact O-CB 3.49Å; S721-R843 PolarHBondContact O-N 3.07Å
722	V	63.2	Low	62.1	Low	26.3333 Å²	26.3333	77.8 Å²	77.8	16%	0.16	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	114	174.7	174.3	0	0	0	0	107.6	Y714 S720 L820 H840 K842	Y714-V722 HydrophobicContact CD1-CG2 4.34Å; Y714-V722 HydrophobicContact CE1-CG1 4.4Å; Y714-V722 HydrophobicContact CE1-CG2 3.91Å; Y714-V722 HydrophobicContact CE2-CG1 4.12Å; S720-V722 PolarHBondContact O-N 2.83Å; V722-L820 WeakPolarHBondContact O-CB 3.32Å; V722-H840 HydrophobicContact CG1-CB 3.38Å; V722-H840 VanDerWaalsContact CG1-CB 3.45Å; V722-K842 HydrophobicContact CG2-CD 4.42Å; V722-K842 HydrophobicContact CG2-CG 3.96Å
723	M	75.7	Confident	64.6	Low	31.6667 Å²	31.6667	69.6 Å²	69.6	16%	0.156	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	136	-172.2	-178.3	170	-175.7	0	0	111.5	R725 K800 L820 H840 V841	M723-R725 PolarHBondContact O-N 2.84Å; M723-K800 HydrophobicContact CE-CG 4.33Å; M723-K800 VanDerWaalsContact CE-N 3.35Å; M723-L820 CarbonylContact C-O 3.58Å; M723-L820 HydrophobicContact CB-CB 4.5Å; M723-L820 HydrophobicContact CE-CD2 4.04Å; M723-L820 HydrophobicContact CG-CB 4.49Å; M723-L820 HydrophobicContact CG-CD2 4.09Å; M723-L820 HydrophobicContact SD-CD2 4.18Å; M723-H840 CarbonylContact O-C 3.53Å; M723-H840 VanDerWaalsContact O-CA 3.28Å; M723-H840 WeakPolarHBondContact O-CA 3.22Å; M723-H840 WeakPolarHBondContact O-CB 3.38Å; M723-V841 PolarHBondContact N-O 2.92Å; M723-V841 PolarHBondContact O-N 2.84Å
724	L	83.4	Confident	67.1	Low	2.66667 Å²	2.66667	64.1 Å²	64.1	1%	0.014	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.2	129.4	174.1	-175.5	62.3	0	0	0	110.5	I727 M746 A797 I817 L820 V822 V838	L724-I727 HydrophobicContact CD1-CG1 3.87Å; L724-I727 HydrophobicContact CD2-CD1 4.09Å; L724-I727 HydrophobicContact CD2-CG1 4.07Å; L724-M746 HydrophobicContact CD2-CE 4.33Å; L724-A797 HydrophobicContact CB-CB 4.22Å; L724-A797 HydrophobicContact CD2-CB 4.11Å; L724-A797 HydrophobicContact CG-CB 3.88Å; L724-A797 WeakPolarHBondContact O-CB 3.17Å; L724-I817 HydrophobicContact CB-CD1 4.37Å; L724-I817 HydrophobicContact CD2-CD1 4.01Å; L724-L820 VanDerWaalsContact CB-O 3.27Å; L724-L820 WeakPolarHBondContact CB-O 3.29Å; L724-L820 PolarHBondContact N-O 2.95Å; L724-V822 HydrophobicContact CD1-CG2 3.87Å; L724-V822 HydrophobicContact CD2-CG2 3.93Å; L724-V822 HydrophobicContact CG-CG2 4.34Å; L724-V838 HydrophobicContact CD1-CG1 3.71Å
725	R	84.4	Confident	69.3	Low	105 Å²	105	67.5 Å²	67.5	40%	0.396	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	-42.7	171.8	-175.9	-167.8	-178.7	168.2	-4.4	110.7	V678 M723 A797 A839 V841 D860 D861	V678-R725 VanDerWaalsContact O-CZ 3.25Å; V678-R725 PolarHBondContact O-NH1 3.23Å; V678-R725 PolarHBondContact O-NH2 2.89Å; M723-R725 PolarHBondContact O-N 2.84Å; R725-A797 PolarHBondContact O-N 2.9Å; R725-A839 WeakPolarHBondContact CA-O 3.43Å; R725-A839 HydrophobicContact CB-CB 4.28Å; R725-A839 WeakPolarHBondContact CB-O 3.33Å; R725-A839 PolarHBondContact N-O 3.04Å; R725-V841 HydrophobicContact CB-CG2 3.85Å; R725-V841 HydrophobicContact CG-CG2 4.26Å; R725-D860 IonicContact CZ-OD1 2.63Å; R725-D860 IonicContact CZ-OD2 3.33Å; R725-D860 VanDerWaalsContact NH1-CG 3.26Å; R725-D860 IonicContact NH1-OD1 2.71Å; R725-D860 PolarHBondContact NH1-OD1 2.96Å; R725-D860 IonicContact NH1-OD2 3.79Å; R725-D860 PolarHBondContact NH1-OD2 2.82Å; R725-D860 IonicContact NH2-OD2 3.54Å; R725-D861 IonicContact CZ-OD1 2.86Å; R725-D861 IonicContact CZ-OD2 3.64Å; R725-D861 IonicContact NH2-OD1 3.2Å; R725-D861 PolarHBondContact NH2-OD1 3.39Å; R725-D861 IonicContact NH2-OD2 2.78Å; R725-D861 PolarHBondContact NH2-OD2 2.71Å
726	S	89	Confident	72	Confident	21 Å²	21	68.1 Å²	68.1	15%	0.147	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	149.4	176.9	56.5	0	0	0	0	113.6	V795 A839	S726-V795 CarbonylContact C-O 3.51Å; S726-V795 WeakPolarHBondContact CA-O 3.35Å; S726-V795 WeakPolarHBondContact CB-O 3.1Å; S726-A839 PolarHBondContact N-O 3.17Å; S726-A839 VanDerWaalsContact N-O 3.1Å; S726-A839 PolarHBondContact O-N 3.07Å
727	I	89.4	Confident	74.6	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.005	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	129.1	158.5	-54.5	178.3	0	0	0	106.5	L724 M742 V744 W752 T794 V795 V822 V825 V836 R837 V838	L724-I727 HydrophobicContact CD1-CG1 3.87Å; L724-I727 HydrophobicContact CD2-CD1 4.09Å; L724-I727 HydrophobicContact CD2-CG1 4.07Å; I727-M742 HydrophobicContact CG2-SD 4.05Å; I727-V744 HydrophobicContact CD1-CB 4.48Å; I727-V744 HydrophobicContact CD1-CG1 3.81Å; I727-V744 HydrophobicContact CD1-CG2 3.81Å; I727-W752 HydrophobicContact CD1-CH2 4.01Å; I727-W752 HydrophobicContact CD1-CZ2 3.75Å; I727-T794 CarbonylContact O-C 3.55Å; I727-T794 WeakPolarHBondContact O-CA 3.22Å; I727-V795 HydrophobicContact CB-CB 4.34Å; I727-V795 HydrophobicContact CB-CG2 4.49Å; I727-V795 PolarHBondContact N-O 3.26Å; I727-V795 PolarHBondContact O-N 2.98Å; I727-V822 HydrophobicContact CD1-CG2 4.24Å; I727-V825 HydrophobicContact CD1-CG2 4.05Å; I727-V825 HydrophobicContact CG2-CG1 4.32Å; I727-V825 HydrophobicContact CG2-CG2 4.3Å; I727-V836 HydrophobicContact CG2-CG1 4.16Å; I727-R837 CarbonylContact C-O 3.44Å; I727-R837 WeakPolarHBondContact CA-O 3.42Å; I727-V838 HydrophobicContact CG1-CG1 4.4Å; I727-V838 HydrophobicContact CG1-CG2 4.38Å; I727-V838 HydrophobicContact CG2-CG2 4.35Å
728	Q	88.7	Confident	77.3	Confident	56.6667 Å²	56.6667	67.7 Å²	67.7	27%	0.265	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	121.9	173.3	-176.8	179.6	13	0	0	108.3	T792 L793 V836 R837	Q728-T792 HydrophobicContact CG-CG2 4.11Å; Q728-L793 CarbonylContact C-O 3.56Å; Q728-L793 WeakPolarHBondContact CA-O 2.98Å; Q728-V836 CarbonylContact O-C 3.55Å; Q728-V836 WeakPolarHBondContact O-CA 3.39Å; Q728-R837 HydrophobicContact CB-CB 4.48Å; Q728-R837 PolarHBondContact N-O 3.02Å; Q728-R837 PolarHBondContact O-N 2.84Å
729	A	86.1	Confident	79.9	Confident	0.666667 Å²	0.666667	66.3 Å²	66.3	1%	0.006	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	119.8	176.2	0	0	0	0	0	109	V731 M742 T792 L793 V827 V835 V836	A729-V731 HydrophobicContact CB-CG2 4.21Å; A729-M742 HydrophobicContact CB-SD 4.24Å; A729-T792 CarbonylContact O-C 3.6Å; A729-L793 HydrophobicContact CB-CB 4.32Å; A729-L793 HydrophobicContact CB-CD1 4.33Å; A729-L793 PolarHBondContact N-O 3.1Å; A729-L793 PolarHBondContact O-N 2.97Å; A729-V827 HydrophobicContact CB-CG2 4.14Å; A729-V835 WeakPolarHBondContact CA-O 3.32Å; A729-V836 HydrophobicContact CB-CG2 4.11Å
730	T	86.7	Confident	82.5	Confident	41.6667 Å²	41.6667	57.5 Å²	57.5	26%	0.256	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	112.1	172.7	-61.3	0	0	0	0	107.9	N790 V791 T792 A834 V835	T730-N790 VanDerWaalsContact CG2-OD1 3.23Å; T730-N790 WeakPolarHBondContact CG2-OD1 3.39Å; T730-V791 CarbonylContact C-O 3.57Å; T730-V791 WeakPolarHBondContact CA-O 3.43Å; T730-T792 PolarHBondContact OG1-OG1 3.15Å; T730-A834 CarbonylContact O-C 3.41Å; T730-A834 VanDerWaalsContact O-CA 3.3Å; T730-A834 WeakPolarHBondContact O-CA 3.33Å; T730-V835 PolarHBondContact N-O 2.88Å; T730-V835 PolarHBondContact O-N 3.06Å
731	V	87.2	Confident	85	Confident	0.666667 Å²	0.666667	56.7 Å²	56.7	0%	0.004	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	129.1	-168.9	-172.7	0	0	0	0	109.9	A729 L733 F740 V791 L793 V827 I831 A834	A729-V731 HydrophobicContact CB-CG2 4.21Å; V731-L733 HydrophobicContact CG1-CD2 3.94Å; V731-F740 HydrophobicContact CG1-CD2 4.45Å; V731-F740 HydrophobicContact CG1-CE2 4.44Å; V731-V791 HydrophobicContact CB-CB 4.38Å; V731-V791 PolarHBondContact N-O 3.12Å; V731-V791 WeakPolarHBondContact O-CB 3.36Å; V731-V791 PolarHBondContact O-N 2.99Å; V731-L793 HydrophobicContact CG2-CD1 3.99Å; V731-L793 HydrophobicContact CG2-CG 4.25Å; V731-V827 HydrophobicContact CG1-CG1 4.31Å; V731-V827 HydrophobicContact CG2-CG1 3.92Å; V731-I831 HydrophobicContact CG1-CB 3.98Å; V731-I831 HydrophobicContact CG1-CG2 3.4Å; V731-I831 VanDerWaalsContact CG1-CG2 3.5Å; V731-A834 HydrophobicContact CG1-CB 4.44Å; V731-A834 HydrophobicContact CG2-CB 4.25Å
732	K	88	Confident	87	Confident	94 Å²	94	54.2 Å²	54.2	41%	0.409	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	116.5	168.1	-176.9	-177.7	178.6	-174.8	0	107.6	I831 A832 S833	K732-I831 CarbonylContact O-C 3.57Å; K732-I831 WeakPolarHBondContact O-CA 3.47Å; K732-A832 HydrophobicContact CB-CB 4.46Å; K732-A832 HydrophobicContact CD-CB 4.06Å; K732-A832 HydrophobicContact CG-CB 4.21Å; K732-A832 PolarHBondContact O-N 3Å; K732-S833 PolarHBondContact N-O 3.1Å; K732-S833 PolarHBondContact O-N 2.68Å
733	L	90	Very high	88.4	Confident	3.33333 Å²	3.33333	56.7 Å²	56.7	2%	0.017	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	165.1	173.2	-58.9	179.9	0	0	0	111.1	V731 P737 F740 L758 L783 Y788 V791 D830 I831	V731-L733 HydrophobicContact CG1-CD2 3.94Å; L733-P737 HydrophobicContact CB-CB 4Å; L733-P737 HydrophobicContact CB-CG 3.92Å; L733-P737 HydrophobicContact CD1-CB 4.2Å; L733-P737 HydrophobicContact CD1-CG 3.9Å; L733-P737 HydrophobicContact CD2-CB 4.09Å; L733-P737 HydrophobicContact CG-CB 4.46Å; L733-P737 HydrophobicContact CG-CG 4.4Å; L733-F740 HydrophobicContact CD1-CD1 4.38Å; L733-F740 HydrophobicContact CD1-CE1 4.2Å; L733-F740 HydrophobicContact CD2-CB 4.34Å; L733-F740 HydrophobicContact CD2-CD1 3.61Å; L733-F740 HydrophobicContact CD2-CD2 4.35Å; L733-F740 HydrophobicContact CD2-CE1 3.91Å; L733-F740 HydrophobicContact CD2-CG 4.03Å; L733-F740 HydrophobicContact CD2-CZ 4.42Å; L733-F740 HydrophobicContact CG-CD1 4.49Å; L733-F740 HydrophobicContact CG-CE1 4.46Å; L733-L758 HydrophobicContact CD1-CD1 3.81Å; L733-L758 HydrophobicContact CD2-CD1 4.37Å; L733-L783 HydrophobicContact CD1-CD2 3.63Å; L733-Y788 WeakPolarHBondContact CA-O 3.36Å; L733-Y788 HydrophobicContact CB-CG 4.26Å; L733-Y788 WeakPolarHBondContact CB-O 3.19Å; L733-Y788 HydrophobicContact CD1-CD1 3.8Å; L733-Y788 HydrophobicContact CD1-CE1 4.24Å; L733-Y788 HydrophobicContact CD1-CG 4.11Å; L733-Y788 PolarHBondContact N-O 3.02Å; L733-V791 HydrophobicContact CD1-CG2 3.93Å; L733-V791 HydrophobicContact CG-CG2 4.02Å; L733-D830 WeakPolarHBondContact CA-O 3.39Å; L733-D830 WeakPolarHBondContact CD2-O 3.37Å; L733-I831 HydrophobicContact CD2-CG2 3.87Å
734	V	88.8	Confident	89.2	Confident	39.6667 Å²	39.6667	55.2 Å²	55.2	24%	0.24	23%	0.233	C	C	.	.	P	Polyproline II helix	trans	-84.6	175.7	178.3	-58.4	0	0	0	0	111.7	T700 R736 P737 D830 I831 A832	T700-V734 HydrophobicContact CG2-CB 4.24Å; T700-V734 HydrophobicContact CG2-CG1 3.99Å; V734-R736 VanDerWaalsContact C-N 3.27Å; V734-R736 PolarHBondContact O-N 2.89Å; V734-P737 HydrophobicContact CG2-CB 4.05Å; V734-P737 HydrophobicContact CG2-CG 4.49Å; V734-P737 WeakPolarHBondContact O-CD 3.16Å; V734-D830 WeakPolarHBondContact CG1-O 3.4Å; V734-D830 HydrophobicContact CG2-CB 3.94Å; V734-D830 WeakPolarHBondContact CG2-O 3.43Å; V734-D830 PolarHBondContact N-O 2.97Å; V734-I831 VanDerWaalsContact CG1-C 3.5Å; V734-A832 HydrophobicContact CG1-CB 4.22Å
735	K	84.6	Confident	89.5	Confident	195.333 Å²	195.333	59.5 Å²	59.5	85%	0.849	25%	0.252	S	S	*	.	S	Bend	trans	-59.5	-29.7	-177.2	-73.2	-175.7	177.4	178.4	0	114.4	A699 T700	A699-K735 HydrophobicContact CB-CD 4.4Å; T700-K735 PolarHBondContact OG1-N 2.78Å
736	R	88.2	Confident	89.7	Confident	225.667 Å²	225.667	54.5 Å²	54.5	85%	0.852	23%	0.233	S	C	*	.	S	Bend	trans	-140.2	78.3	179.2	-66.2	-179.3	-178.4	147	-2.2	109.8	V734	V734-R736 VanDerWaalsContact C-N 3.27Å; V734-R736 PolarHBondContact O-N 2.89Å
737	P	90.3	Very high	89.4	Confident	5.66667 Å²	5.66667	56.2 Å²	56.2	4%	0.037	24%	0.238	C	C	.	.			trans	-88.6	128.9	-175.9	35.2	-30	0	0	0	110.7	L733 V734 L758 Y788 D830	L733-P737 HydrophobicContact CB-CB 4Å; L733-P737 HydrophobicContact CB-CG 3.92Å; L733-P737 HydrophobicContact CD1-CB 4.2Å; L733-P737 HydrophobicContact CD1-CG 3.9Å; L733-P737 HydrophobicContact CD2-CB 4.09Å; L733-P737 HydrophobicContact CG-CB 4.46Å; L733-P737 HydrophobicContact CG-CG 4.4Å; V734-P737 HydrophobicContact CG2-CB 4.05Å; V734-P737 HydrophobicContact CG2-CG 4.49Å; V734-P737 WeakPolarHBondContact O-CD 3.16Å; P737-L758 HydrophobicContact CB-CD1 3.82Å; P737-L758 HydrophobicContact CG-CD1 3.83Å; P737-Y788 VanDerWaalsContact CD-CE2 3.45Å; P737-Y788 HydrophobicContact CG-CD2 3.64Å; P737-Y788 HydrophobicContact CG-CE1 4.43Å; P737-Y788 HydrophobicContact CG-CE2 3.44Å; P737-Y788 HydrophobicContact CG-CG 4.25Å; P737-D830 HydrophobicContact CB-CB 3.75Å
738	R	90.9	Very high	88.9	Confident	172.333 Å²	172.333	62.2 Å²	62.2	65%	0.65	27%	0.271	S	S	*	.			trans	-101.7	-42.9	176	-61.3	-171	161.9	158.7	-4.3	112.2	L758 D759 D830	R738-L758 WeakPolarHBondContact O-CB 3.14Å; R738-L758 PolarHBondContact O-N 3.03Å; R738-D759 WeakPolarHBondContact CB-OD2 3.19Å; R738-D759 WeakPolarHBondContact CD-OD2 3.34Å; R738-D759 WeakPolarHBondContact CG-OD2 3.33Å; R738-D759 IonicContact NE-OD2 3.28Å; R738-D759 PolarHBondContact NE-OD2 3.11Å; R738-D830 WeakPolarHBondContact CA-OD2 3.35Å; R738-D830 WeakPolarHBondContact CB-OD2 3.5Å; R738-D830 PolarHBondContact N-OD2 3.15Å
739	Y	92.3	Very high	88.3	Confident	63 Å²	63	65.3 Å²	65.3	25%	0.247	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	135.2	-173.1	162.7	-92.7	0	0	0	112.2	Y741 K753 E755 A756 H757 D830	Y739-Y741 AromaticContact CE1-CD1 3.57Å; Y739-Y741 HydrophobicContact CE1-CD1 3.57Å; Y739-Y741 HydrophobicContact CE1-CE1 4.14Å; Y739-Y741 HydrophobicContact CE1-CG 4.48Å; Y739-Y741 AromaticContact CZ-CD1 3.63Å; Y739-Y741 VanDerWaalsContact OH-CD1 3.22Å; Y739-Y741 WeakPolarHBondContact OH-CD1 3.39Å; Y739-K753 WeakPolarHBondContact OH-CE 3.41Å; Y739-K753 PolarHBondContact OH-NZ 2.78Å; Y739-E755 HydrophobicContact CE2-CB 4.25Å; Y739-E755 HydrophobicContact CE2-CG 4.38Å; Y739-A756 WeakPolarHBondContact CA-O 3.15Å; Y739-H757 AromaticContact CD2-CD2 3.88Å; Y739-H757 AromaticContact CD2-CE1 3.68Å; Y739-H757 AromaticContact CD2-NE2 3.56Å; Y739-H757 AromaticContact CE2-CE1 3.99Å; Y739-H757 AromaticContact CE2-NE2 3.6Å; Y739-D830 PolarHBondContact N-OD2 3.24Å; Y739-D830 WeakPolarHBondContact O-CB 3.35Å; Y739-D830 PolarHBondContact O-N 3.05Å
740	F	93.6	Very high	88.3	Confident	2.66667 Å²	2.66667	69.5 Å²	69.5	1%	0.012	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	163.5	165.3	75.2	-86.5	0	0	0	111.6	V731 L733 A756 L758 W763 L783 L793 A828 I831	V731-F740 HydrophobicContact CG1-CD2 4.45Å; V731-F740 HydrophobicContact CG1-CE2 4.44Å; L733-F740 HydrophobicContact CD1-CD1 4.38Å; L733-F740 HydrophobicContact CD1-CE1 4.2Å; L733-F740 HydrophobicContact CD2-CB 4.34Å; L733-F740 HydrophobicContact CD2-CD1 3.61Å; L733-F740 HydrophobicContact CD2-CD2 4.35Å; L733-F740 HydrophobicContact CD2-CE1 3.91Å; L733-F740 HydrophobicContact CD2-CG 4.03Å; L733-F740 HydrophobicContact CD2-CZ 4.42Å; L733-F740 HydrophobicContact CG-CD1 4.49Å; L733-F740 HydrophobicContact CG-CE1 4.46Å; F740-A756 HydrophobicContact CD1-CB 3.98Å; F740-A756 HydrophobicContact CD2-CB 4.35Å; F740-A756 HydrophobicContact CE1-CB 3.67Å; F740-A756 HydrophobicContact CE2-CB 3.99Å; F740-A756 HydrophobicContact CG-CB 4.38Å; F740-A756 HydrophobicContact CZ-CB 3.81Å; F740-A756 PolarHBondContact N-O 3.08Å; F740-A756 VanDerWaalsContact N-O 3.12Å; F740-A756 PolarHBondContact O-N 3.16Å; F740-L758 HydrophobicContact CD1-CD1 4.08Å; F740-L758 HydrophobicContact CD1-CG 4.45Å; F740-L758 HydrophobicContact CE1-CD1 4.12Å; F740-L758 HydrophobicContact CE1-CD2 4.13Å; F740-L758 HydrophobicContact CE1-CG 4.31Å; F740-W763 HydrophobicContact CE1-CH2 4.3Å; F740-W763 HydrophobicContact CE1-CZ2 4.45Å; F740-W763 HydrophobicContact CE2-CH2 4.35Å; F740-W763 AromaticContact CZ-CH2 3.71Å; F740-W763 HydrophobicContact CZ-CH2 3.71Å; F740-W763 HydrophobicContact CZ-CZ2 4.31Å; F740-W763 HydrophobicContact CZ-CZ3 4.29Å; F740-L783 HydrophobicContact CE1-CD2 4.37Å; F740-L793 HydrophobicContact CE2-CD1 3.95Å; F740-L793 HydrophobicContact CE2-CD2 4.3Å; F740-L793 HydrophobicContact CZ-CD1 4.5Å; F740-L793 HydrophobicContact CZ-CD2 4.34Å; F740-A828 CarbonylContact C-O 3.28Å; F740-A828 WeakPolarHBondContact CA-O 3.33Å; F740-A828 WeakPolarHBondContact CB-O 3.37Å; F740-I831 HydrophobicContact CB-CG2 3.89Å; F740-I831 HydrophobicContact CD2-CG2 4.24Å; F740-I831 HydrophobicContact CG-CG2 4.34Å
741	Y	93.2	Very high	88.5	Confident	47.6667 Å²	47.6667	68 Å²	68	19%	0.187	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	159.2	-179	69.1	-83.7	0	0	0	113.3	Y739 R743 K753 L754 V827 A828	Y739-Y741 AromaticContact CE1-CD1 3.57Å; Y739-Y741 HydrophobicContact CE1-CD1 3.57Å; Y739-Y741 HydrophobicContact CE1-CE1 4.14Å; Y739-Y741 HydrophobicContact CE1-CG 4.48Å; Y739-Y741 AromaticContact CZ-CD1 3.63Å; Y739-Y741 VanDerWaalsContact OH-CD1 3.22Å; Y739-Y741 WeakPolarHBondContact OH-CD1 3.39Å; Y741-R743 HydrophobicContact CD2-CB 4.05Å; Y741-R743 HydrophobicContact CE2-CB 4.01Å; Y741-K753 HydrophobicContact CD2-CD 4.26Å; Y741-K753 VanDerWaalsContact CD2-CE 3.43Å; Y741-K753 HydrophobicContact CD2-CG 4.13Å; Y741-K753 VanDerWaalsContact CG-CE 3.47Å; Y741-L754 CarbonylContact C-O 3.53Å; Y741-L754 WeakPolarHBondContact CA-O 3.15Å; Y741-L754 VanDerWaalsContact CB-O 3.31Å; Y741-L754 WeakPolarHBondContact CB-O 3.35Å; Y741-V827 VanDerWaalsContact O-CA 3.32Å; Y741-V827 WeakPolarHBondContact O-CA 3.37Å; Y741-V827 WeakPolarHBondContact O-CG1 2.82Å; Y741-A828 HydrophobicContact CD1-CB 4.42Å; Y741-A828 VanDerWaalsContact CD1-O 3.31Å; Y741-A828 WeakPolarHBondContact CD1-O 3.4Å; Y741-A828 HydrophobicContact CE1-CB 3.74Å; Y741-A828 HydrophobicContact CE2-CB 4.33Å; Y741-A828 PolarHBondContact N-O 2.81Å; Y741-A828 PolarHBondContact O-N 2.92Å; Y741-A828 VanDerWaalsContact O-N 3.07Å
742	M	92.8	Very high	88.7	Confident	2.33333 Å²	2.33333	68 Å²	68	1%	0.011	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	115.8	169.2	176.6	176.4	65.9	0	0	109.2	I727 A729 V744 W752 K753 L754 V795 V825 T826 V827	I727-M742 HydrophobicContact CG2-SD 4.05Å; A729-M742 HydrophobicContact CB-SD 4.24Å; M742-V744 HydrophobicContact CG-CG2 4.17Å; M742-W752 HydrophobicContact CE-CH2 4.19Å; M742-W752 HydrophobicContact CE-CZ3 4.17Å; M742-K753 CarbonylContact O-C 3.54Å; M742-K753 WeakPolarHBondContact O-CA 3.42Å; M742-L754 HydrophobicContact CB-CB 4.48Å; M742-L754 HydrophobicContact CE-CB 4.39Å; M742-L754 HydrophobicContact CE-CD2 4.05Å; M742-L754 PolarHBondContact N-O 3.05Å; M742-L754 PolarHBondContact O-N 2.91Å; M742-V795 HydrophobicContact CE-CG2 3.55Å; M742-V795 VanDerWaalsContact CE-CG2 3.48Å; M742-V825 HydrophobicContact CG-CG1 3.83Å; M742-V825 HydrophobicContact SD-CG1 4.09Å; M742-T826 CarbonylContact C-O 3.57Å; M742-T826 VanDerWaalsContact CA-O 3.3Å; M742-T826 WeakPolarHBondContact CA-O 3.28Å; M742-V827 HydrophobicContact CB-CG2 4.17Å; M742-V827 HydrophobicContact CG-CG2 3.97Å; M742-V827 HydrophobicContact SD-CG2 4.4Å
743	R	92.6	Very high	88.9	Confident	78.6667 Å²	78.6667	64.9 Å²	64.9	30%	0.297	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	132.7	-179.6	-177	178.6	-144.1	168	2.9	109.4	Y741 E751 K753 W773 V825 T826	Y741-R743 HydrophobicContact CD2-CB 4.05Å; Y741-R743 HydrophobicContact CE2-CB 4.01Å; R743-E751 WeakPolarHBondContact CD-OE1 3.47Å; R743-E751 HydrophobicContact CG-CG 4.22Å; R743-E751 VanDerWaalsContact CG-OE1 3.28Å; R743-E751 WeakPolarHBondContact CG-OE1 3.37Å; R743-E751 IonicContact CZ-OE1 3.16Å; R743-E751 IonicContact CZ-OE2 2.77Å; R743-E751 IonicContact NE-OE1 3.16Å; R743-E751 PolarHBondContact NE-OE1 3.01Å; R743-E751 IonicContact NE-OE2 3.32Å; R743-E751 PolarHBondContact NE-OE2 2.67Å; R743-E751 VanDerWaalsContact NE-OE2 3.1Å; R743-E751 IonicContact NH2-OE1 3.73Å; R743-E751 IonicContact NH2-OE2 3.33Å; R743-E751 PolarHBondContact NH2-OE2 2.86Å; R743-K753 HydrophobicContact CB-CG 4.33Å; R743-K753 HydrophobicContact CG-CB 4.45Å; R743-K753 HydrophobicContact CG-CG 4.37Å; R743-W773 HydrophobicContact CG-CH2 4.35Å; R743-W773 VanDerWaalsContact NH2-CZ2 3.34Å; R743-V825 CarbonylContact O-C 3.46Å; R743-V825 WeakPolarHBondContact O-CA 3.34Å; R743-T826 PolarHBondContact N-O 3.2Å; R743-T826 PolarHBondContact O-N 2.85Å
744	V	92.1	Very high	89	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	108.3	-172.1	-178.9	0	0	0	0	110.4	I727 M742 M746 E751 W752 V822 N824 V825	I727-V744 HydrophobicContact CD1-CB 4.48Å; I727-V744 HydrophobicContact CD1-CG1 3.81Å; I727-V744 HydrophobicContact CD1-CG2 3.81Å; M742-V744 HydrophobicContact CG-CG2 4.17Å; V744-M746 HydrophobicContact CG1-CG 4.24Å; V744-M746 HydrophobicContact CG1-SD 3.65Å; V744-E751 WeakPolarHBondContact O-CA 3.27Å; V744-E751 WeakPolarHBondContact O-CG 3.36Å; V744-W752 HydrophobicContact CB-CD2 3.87Å; V744-W752 HydrophobicContact CB-CE3 4.32Å; V744-W752 HydrophobicContact CB-CG 4.34Å; V744-W752 HydrophobicContact CB-CH2 4.2Å; V744-W752 HydrophobicContact CB-CZ2 3.73Å; V744-W752 HydrophobicContact CB-CZ3 4.46Å; V744-W752 HydrophobicContact CG1-CD2 4.49Å; V744-W752 HydrophobicContact CG1-CZ2 3.75Å; V744-W752 HydrophobicContact CG2-CD2 4.21Å; V744-W752 HydrophobicContact CG2-CE3 4.19Å; V744-W752 HydrophobicContact CG2-CH2 3.6Å; V744-W752 HydrophobicContact CG2-CZ2 3.61Å; V744-W752 HydrophobicContact CG2-CZ3 3.89Å; V744-W752 PolarHBondContact N-O 2.98Å; V744-W752 PolarHBondContact O-N 3.06Å; V744-W752 VanDerWaalsContact O-N 3.09Å; V744-V822 HydrophobicContact CG1-CG1 3.96Å; V744-V822 HydrophobicContact CG1-CG2 4.08Å; V744-N824 CarbonylContact C-O 3.58Å; V744-N824 WeakPolarHBondContact CA-O 3.38Å; V744-V825 HydrophobicContact CG1-CG2 4.23Å; V744-V825 HydrophobicContact CG2-CG1 4.08Å; V744-V825 HydrophobicContact CG2-CG2 4.17Å
745	K	90.3	Very high	89.2	Confident	93 Å²	93	64 Å²	64	40%	0.404	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	124.2	170.8	-63.1	-169.3	176.9	-156.3	0	109.1	E751 V822 K823 N824	K745-E751 WeakPolarHBondContact CE-OE1 3.45Å; K745-E751 WeakPolarHBondContact CE-OE2 3.32Å; K745-E751 HydrophobicContact CG-CG 3.91Å; K745-E751 WeakPolarHBondContact CG-OE1 3.44Å; K745-E751 WeakPolarHBondContact CG-OE2 3.21Å; K745-E751 IonicContact NZ-OE2 3.09Å; K745-E751 PolarHBondContact NZ-OE2 2.85Å; K745-V822 CarbonylContact O-C 3.58Å; K745-K823 HydrophobicContact CB-CB 4.25Å; K745-K823 PolarHBondContact O-N 2.87Å; K745-N824 HydrophobicContact CB-CB 4.14Å; K745-N824 HydrophobicContact CG-CB 4.25Å; K745-N824 PolarHBondContact N-O 3.1Å; K745-N824 PolarHBondContact O-N 3.05Å; K745-N824 VanDerWaalsContact O-N 3.09Å
746	M	88	Confident	89.6	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	-179.7	177.2	-56.2	-89.7	-56.9	0	0	110.9	L724 V744 K750 W752 I817 P818 G819 R821 V822 K823	L724-M746 HydrophobicContact CD2-CE 4.33Å; V744-M746 HydrophobicContact CG1-CG 4.24Å; V744-M746 HydrophobicContact CG1-SD 3.65Å; M746-K750 WeakPolarHBondContact CA-O 3.32Å; M746-K750 HydrophobicContact CB-CB 4.38Å; M746-K750 WeakPolarHBondContact CB-O 3.41Å; M746-K750 PolarHBondContact N-O 2.9Å; M746-W752 VanDerWaalsContact SD-CD1 3.53Å; M746-W752 PolarHBondContact SD-NE1 3.14Å; M746-W752 VanDerWaalsContact SD-NE1 3.43Å; M746-I817 HydrophobicContact CE-CD1 4.34Å; M746-I817 HydrophobicContact SD-CB 4.34Å; M746-P818 HydrophobicContact CG-CG 4.35Å; M746-P818 HydrophobicContact SD-CG 3.98Å; M746-G819 VanDerWaalsContact CE-C 3.42Å; M746-G819 WeakPolarHBondContact CE-O 3.39Å; M746-G819 PolarHBondContact SD-N 3.32Å; M746-G819 VanDerWaalsContact SD-N 3.37Å; M746-R821 CarbonylContact C-O 3.52Å; M746-R821 VanDerWaalsContact CA-O 3.24Å; M746-R821 WeakPolarHBondContact CA-O 3.22Å; M746-R821 VanDerWaalsContact CB-O 3.3Å; M746-R821 WeakPolarHBondContact CB-O 3.32Å; M746-R821 WeakPolarHBondContact CE-O 3.35Å; M746-V822 HydrophobicContact CE-CG2 4.11Å; M746-V822 HydrophobicContact SD-CB 4.44Å; M746-V822 HydrophobicContact SD-CG2 3.71Å; M746-K823 WeakPolarHBondContact O-CD 3.29Å; M746-K823 WeakPolarHBondContact O-CG 3.23Å
747	E	82.9	Confident	89.8	Confident	55.6667 Å²	55.6667	46.7 Å²	46.7	26%	0.26	21%	0.209	S	C	.	.	G	3₁₀ helix	trans	-60.6	157.7	165.1	70.2	-158	161.9	0	0	112.6	D749 K750 L820 R821	E747-D749 PolarHBondContact O-N 2.97Å; E747-D749 VanDerWaalsContact O-N 3.15Å; E747-K750 PolarHBondContact O-N 2.77Å; E747-L820 VanDerWaalsContact OE1-CA 3.3Å; E747-L820 WeakPolarHBondContact OE1-CA 3.32Å; E747-L820 VanDerWaalsContact OE1-CB 3.26Å; E747-L820 WeakPolarHBondContact OE1-CB 3.32Å; E747-L820 PolarHBondContact OE1-N 3.06Å; E747-R821 HydrophobicContact CB-CB 4.26Å; E747-R821 HydrophobicContact CG-CB 4.43Å; E747-R821 PolarHBondContact N-O 3.09Å; E747-R821 PolarHBondContact OE1-N 2.8Å; E747-R821 VanDerWaalsContact OE2-CB 3.24Å; E747-R821 WeakPolarHBondContact OE2-CB 3.31Å; E747-R821 PolarHBondContact OE2-N 2.82Å
748	N	79.9	Confident	89.9	Confident	127.333 Å²	127.333	47.2 Å²	47.2	68%	0.681	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	54.4	33.3	-178.3	-54.6	8.7	0	0	0	113.6	K750	N748-K750 WeakPolarHBondContact O-CG 3.28Å; N748-K750 PolarHBondContact O-N 3.1Å
749	D	75.4	Confident	89.7	Confident	121 Å²	121	43.7 Å²	43.7	65%	0.647	21%	0.206	S	C	*	.	G	3₁₀ helix	trans	58.5	20.1	171.2	-55.3	-58.9	0	0	0	115.2	E747 K823	E747-D749 PolarHBondContact O-N 2.97Å; E747-D749 VanDerWaalsContact O-N 3.15Å; D749-K823 IonicContact OD1-NZ 2.79Å; D749-K823 PolarHBondContact OD1-NZ 2.92Å; D749-K823 IonicContact OD2-NZ 2.9Å; D749-K823 PolarHBondContact OD2-NZ 3.45Å
750	K	86.3	Confident	89.4	Confident	90.6667 Å²	90.6667	46.4 Å²	46.4	39%	0.394	22%	0.224	S	C	.	.			trans	-77.3	141.5	168.9	-53.5	179.7	-179	-172.3	0	109.6	M746 E747 N748 P818	M746-K750 WeakPolarHBondContact CA-O 3.32Å; M746-K750 HydrophobicContact CB-CB 4.38Å; M746-K750 WeakPolarHBondContact CB-O 3.41Å; M746-K750 PolarHBondContact N-O 2.9Å; E747-K750 PolarHBondContact O-N 2.77Å; N748-K750 WeakPolarHBondContact O-CG 3.28Å; N748-K750 PolarHBondContact O-N 3.1Å; K750-P818 HydrophobicContact CB-CB 3.94Å; K750-P818 HydrophobicContact CB-CG 4.07Å; K750-P818 HydrophobicContact CD-CB 3.89Å; K750-P818 VanDerWaalsContact CD-O 3.25Å; K750-P818 WeakPolarHBondContact CD-O 3.38Å; K750-P818 HydrophobicContact CG-CB 4.4Å; K750-P818 PolarHBondContact NZ-O 2.95Å
751	E	90.4	Very high	89.2	Confident	10.3333 Å²	10.3333	50.5 Å²	50.5	5%	0.048	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	150	-177.6	-156.3	174.3	179.6	0	0	110.4	R743 V744 K745 Q767 L768 W773	R743-E751 WeakPolarHBondContact CD-OE1 3.47Å; R743-E751 HydrophobicContact CG-CG 4.22Å; R743-E751 VanDerWaalsContact CG-OE1 3.28Å; R743-E751 WeakPolarHBondContact CG-OE1 3.37Å; R743-E751 IonicContact CZ-OE1 3.16Å; R743-E751 IonicContact CZ-OE2 2.77Å; R743-E751 IonicContact NE-OE1 3.16Å; R743-E751 PolarHBondContact NE-OE1 3.01Å; R743-E751 IonicContact NE-OE2 3.32Å; R743-E751 PolarHBondContact NE-OE2 2.67Å; R743-E751 VanDerWaalsContact NE-OE2 3.1Å; R743-E751 IonicContact NH2-OE1 3.73Å; R743-E751 IonicContact NH2-OE2 3.33Å; R743-E751 PolarHBondContact NH2-OE2 2.86Å; V744-E751 WeakPolarHBondContact O-CA 3.27Å; V744-E751 WeakPolarHBondContact O-CG 3.36Å; K745-E751 WeakPolarHBondContact CE-OE1 3.45Å; K745-E751 WeakPolarHBondContact CE-OE2 3.32Å; K745-E751 HydrophobicContact CG-CG 3.91Å; K745-E751 WeakPolarHBondContact CG-OE1 3.44Å; K745-E751 WeakPolarHBondContact CG-OE2 3.21Å; K745-E751 IonicContact NZ-OE2 3.09Å; K745-E751 PolarHBondContact NZ-OE2 2.85Å; E751-Q767 WeakPolarHBondContact O-CG 3.18Å; E751-L768 HydrophobicContact CB-CB 3.77Å; E751-L768 HydrophobicContact CB-CD2 3.85Å; E751-L768 HydrophobicContact CB-CG 4.42Å; E751-L768 WeakPolarHBondContact O-CB 3.23Å; E751-L768 PolarHBondContact O-N 3.36Å; E751-W773 HydrophobicContact CB-CH2 4.13Å; E751-W773 HydrophobicContact CG-CH2 3.9Å; E751-W773 HydrophobicContact CG-CZ2 4.43Å; E751-W773 WeakPolarHBondContact OE1-CH2 3.43Å; E751-W773 WeakPolarHBondContact OE1-CZ2 3.36Å; E751-W773 WeakPolarHBondContact OE2-CZ2 3.4Å
752	W	91.7	Very high	89	Confident	0 Å²	0	52 Å²	52	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	158.2	168.5	59.4	-86.7	0	0	0	110.4	I727 M742 V744 M746 F765 S766 Q767 V795 I817 P818	I727-W752 HydrophobicContact CD1-CH2 4.01Å; I727-W752 HydrophobicContact CD1-CZ2 3.75Å; M742-W752 HydrophobicContact CE-CH2 4.19Å; M742-W752 HydrophobicContact CE-CZ3 4.17Å; V744-W752 HydrophobicContact CB-CD2 3.87Å; V744-W752 HydrophobicContact CB-CE3 4.32Å; V744-W752 HydrophobicContact CB-CG 4.34Å; V744-W752 HydrophobicContact CB-CH2 4.2Å; V744-W752 HydrophobicContact CB-CZ2 3.73Å; V744-W752 HydrophobicContact CB-CZ3 4.46Å; V744-W752 HydrophobicContact CG1-CD2 4.49Å; V744-W752 HydrophobicContact CG1-CZ2 3.75Å; V744-W752 HydrophobicContact CG2-CD2 4.21Å; V744-W752 HydrophobicContact CG2-CE3 4.19Å; V744-W752 HydrophobicContact CG2-CH2 3.6Å; V744-W752 HydrophobicContact CG2-CZ2 3.61Å; V744-W752 HydrophobicContact CG2-CZ3 3.89Å; V744-W752 PolarHBondContact N-O 2.98Å; V744-W752 PolarHBondContact O-N 3.06Å; V744-W752 VanDerWaalsContact O-N 3.09Å; M746-W752 VanDerWaalsContact SD-CD1 3.53Å; M746-W752 PolarHBondContact SD-NE1 3.14Å; M746-W752 VanDerWaalsContact SD-NE1 3.43Å; W752-F765 HydrophobicContact CB-CE1 4.46Å; W752-F765 HydrophobicContact CB-CZ 4.13Å; W752-F765 AromaticContact CD2-CE2 3.92Å; W752-F765 HydrophobicContact CD2-CE2 3.98Å; W752-F765 AromaticContact CD2-CZ 3.94Å; W752-F765 HydrophobicContact CD2-CZ 3.94Å; W752-F765 HydrophobicContact CE3-CD1 4.13Å; W752-F765 HydrophobicContact CE3-CD2 4.2Å; W752-F765 AromaticContact CE3-CE1 3.62Å; W752-F765 HydrophobicContact CE3-CE1 3.62Å; W752-F765 AromaticContact CE3-CE2 3.32Å; W752-F765 HydrophobicContact CE3-CE2 3.32Å; W752-F765 AromaticContact CE3-CZ 3.75Å; W752-F765 HydrophobicContact CE3-CZ 3.75Å; W752-F765 HydrophobicContact CG-CZ 4.15Å; W752-F765 HydrophobicContact CH2-CE1 4.42Å; W752-F765 HydrophobicContact CZ3-CD1 4.46Å; W752-F765 HydrophobicContact CZ3-CD2 4.48Å; W752-F765 AromaticContact CZ3-CE1 3.58Å; W752-F765 HydrophobicContact CZ3-CE1 3.58Å; W752-F765 AromaticContact CZ3-CE2 3.7Å; W752-F765 HydrophobicContact CZ3-CE2 3.7Å; W752-F765 HydrophobicContact CZ3-CZ 4.36Å; W752-S766 CarbonylContact C-O 3.51Å; W752-S766 VanDerWaalsContact CA-O 3.27Å; W752-S766 WeakPolarHBondContact CA-O 3.37Å; W752-S766 WeakPolarHBondContact CB-O 3.27Å; W752-Q767 HydrophobicContact CB-CG 4.37Å; W752-V795 HydrophobicContact CH2-CB 4.39Å; W752-V795 HydrophobicContact CH2-CG1 4.03Å; W752-V795 HydrophobicContact CH2-CG2 4.12Å; W752-V795 HydrophobicContact CZ3-CG2 4.49Å; W752-I817 HydrophobicContact CD2-CG2 4.45Å; W752-I817 HydrophobicContact CZ2-CG2 4.21Å; W752-P818 HydrophobicContact CB-CG 4.41Å; W752-P818 HydrophobicContact CG-CG 4.42Å
753	K	92.2	Very high	89	Confident	27.6667 Å²	27.6667	51.9 Å²	51.9	12%	0.12	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	138.3	-174.7	-167.7	-171.3	174.6	-159.3	0	109	Y739 Y741 M742 R743 E755 F765 S766 W773	Y739-K753 WeakPolarHBondContact OH-CE 3.41Å; Y739-K753 PolarHBondContact OH-NZ 2.78Å; Y741-K753 HydrophobicContact CD2-CD 4.26Å; Y741-K753 VanDerWaalsContact CD2-CE 3.43Å; Y741-K753 HydrophobicContact CD2-CG 4.13Å; Y741-K753 VanDerWaalsContact CG-CE 3.47Å; M742-K753 CarbonylContact O-C 3.54Å; M742-K753 WeakPolarHBondContact O-CA 3.42Å; R743-K753 HydrophobicContact CB-CG 4.33Å; R743-K753 HydrophobicContact CG-CB 4.45Å; R743-K753 HydrophobicContact CG-CG 4.37Å; K753-E755 HydrophobicContact CB-CG 4.43Å; K753-E755 HydrophobicContact CD-CG 3.72Å; K753-E755 VanDerWaalsContact CE-OE1 3.29Å; K753-E755 WeakPolarHBondContact CE-OE1 3.06Å; K753-E755 HydrophobicContact CG-CG 3.87Å; K753-E755 VanDerWaalsContact NZ-CD 3.27Å; K753-E755 IonicContact NZ-OE1 2.68Å; K753-E755 PolarHBondContact NZ-OE1 2.94Å; K753-E755 IonicContact NZ-OE2 3.48Å; K753-F765 WeakPolarHBondContact O-CA 3.02Å; K753-S766 PolarHBondContact N-O 3.01Å; K753-S766 PolarHBondContact O-N 2.74Å; K753-W773 HydrophobicContact CB-CE3 4.14Å; K753-W773 HydrophobicContact CB-CH2 3.79Å; K753-W773 HydrophobicContact CB-CZ3 3.47Å; K753-W773 VanDerWaalsContact CB-CZ3 3.43Å
754	L	92.9	Very high	88.9	Confident	2.66667 Å²	2.66667	48.6 Å²	48.6	1%	0.014	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	126.6	166.4	174.9	67	0	0	0	107.1	Y741 M742 W763 T764 F765 F779 V804	Y741-L754 CarbonylContact C-O 3.53Å; Y741-L754 WeakPolarHBondContact CA-O 3.15Å; Y741-L754 VanDerWaalsContact CB-O 3.31Å; Y741-L754 WeakPolarHBondContact CB-O 3.35Å; M742-L754 HydrophobicContact CB-CB 4.48Å; M742-L754 HydrophobicContact CE-CB 4.39Å; M742-L754 HydrophobicContact CE-CD2 4.05Å; M742-L754 PolarHBondContact N-O 3.05Å; M742-L754 PolarHBondContact O-N 2.91Å; L754-W763 HydrophobicContact CD1-CE3 4.12Å; L754-W763 HydrophobicContact CD2-CE3 4.35Å; L754-W763 HydrophobicContact CD2-CZ3 4.22Å; L754-W763 HydrophobicContact CG-CE3 4.27Å; L754-W763 HydrophobicContact CG-CZ3 4.48Å; L754-T764 CarbonylContact C-O 3.54Å; L754-T764 WeakPolarHBondContact CA-O 3.18Å; L754-T764 WeakPolarHBondContact CD1-O 2.81Å; L754-F765 HydrophobicContact CB-CE1 4.49Å; L754-F765 HydrophobicContact CD1-CD2 4.2Å; L754-F765 HydrophobicContact CD1-CE2 4.23Å; L754-F765 HydrophobicContact CD1-CG 4.36Å; L754-F765 HydrophobicContact CD1-CZ 4.41Å; L754-F779 HydrophobicContact CD1-CE1 4.28Å; L754-F779 HydrophobicContact CD1-CZ 3.9Å; L754-V804 HydrophobicContact CD1-CG1 4.41Å; L754-V804 HydrophobicContact CD1-CG2 4.14Å; L754-V804 HydrophobicContact CD2-CG1 3.79Å; L754-V804 HydrophobicContact CD2-CG2 4Å
755	E	93	Very high	88.9	Confident	21.3333 Å²	21.3333	48.7 Å²	48.7	10%	0.1	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	140.8	-174.9	-43.9	176.8	75.7	0	0	108.4	Y739 K753 W763 T764 S766	Y739-E755 HydrophobicContact CE2-CB 4.25Å; Y739-E755 HydrophobicContact CE2-CG 4.38Å; K753-E755 HydrophobicContact CB-CG 4.43Å; K753-E755 HydrophobicContact CD-CG 3.72Å; K753-E755 VanDerWaalsContact CE-OE1 3.29Å; K753-E755 WeakPolarHBondContact CE-OE1 3.06Å; K753-E755 HydrophobicContact CG-CG 3.87Å; K753-E755 VanDerWaalsContact NZ-CD 3.27Å; K753-E755 IonicContact NZ-OE1 2.68Å; K753-E755 PolarHBondContact NZ-OE1 2.94Å; K753-E755 IonicContact NZ-OE2 3.48Å; E755-W763 CarbonylContact O-C 3.54Å; E755-W763 WeakPolarHBondContact O-CA 3.35Å; E755-T764 VanDerWaalsContact CB-OG1 3.29Å; E755-T764 WeakPolarHBondContact CB-OG1 3.27Å; E755-T764 VanDerWaalsContact CD-OG1 3.22Å; E755-T764 VanDerWaalsContact CG-OG1 3.27Å; E755-T764 WeakPolarHBondContact CG-OG1 3.33Å; E755-T764 PolarHBondContact N-O 2.82Å; E755-T764 PolarHBondContact O-N 3.13Å; E755-T764 PolarHBondContact OE2-OG1 3.24Å; E755-S766 WeakPolarHBondContact OE2-CB 3.21Å; E755-S766 PolarHBondContact OE2-OG 3.31Å
756	A	93.3	Very high	88.8	Confident	0.666667 Å²	0.666667	44.3 Å²	44.3	1%	0.006	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	105.9	-176.9	0	0	0	0	0	109.7	Y739 F740 L758 W763	Y739-A756 WeakPolarHBondContact CA-O 3.15Å; F740-A756 HydrophobicContact CD1-CB 3.98Å; F740-A756 HydrophobicContact CD2-CB 4.35Å; F740-A756 HydrophobicContact CE1-CB 3.67Å; F740-A756 HydrophobicContact CE2-CB 3.99Å; F740-A756 HydrophobicContact CG-CB 4.38Å; F740-A756 HydrophobicContact CZ-CB 3.81Å; F740-A756 PolarHBondContact N-O 3.08Å; F740-A756 VanDerWaalsContact N-O 3.12Å; F740-A756 PolarHBondContact O-N 3.16Å; A756-L758 HydrophobicContact CB-CD2 4.44Å; A756-W763 HydrophobicContact CB-CD2 3.62Å; A756-W763 HydrophobicContact CB-CE3 3.69Å; A756-W763 HydrophobicContact CB-CG 4.29Å; A756-W763 HydrophobicContact CB-CH2 3.91Å; A756-W763 HydrophobicContact CB-CZ2 3.82Å; A756-W763 HydrophobicContact CB-CZ3 3.84Å
757	H	92.7	Very high	88.8	Confident	57.3333 Å²	57.3333	45.1 Å²	45.1	27%	0.265	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	102.9	174.9	-66.4	-109.4	0	0	0	107.7	Y739 D760 K761 E762	Y739-H757 AromaticContact CD2-CD2 3.88Å; Y739-H757 AromaticContact CD2-CE1 3.68Å; Y739-H757 AromaticContact CD2-NE2 3.56Å; Y739-H757 AromaticContact CE2-CE1 3.99Å; Y739-H757 AromaticContact CE2-NE2 3.6Å; H757-D760 HydrophobicContact CB-CB 4.33Å; H757-D760 IonicContact ND1-OD2 3.37Å; H757-K761 CarbonylContact O-C 3.58Å; H757-K761 VanDerWaalsContact O-CA 3.28Å; H757-K761 WeakPolarHBondContact O-CA 3.13Å; H757-K761 PolarHBondContact O-N 3.25Å; H757-E762 WeakPolarHBondContact CA-O 3.25Å; H757-E762 HydrophobicContact CB-CB 4.46Å; H757-E762 WeakPolarHBondContact CB-O 3.26Å; H757-E762 PolarHBondContact N-O 3.19Å; H757-E762 PolarHBondContact O-N 2.96Å; H757-E762 VanDerWaalsContact O-N 3.11Å
758	L	90.5	Very high	89	Confident	17.6667 Å²	17.6667	44.5 Å²	44.5	9%	0.092	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-27.3	-169.6	-62.1	179.9	0	0	0	113.1	L733 P737 R738 F740 A756 L783	L733-L758 HydrophobicContact CD1-CD1 3.81Å; L733-L758 HydrophobicContact CD2-CD1 4.37Å; P737-L758 HydrophobicContact CB-CD1 3.82Å; P737-L758 HydrophobicContact CG-CD1 3.83Å; R738-L758 WeakPolarHBondContact O-CB 3.14Å; R738-L758 PolarHBondContact O-N 3.03Å; F740-L758 HydrophobicContact CD1-CD1 4.08Å; F740-L758 HydrophobicContact CD1-CG 4.45Å; F740-L758 HydrophobicContact CE1-CD1 4.12Å; F740-L758 HydrophobicContact CE1-CD2 4.13Å; F740-L758 HydrophobicContact CE1-CG 4.31Å; A756-L758 HydrophobicContact CB-CD2 4.44Å; L758-L783 HydrophobicContact CD1-CD2 4.47Å; L758-L783 HydrophobicContact CD2-CB 3.99Å; L758-L783 HydrophobicContact CD2-CD2 3.96Å
759	D	86.7	Confident	88.8	Confident	99 Å²	99	41.3 Å²	41.3	53%	0.529	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-49.8	173.8	-67.6	-22.8	0	0	0	110	R738 K761	R738-D759 WeakPolarHBondContact CB-OD2 3.19Å; R738-D759 WeakPolarHBondContact CD-OD2 3.34Å; R738-D759 WeakPolarHBondContact CG-OD2 3.33Å; R738-D759 IonicContact NE-OD2 3.28Å; R738-D759 PolarHBondContact NE-OD2 3.11Å; D759-K761 VanDerWaalsContact C-N 3.28Å; D759-K761 PolarHBondContact O-N 3.42Å
760	D	86.4	Confident	88.6	Confident	119.333 Å²	119.333	42.5 Å²	42.5	64%	0.638	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79	-10.9	-180	-48.8	-64.3	0	0	0	113.9	H757 E762	H757-D760 HydrophobicContact CB-CB 4.33Å; H757-D760 IonicContact ND1-OD2 3.37Å; D760-E762 HydrophobicContact CB-CB 4.35Å; D760-E762 PolarHBondContact O-N 3.18Å
761	K	90.2	Very high	88	Confident	87.3333 Å²	87.3333	46.8 Å²	46.8	38%	0.38	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.2	14.9	-173.4	-49.9	172.9	179.3	-168.1	0	114.1	H757 D759 A780 Y781 E782	H757-K761 CarbonylContact O-C 3.58Å; H757-K761 VanDerWaalsContact O-CA 3.28Å; H757-K761 WeakPolarHBondContact O-CA 3.13Å; H757-K761 PolarHBondContact O-N 3.25Å; D759-K761 VanDerWaalsContact C-N 3.28Å; D759-K761 PolarHBondContact O-N 3.42Å; K761-A780 CarbonylContact O-C 3.52Å; K761-A780 WeakPolarHBondContact O-CA 3.41Å; K761-Y781 CarbonylContact O-C 3.43Å; K761-Y781 PolarHBondContact O-N 2.85Å; K761-E782 HydrophobicContact CD-CB 4.09Å; K761-E782 HydrophobicContact CD-CG 4.16Å; K761-E782 VanDerWaalsContact CE-CD 3.42Å; K761-E782 VanDerWaalsContact CE-OE1 3.3Å; K761-E782 WeakPolarHBondContact CE-OE1 3.18Å; K761-E782 WeakPolarHBondContact CE-OE2 3.34Å; K761-E782 HydrophobicContact CG-CB 4.37Å; K761-E782 HydrophobicContact CG-CG 4.47Å; K761-E782 IonicContact NZ-OE1 3.33Å; K761-E782 PolarHBondContact NZ-OE1 3.21Å; K761-E782 IonicContact NZ-OE2 2.87Å; K761-E782 PolarHBondContact NZ-OE2 3.16Å
762	E	89.4	Confident	87.3	Confident	80.6667 Å²	80.6667	51.6 Å²	51.6	38%	0.377	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	136.8	-178.7	-172.7	174.7	173	0	0	111.9	H757 D760 T764 P778	H757-E762 WeakPolarHBondContact CA-O 3.25Å; H757-E762 HydrophobicContact CB-CB 4.46Å; H757-E762 WeakPolarHBondContact CB-O 3.26Å; H757-E762 PolarHBondContact N-O 3.19Å; H757-E762 PolarHBondContact O-N 2.96Å; H757-E762 VanDerWaalsContact O-N 3.11Å; D760-E762 HydrophobicContact CB-CB 4.35Å; D760-E762 PolarHBondContact O-N 3.18Å; E762-T764 HydrophobicContact CG-CG2 4.33Å; E762-T764 VanDerWaalsContact OE1-CG2 3.27Å; E762-T764 WeakPolarHBondContact OE1-CG2 3.43Å; E762-P778 VanDerWaalsContact CD-CB 3.42Å; E762-P778 HydrophobicContact CG-CB 4.01Å; E762-P778 VanDerWaalsContact OE1-CB 3.24Å; E762-P778 WeakPolarHBondContact OE1-CB 3.22Å; E762-P778 WeakPolarHBondContact OE1-CG 3.28Å
763	W	93	Very high	86.7	Confident	0.333333 Å²	0.333333	55.4 Å²	55.4	0%	0.001	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	136.5	169.9	-67.5	58.1	0	0	0	109.3	F740 L754 E755 A756 P778 F779 Y781 L793 V806 I811	F740-W763 HydrophobicContact CE1-CH2 4.3Å; F740-W763 HydrophobicContact CE1-CZ2 4.45Å; F740-W763 HydrophobicContact CE2-CH2 4.35Å; F740-W763 AromaticContact CZ-CH2 3.71Å; F740-W763 HydrophobicContact CZ-CH2 3.71Å; F740-W763 HydrophobicContact CZ-CZ2 4.31Å; F740-W763 HydrophobicContact CZ-CZ3 4.29Å; L754-W763 HydrophobicContact CD1-CE3 4.12Å; L754-W763 HydrophobicContact CD2-CE3 4.35Å; L754-W763 HydrophobicContact CD2-CZ3 4.22Å; L754-W763 HydrophobicContact CG-CE3 4.27Å; L754-W763 HydrophobicContact CG-CZ3 4.48Å; E755-W763 CarbonylContact O-C 3.54Å; E755-W763 WeakPolarHBondContact O-CA 3.35Å; A756-W763 HydrophobicContact CB-CD2 3.62Å; A756-W763 HydrophobicContact CB-CE3 3.69Å; A756-W763 HydrophobicContact CB-CG 4.29Å; A756-W763 HydrophobicContact CB-CH2 3.91Å; A756-W763 HydrophobicContact CB-CZ2 3.82Å; A756-W763 HydrophobicContact CB-CZ3 3.84Å; W763-P778 CarbonylContact O-C 3.52Å; W763-P778 VanDerWaalsContact O-CA 3.3Å; W763-P778 WeakPolarHBondContact O-CA 3.38Å; W763-F779 HydrophobicContact CB-CD1 4.17Å; W763-F779 HydrophobicContact CB-CD2 3.94Å; W763-F779 HydrophobicContact CB-CE1 3.92Å; W763-F779 HydrophobicContact CB-CE2 3.53Å; W763-F779 VanDerWaalsContact CB-CE2 3.44Å; W763-F779 HydrophobicContact CB-CG 4.32Å; W763-F779 HydrophobicContact CB-CZ 3.53Å; W763-F779 VanDerWaalsContact CB-CZ 3.48Å; W763-F779 HydrophobicContact CG-CE2 4.16Å; W763-F779 HydrophobicContact CG-CZ 4.36Å; W763-F779 PolarHBondContact N-O 2.82Å; W763-F779 VanDerWaalsContact O-CD1 3.24Å; W763-F779 WeakPolarHBondContact O-CD1 3.43Å; W763-F779 WeakPolarHBondContact O-CE1 3.29Å; W763-F779 PolarHBondContact O-N 2.82Å; W763-Y781 AromaticContact CE2-CD1 3.83Å; W763-Y781 AromaticContact CZ2-CD1 3.83Å; W763-Y781 HydrophobicContact CZ2-CD1 3.83Å; W763-Y781 HydrophobicContact CZ2-CE1 4.34Å; W763-Y781 AromaticContact NE1-CD1 3.75Å; W763-Y781 PolarHBondContact NE1-O 2.95Å; W763-L793 HydrophobicContact CH2-CD2 3.88Å; W763-L793 HydrophobicContact CZ3-CD2 4.04Å; W763-V806 HydrophobicContact CH2-CG2 3.82Å; W763-V806 HydrophobicContact CZ2-CG2 4.46Å; W763-V806 HydrophobicContact CZ3-CG2 4.16Å; W763-I811 HydrophobicContact CD2-CD1 3.93Å; W763-I811 HydrophobicContact CE3-CD1 3.89Å; W763-I811 HydrophobicContact CG-CD1 4.35Å; W763-I811 HydrophobicContact CH2-CD1 4.27Å; W763-I811 HydrophobicContact CZ2-CD1 4.32Å; W763-I811 HydrophobicContact CZ3-CD1 4.06Å
764	T	90.1	Very high	85.9	Confident	9 Å²	9	58.3 Å²	58.3	6%	0.055	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	140.2	-179.2	38.9	0	0	0	0	110.9	L754 E755 E762 R776 P778	L754-T764 CarbonylContact C-O 3.54Å; L754-T764 WeakPolarHBondContact CA-O 3.18Å; L754-T764 WeakPolarHBondContact CD1-O 2.81Å; E755-T764 VanDerWaalsContact CB-OG1 3.29Å; E755-T764 WeakPolarHBondContact CB-OG1 3.27Å; E755-T764 VanDerWaalsContact CD-OG1 3.22Å; E755-T764 VanDerWaalsContact CG-OG1 3.27Å; E755-T764 WeakPolarHBondContact CG-OG1 3.33Å; E755-T764 PolarHBondContact N-O 2.82Å; E755-T764 PolarHBondContact O-N 3.13Å; E755-T764 PolarHBondContact OE2-OG1 3.24Å; E762-T764 HydrophobicContact CG-CG2 4.33Å; E762-T764 VanDerWaalsContact OE1-CG2 3.27Å; E762-T764 WeakPolarHBondContact OE1-CG2 3.43Å; T764-R776 HydrophobicContact CG2-CB 4.03Å; T764-R776 HydrophobicContact CG2-CG 3.95Å; T764-P778 HydrophobicContact CG2-CB 4.31Å
765	F	90.7	Very high	84.7	Confident	1 Å²	1	63.3 Å²	63.3	0%	0.004	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	123.2	164.9	-151.4	-80	0	0	0	109.2	W752 K753 L754 Q767 R776 L777 F779 V804 Y815 I817	W752-F765 HydrophobicContact CB-CE1 4.46Å; W752-F765 HydrophobicContact CB-CZ 4.13Å; W752-F765 AromaticContact CD2-CE2 3.92Å; W752-F765 HydrophobicContact CD2-CE2 3.98Å; W752-F765 AromaticContact CD2-CZ 3.94Å; W752-F765 HydrophobicContact CD2-CZ 3.94Å; W752-F765 HydrophobicContact CE3-CD1 4.13Å; W752-F765 HydrophobicContact CE3-CD2 4.2Å; W752-F765 AromaticContact CE3-CE1 3.62Å; W752-F765 HydrophobicContact CE3-CE1 3.62Å; W752-F765 AromaticContact CE3-CE2 3.32Å; W752-F765 HydrophobicContact CE3-CE2 3.32Å; W752-F765 AromaticContact CE3-CZ 3.75Å; W752-F765 HydrophobicContact CE3-CZ 3.75Å; W752-F765 HydrophobicContact CG-CZ 4.15Å; W752-F765 HydrophobicContact CH2-CE1 4.42Å; W752-F765 HydrophobicContact CZ3-CD1 4.46Å; W752-F765 HydrophobicContact CZ3-CD2 4.48Å; W752-F765 AromaticContact CZ3-CE1 3.58Å; W752-F765 HydrophobicContact CZ3-CE1 3.58Å; W752-F765 AromaticContact CZ3-CE2 3.7Å; W752-F765 HydrophobicContact CZ3-CE2 3.7Å; W752-F765 HydrophobicContact CZ3-CZ 4.36Å; K753-F765 WeakPolarHBondContact O-CA 3.02Å; L754-F765 HydrophobicContact CB-CE1 4.49Å; L754-F765 HydrophobicContact CD1-CD2 4.2Å; L754-F765 HydrophobicContact CD1-CE2 4.23Å; L754-F765 HydrophobicContact CD1-CG 4.36Å; L754-F765 HydrophobicContact CD1-CZ 4.41Å; F765-Q767 HydrophobicContact CD1-CG 4.38Å; F765-Q767 HydrophobicContact CE1-CG 3.88Å; F765-R776 CarbonylContact O-C 3.51Å; F765-R776 VanDerWaalsContact O-CA 3.25Å; F765-R776 WeakPolarHBondContact O-CA 3.34Å; F765-R776 WeakPolarHBondContact O-CB 3.25Å; F765-R776 PolarHBondContact O-N 3.28Å; F765-L777 HydrophobicContact CB-CB 4.29Å; F765-L777 PolarHBondContact N-O 2.9Å; F765-L777 VanDerWaalsContact N-O 3.11Å; F765-L777 PolarHBondContact O-N 2.84Å; F765-F779 AromaticContact CD2-CE1 3.71Å; F765-F779 HydrophobicContact CD2-CE1 3.71Å; F765-F779 HydrophobicContact CD2-CZ 4.13Å; F765-F779 HydrophobicContact CE2-CE1 4.43Å; F765-F779 HydrophobicContact CE2-CZ 4.44Å; F765-V804 HydrophobicContact CE2-CG2 3.34Å; F765-V804 HydrophobicContact CZ-CG2 3.34Å; F765-Y815 HydrophobicContact CB-CD1 4.38Å; F765-Y815 HydrophobicContact CB-CD2 3.61Å; F765-Y815 HydrophobicContact CB-CE1 4.24Å; F765-Y815 HydrophobicContact CB-CE2 3.53Å; F765-Y815 VanDerWaalsContact CB-CE2 3.47Å; F765-Y815 HydrophobicContact CB-CG 4.04Å; F765-Y815 AromaticContact CD1-CD1 3.74Å; F765-Y815 HydrophobicContact CD1-CD1 4.05Å; F765-Y815 AromaticContact CD1-CD2 3.96Å; F765-Y815 HydrophobicContact CD1-CD2 4.11Å; F765-Y815 HydrophobicContact CD1-CE1 4.09Å; F765-Y815 AromaticContact CD1-CG 3.79Å; F765-Y815 HydrophobicContact CD1-CG 3.79Å; F765-Y815 AromaticContact CD2-CD2 3.55Å; F765-Y815 HydrophobicContact CD2-CD2 3.77Å; F765-Y815 VanDerWaalsContact CD2-CD2 3.48Å; F765-Y815 HydrophobicContact CD2-CE2 4.13Å; F765-Y815 AromaticContact CD2-CG 3.93Å; F765-Y815 HydrophobicContact CD2-CG 4.05Å; F765-Y815 HydrophobicContact CE1-CD1 4.02Å; F765-Y815 HydrophobicContact CE1-CG 4.21Å; F765-Y815 HydrophobicContact CE2-CD2 4.15Å; F765-Y815 HydrophobicContact CE2-CG 4.38Å; F765-Y815 HydrophobicContact CG-CD1 4.23Å; F765-Y815 AromaticContact CG-CD2 3.57Å; F765-Y815 HydrophobicContact CG-CD2 3.57Å; F765-Y815 VanDerWaalsContact CG-CD2 3.45Å; F765-Y815 HydrophobicContact CG-CE1 4.49Å; F765-Y815 AromaticContact CG-CE2 3.86Å; F765-Y815 HydrophobicContact CG-CE2 4Å; F765-Y815 AromaticContact CG-CG 3.7Å; F765-Y815 HydrophobicContact CG-CG 3.7Å; F765-Y815 HydrophobicContact CZ-CG 4.47Å; F765-I817 HydrophobicContact CZ-CG2 4.32Å
766	S	89.3	Confident	83.7	Confident	1.33333 Å²	1.33333	68.8 Å²	68.8	1%	0.009	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	141.5	-175.6	-57.6	0	0	0	0	110.2	W752 K753 E755	W752-S766 CarbonylContact C-O 3.51Å; W752-S766 VanDerWaalsContact CA-O 3.27Å; W752-S766 WeakPolarHBondContact CA-O 3.37Å; W752-S766 WeakPolarHBondContact CB-O 3.27Å; K753-S766 PolarHBondContact N-O 3.01Å; K753-S766 PolarHBondContact O-N 2.74Å; E755-S766 WeakPolarHBondContact OE2-CB 3.21Å; E755-S766 PolarHBondContact OE2-OG 3.31Å
767	Q	88.1	Confident	82.8	Confident	17.6667 Å²	17.6667	73.2 Å²	73.2	8%	0.083	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	140.1	174.3	-94.7	-175.3	0.6	0	0	111	E751 W752 F765 I769 K774 Y815 Q816 P818	E751-Q767 WeakPolarHBondContact O-CG 3.18Å; W752-Q767 HydrophobicContact CB-CG 4.37Å; F765-Q767 HydrophobicContact CD1-CG 4.38Å; F765-Q767 HydrophobicContact CE1-CG 3.88Å; Q767-I769 HydrophobicContact CB-CD1 4.25Å; Q767-I769 HydrophobicContact CB-CG1 4.22Å; Q767-I769 HydrophobicContact CG-CD1 4.4Å; Q767-I769 HydrophobicContact CG-CG1 3.96Å; Q767-I769 PolarHBondContact O-N 3Å; Q767-K774 PolarHBondContact N-O 2.86Å; Q767-K774 PolarHBondContact O-N 3.03Å; Q767-K774 VanDerWaalsContact O-O 3.09Å; Q767-Y815 WeakPolarHBondContact CB-OH 3.33Å; Q767-Q816 PolarHBondContact NE2-O 3.43Å; Q767-P818 HydrophobicContact CG-CB 4.37Å; Q767-P818 HydrophobicContact CG-CG 4.17Å; Q767-P818 VanDerWaalsContact OE1-CD 3.28Å
768	L	86	Confident	82.4	Confident	42.3333 Å²	42.3333	73.8 Å²	73.8	22%	0.222	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	113.1	172	-169.1	72.7	0	0	0	109.3	E751 Q771 E772 W773	E751-L768 HydrophobicContact CB-CB 3.77Å; E751-L768 HydrophobicContact CB-CD2 3.85Å; E751-L768 HydrophobicContact CB-CG 4.42Å; E751-L768 WeakPolarHBondContact O-CB 3.23Å; E751-L768 PolarHBondContact O-N 3.36Å; L768-Q771 VanDerWaalsContact CD1-C 3.48Å; L768-Q771 VanDerWaalsContact CD1-O 3.31Å; L768-Q771 WeakPolarHBondContact CD1-O 3.27Å; L768-E772 WeakPolarHBondContact CA-O 3.24Å; L768-W773 HydrophobicContact CB-CE3 4.41Å; L768-W773 HydrophobicContact CB-CH2 4.08Å; L768-W773 HydrophobicContact CB-CZ2 4.23Å; L768-W773 HydrophobicContact CB-CZ3 4.18Å; L768-W773 HydrophobicContact CD1-CD2 4.14Å; L768-W773 HydrophobicContact CD1-CG 4.38Å; L768-W773 HydrophobicContact CD1-CZ2 4.03Å; L768-W773 HydrophobicContact CG-CZ2 4.41Å
769	I	75.7	Confident	82.3	Confident	60.6667 Å²	60.6667	74 Å²	74	31%	0.311	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	118.5	-179.1	-56.7	179	0	0	0	107.5	Q767 Q771 E772 K774 Q775	Q767-I769 HydrophobicContact CB-CD1 4.25Å; Q767-I769 HydrophobicContact CB-CG1 4.22Å; Q767-I769 HydrophobicContact CG-CD1 4.4Å; Q767-I769 HydrophobicContact CG-CG1 3.96Å; Q767-I769 PolarHBondContact O-N 3Å; I769-Q771 VanDerWaalsContact C-N 3.3Å; I769-Q771 PolarHBondContact O-N 3.06Å; I769-E772 PolarHBondContact N-O 2.93Å; I769-E772 PolarHBondContact O-N 3.22Å; I769-E772 VanDerWaalsContact O-N 3.12Å; I769-E772 VanDerWaalsContact O-O 3.11Å; I769-K774 HydrophobicContact CB-CB 4.23Å; I769-K774 HydrophobicContact CB-CD 4.24Å; I769-K774 HydrophobicContact CB-CG 4.18Å; I769-K774 HydrophobicContact CD1-CB 4.21Å; I769-K774 HydrophobicContact CD1-CD 4.29Å; I769-K774 HydrophobicContact CG1-CB 4.4Å; I769-K774 HydrophobicContact CG2-CD 4.29Å; I769-Q775 HydrophobicContact CD1-CG 3.87Å
770	N	72	Confident	82.2	Confident	144.667 Å²	144.667	73.6 Å²	73.6	77%	0.774	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	45.1	-175.7	-56.1	-0.9	0	0	0	112.7	E772	N770-E772 PolarHBondContact O-N 2.85Å; N770-E772 VanDerWaalsContact O-N 3.07Å
771	Q	73.6	Confident	82.4	Confident	182.667 Å²	182.667	69.1 Å²	69.1	85%	0.854	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.6	-5.1	-174.1	-54.4	-172.6	3.7	0	0	116.3	L768 I769	L768-Q771 VanDerWaalsContact CD1-C 3.48Å; L768-Q771 VanDerWaalsContact CD1-O 3.31Å; L768-Q771 WeakPolarHBondContact CD1-O 3.27Å; I769-Q771 VanDerWaalsContact C-N 3.3Å; I769-Q771 PolarHBondContact O-N 3.06Å
772	E	75	Confident	82.4	Confident	110.333 Å²	110.333	70.6 Å²	70.6	52%	0.516	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	146.5	174.7	-63.3	179.9	134.5	0	0	112.1	L768 I769 N770 K774	L768-E772 WeakPolarHBondContact CA-O 3.24Å; I769-E772 PolarHBondContact N-O 2.93Å; I769-E772 PolarHBondContact O-N 3.22Å; I769-E772 VanDerWaalsContact O-N 3.12Å; I769-E772 VanDerWaalsContact O-O 3.11Å; N770-E772 PolarHBondContact O-N 2.85Å; N770-E772 VanDerWaalsContact O-N 3.07Å; E772-K774 HydrophobicContact CB-CD 4.27Å; E772-K774 HydrophobicContact CB-CG 4.28Å; E772-K774 PolarHBondContact O-N 2.84Å; E772-K774 WeakPolarHBondContact OE2-CE 3.29Å; E772-K774 IonicContact OE2-NZ 3.61Å; E772-K774 PolarHBondContact OE2-NZ 3.25Å
773	W	79.7	Confident	82.4	Confident	80 Å²	80	67.1 Å²	67.1	30%	0.303	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	102.4	174.3	-73.5	96.5	0	0	0	110.6	R743 E751 K753 L768	R743-W773 HydrophobicContact CG-CH2 4.35Å; R743-W773 VanDerWaalsContact NH2-CZ2 3.34Å; E751-W773 HydrophobicContact CB-CH2 4.13Å; E751-W773 HydrophobicContact CG-CH2 3.9Å; E751-W773 HydrophobicContact CG-CZ2 4.43Å; E751-W773 WeakPolarHBondContact OE1-CH2 3.43Å; E751-W773 WeakPolarHBondContact OE1-CZ2 3.36Å; E751-W773 WeakPolarHBondContact OE2-CZ2 3.4Å; K753-W773 HydrophobicContact CB-CE3 4.14Å; K753-W773 HydrophobicContact CB-CH2 3.79Å; K753-W773 HydrophobicContact CB-CZ3 3.47Å; K753-W773 VanDerWaalsContact CB-CZ3 3.43Å; L768-W773 HydrophobicContact CB-CE3 4.41Å; L768-W773 HydrophobicContact CB-CH2 4.08Å; L768-W773 HydrophobicContact CB-CZ2 4.23Å; L768-W773 HydrophobicContact CB-CZ3 4.18Å; L768-W773 HydrophobicContact CD1-CD2 4.14Å; L768-W773 HydrophobicContact CD1-CG 4.38Å; L768-W773 HydrophobicContact CD1-CZ2 4.03Å; L768-W773 HydrophobicContact CG-CZ2 4.41Å
774	K	74.6	Confident	82.2	Confident	88 Å²	88	69.3 Å²	69.3	38%	0.383	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	149.8	-177.3	-67.2	-176.1	175.9	-172	0	110.7	Q767 I769 E772 R776	Q767-K774 PolarHBondContact N-O 2.86Å; Q767-K774 PolarHBondContact O-N 3.03Å; Q767-K774 VanDerWaalsContact O-O 3.09Å; I769-K774 HydrophobicContact CB-CB 4.23Å; I769-K774 HydrophobicContact CB-CD 4.24Å; I769-K774 HydrophobicContact CB-CG 4.18Å; I769-K774 HydrophobicContact CD1-CB 4.21Å; I769-K774 HydrophobicContact CD1-CD 4.29Å; I769-K774 HydrophobicContact CG1-CB 4.4Å; I769-K774 HydrophobicContact CG2-CD 4.29Å; E772-K774 HydrophobicContact CB-CD 4.27Å; E772-K774 HydrophobicContact CB-CG 4.28Å; E772-K774 PolarHBondContact O-N 2.84Å; E772-K774 WeakPolarHBondContact OE2-CE 3.29Å; E772-K774 IonicContact OE2-NZ 3.61Å; E772-K774 PolarHBondContact OE2-NZ 3.25Å; K774-R776 PolarHBondContact O-N 3.42Å
775	Q	68.4	Low	82	Confident	107.333 Å²	107.333	76.8 Å²	76.8	50%	0.502	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	24.5	77	-179	-139	-176.8	-0.5	0	0	112.2	I769 L777	I769-Q775 HydrophobicContact CD1-CG 3.87Å; Q775-L777 HydrophobicContact CG-CD1 4.16Å; Q775-L777 HydrophobicContact CG-CG 4.09Å; Q775-L777 PolarHBondContact O-N 2.89Å; Q775-L777 VanDerWaalsContact O-N 3.16Å
776	R	72.3	Confident	81.7	Confident	136.667 Å²	136.667	86.1 Å²	86.1	52%	0.516	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	128.6	167.6	-69.9	-176.2	173.3	-159.5	-3	109.4	T764 F765 K774 P778 Y815	T764-R776 HydrophobicContact CG2-CB 4.03Å; T764-R776 HydrophobicContact CG2-CG 3.95Å; F765-R776 CarbonylContact O-C 3.51Å; F765-R776 VanDerWaalsContact O-CA 3.25Å; F765-R776 WeakPolarHBondContact O-CA 3.34Å; F765-R776 WeakPolarHBondContact O-CB 3.25Å; F765-R776 PolarHBondContact O-N 3.28Å; K774-R776 PolarHBondContact O-N 3.42Å; R776-P778 WeakPolarHBondContact O-CD 3.39Å; R776-Y815 HydrophobicContact CB-CD1 4.19Å; R776-Y815 HydrophobicContact CB-CE1 3.98Å
777	L	73.9	Confident	81.6	Confident	94 Å²	94	89.4 Å²	89.4	49%	0.492	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	104.8	177.8	-97.5	142.4	0	0	0	109.9	F765 Q775 F779 P813 Y815	F765-L777 HydrophobicContact CB-CB 4.29Å; F765-L777 PolarHBondContact N-O 2.9Å; F765-L777 VanDerWaalsContact N-O 3.11Å; F765-L777 PolarHBondContact O-N 2.84Å; Q775-L777 HydrophobicContact CG-CD1 4.16Å; Q775-L777 HydrophobicContact CG-CG 4.09Å; Q775-L777 PolarHBondContact O-N 2.89Å; Q775-L777 VanDerWaalsContact O-N 3.16Å; L777-F779 WeakPolarHBondContact O-CD1 3.48Å; L777-P813 HydrophobicContact CD2-CB 4.49Å; L777-P813 HydrophobicContact CD2-CG 3.64Å; L777-P813 HydrophobicContact CG-CG 4.27Å; L777-Y815 HydrophobicContact CB-CD1 4.27Å; L777-Y815 HydrophobicContact CB-CD2 4.14Å; L777-Y815 HydrophobicContact CB-CE1 3.58Å; L777-Y815 HydrophobicContact CB-CE2 4.2Å; L777-Y815 HydrophobicContact CD1-CD1 3.51Å; L777-Y815 HydrophobicContact CD1-CE1 3.62Å; L777-Y815 HydrophobicContact CD2-CD2 3.84Å; L777-Y815 HydrophobicContact CG-CE1 4.23Å; L777-Y815 PolarHBondContact O-OH 3.42Å
778	P	83.9	Confident	81.6	Confident	69.6667 Å²	69.6667	90.6 Å²	90.6	45%	0.452	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	154.2	178.7	31	-35.1	0	0	0	111.8	E762 W763 T764 R776	E762-P778 VanDerWaalsContact CD-CB 3.42Å; E762-P778 HydrophobicContact CG-CB 4.01Å; E762-P778 VanDerWaalsContact OE1-CB 3.24Å; E762-P778 WeakPolarHBondContact OE1-CB 3.22Å; E762-P778 WeakPolarHBondContact OE1-CG 3.28Å; W763-P778 CarbonylContact O-C 3.52Å; W763-P778 VanDerWaalsContact O-CA 3.3Å; W763-P778 WeakPolarHBondContact O-CA 3.38Å; T764-P778 HydrophobicContact CG2-CB 4.31Å; R776-P778 WeakPolarHBondContact O-CD 3.39Å
779	F	88.6	Confident	81.4	Confident	21 Å²	21	94.6 Å²	94.6	9%	0.092	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	135.4	176.1	55.9	-77.6	0	0	0	110.2	L754 W763 F765 L777 I811 S812 Y815	L754-F779 HydrophobicContact CD1-CE1 4.28Å; L754-F779 HydrophobicContact CD1-CZ 3.9Å; W763-F779 HydrophobicContact CB-CD1 4.17Å; W763-F779 HydrophobicContact CB-CD2 3.94Å; W763-F779 HydrophobicContact CB-CE1 3.92Å; W763-F779 HydrophobicContact CB-CE2 3.53Å; W763-F779 VanDerWaalsContact CB-CE2 3.44Å; W763-F779 HydrophobicContact CB-CG 4.32Å; W763-F779 HydrophobicContact CB-CZ 3.53Å; W763-F779 VanDerWaalsContact CB-CZ 3.48Å; W763-F779 HydrophobicContact CG-CE2 4.16Å; W763-F779 HydrophobicContact CG-CZ 4.36Å; W763-F779 PolarHBondContact N-O 2.82Å; W763-F779 VanDerWaalsContact O-CD1 3.24Å; W763-F779 WeakPolarHBondContact O-CD1 3.43Å; W763-F779 WeakPolarHBondContact O-CE1 3.29Å; W763-F779 PolarHBondContact O-N 2.82Å; F765-F779 AromaticContact CD2-CE1 3.71Å; F765-F779 HydrophobicContact CD2-CE1 3.71Å; F765-F779 HydrophobicContact CD2-CZ 4.13Å; F765-F779 HydrophobicContact CE2-CE1 4.43Å; F765-F779 HydrophobicContact CE2-CZ 4.44Å; L777-F779 WeakPolarHBondContact O-CD1 3.48Å; F779-I811 VanDerWaalsContact CD2-O 3.31Å; F779-I811 WeakPolarHBondContact CD2-O 3.4Å; F779-I811 HydrophobicContact CE2-CB 4.48Å; F779-I811 HydrophobicContact CE2-CD1 3.79Å; F779-I811 HydrophobicContact CE2-CG1 3.88Å; F779-S812 VanDerWaalsContact CZ-CB 3.45Å; F779-Y815 HydrophobicContact CD1-CE2 4.39Å; F779-Y815 WeakPolarHBondContact CD1-OH 3.15Å; F779-Y815 AromaticContact CE1-CE2 3.9Å; F779-Y815 HydrophobicContact CE1-CE2 3.9Å; F779-Y815 AromaticContact CE1-CZ 3.96Å; F779-Y815 WeakPolarHBondContact CE1-OH 3.41Å; F779-Y815 HydrophobicContact CZ-CE2 4.4Å
780	A	85.3	Confident	81.9	Confident	92 Å²	92	95.5 Å²	95.5	76%	0.76	46%	0.459	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.7	127.1	-178	0	0	0	0	0	111.6	K761	K761-A780 CarbonylContact O-C 3.52Å; K761-A780 WeakPolarHBondContact O-CA 3.41Å
781	Y	90	Very high	82.7	Confident	25.3333 Å²	25.3333	88.7 Å²	88.7	10%	0.099	42%	0.423	C	S	.	.			trans	-148.9	109	169.2	178.7	-105.5	0	0	0	112.3	K761 W763 L783 V806 K809 I811	K761-Y781 CarbonylContact O-C 3.43Å; K761-Y781 PolarHBondContact O-N 2.85Å; W763-Y781 AromaticContact CE2-CD1 3.83Å; W763-Y781 AromaticContact CZ2-CD1 3.83Å; W763-Y781 HydrophobicContact CZ2-CD1 3.83Å; W763-Y781 HydrophobicContact CZ2-CE1 4.34Å; W763-Y781 AromaticContact NE1-CD1 3.75Å; W763-Y781 PolarHBondContact NE1-O 2.95Å; Y781-L783 HydrophobicContact CE1-CB 4.2Å; Y781-L783 HydrophobicContact CE1-CD1 4.18Å; Y781-L783 PolarHBondContact O-N 2.86Å; Y781-V806 HydrophobicContact CE1-CB 4Å; Y781-V806 HydrophobicContact CE1-CG1 3.92Å; Y781-V806 HydrophobicContact CE1-CG2 4.34Å; Y781-K809 HydrophobicContact CE2-CD 4.3Å; Y781-I811 HydrophobicContact CD1-CB 4.43Å; Y781-I811 HydrophobicContact CD1-CD1 3.62Å; Y781-I811 HydrophobicContact CD1-CG2 4.04Å; Y781-I811 HydrophobicContact CD2-CB 3.94Å; Y781-I811 HydrophobicContact CD2-CG2 3.4Å; Y781-I811 VanDerWaalsContact CD2-CG2 3.42Å; Y781-I811 HydrophobicContact CE1-CD1 4.28Å; Y781-I811 HydrophobicContact CE1-CG2 4.07Å; Y781-I811 HydrophobicContact CE2-CB 4.46Å; Y781-I811 HydrophobicContact CE2-CG2 3.44Å; Y781-I811 VanDerWaalsContact CE2-CG2 3.44Å; Y781-I811 HydrophobicContact CG-CB 3.92Å; Y781-I811 HydrophobicContact CG-CD1 3.8Å; Y781-I811 HydrophobicContact CG-CG1 4.48Å; Y781-I811 HydrophobicContact CG-CG2 3.71Å
782	E	90.4	Very high	83.4	Confident	117.667 Å²	117.667	81.3 Å²	81.3	55%	0.55	39%	0.39	S	S	.	.			trans	-72.8	113.9	170.2	-174.7	161	-171	0	0	110.7	K761 P784	K761-E782 HydrophobicContact CD-CB 4.09Å; K761-E782 HydrophobicContact CD-CG 4.16Å; K761-E782 VanDerWaalsContact CE-CD 3.42Å; K761-E782 VanDerWaalsContact CE-OE1 3.3Å; K761-E782 WeakPolarHBondContact CE-OE1 3.18Å; K761-E782 WeakPolarHBondContact CE-OE2 3.34Å; K761-E782 HydrophobicContact CG-CB 4.37Å; K761-E782 HydrophobicContact CG-CG 4.47Å; K761-E782 IonicContact NZ-OE1 3.33Å; K761-E782 PolarHBondContact NZ-OE1 3.21Å; K761-E782 IonicContact NZ-OE2 2.87Å; K761-E782 PolarHBondContact NZ-OE2 3.16Å; E782-P784 VanDerWaalsContact O-CD 3.25Å; E782-P784 WeakPolarHBondContact O-CD 3.43Å
783	L	90.5	Very high	84.2	Confident	7.66667 Å²	7.66667	76.1 Å²	76.1	4%	0.04	37%	0.366	C	S	.	.			trans	-82.1	111.9	175	176.4	64.5	0	0	0	109.9	L733 F740 L758 Y781 K785 Y788 V791 V806	L733-L783 HydrophobicContact CD1-CD2 3.63Å; F740-L783 HydrophobicContact CE1-CD2 4.37Å; L758-L783 HydrophobicContact CD1-CD2 4.47Å; L758-L783 HydrophobicContact CD2-CB 3.99Å; L758-L783 HydrophobicContact CD2-CD2 3.96Å; Y781-L783 HydrophobicContact CE1-CB 4.2Å; Y781-L783 HydrophobicContact CE1-CD1 4.18Å; Y781-L783 PolarHBondContact O-N 2.86Å; L783-K785 PolarHBondContact O-N 2.87Å; L783-Y788 HydrophobicContact CB-CE1 4.45Å; L783-Y788 HydrophobicContact CD2-CD1 4.04Å; L783-Y788 HydrophobicContact CD2-CE1 3.95Å; L783-Y788 HydrophobicContact CG-CD1 4.22Å; L783-Y788 HydrophobicContact CG-CE1 3.99Å; L783-V791 HydrophobicContact CD1-CG1 4.05Å; L783-V791 HydrophobicContact CD1-CG2 4.33Å; L783-V791 HydrophobicContact CD2-CG1 4.23Å; L783-V791 HydrophobicContact CD2-CG2 3.86Å; L783-V806 HydrophobicContact CD1-CG1 3.95Å
784	P	88.2	Confident	84.8	Confident	45.3333 Å²	45.3333	73.4 Å²	73.4	29%	0.294	36%	0.358	S	S	.	.			trans	-66.8	129.8	-175.5	-22.2	34.4	0	0	0	112	E782 R786 Y787	E782-P784 VanDerWaalsContact O-CD 3.25Å; E782-P784 WeakPolarHBondContact O-CD 3.43Å; P784-R786 HydrophobicContact CB-CG 4.27Å; P784-R786 PolarHBondContact O-N 3.19Å; P784-Y787 HydrophobicContact CB-CD2 3.87Å; P784-Y787 HydrophobicContact CB-CE2 4.07Å; P784-Y787 HydrophobicContact CG-CD2 4.05Å; P784-Y787 HydrophobicContact CG-CE2 4.01Å; P784-Y787 WeakPolarHBondContact O-CD2 3.45Å; P784-Y787 PolarHBondContact O-N 3.03Å
785	K	85.1	Confident	85.6	Confident	167 Å²	167	69.3 Å²	69.3	73%	0.726	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	-47.1	-33.3	-174.9	-63.4	-179.2	179.4	174.9	0	114.5	L783 Y787 Y788	L783-K785 PolarHBondContact O-N 2.87Å; K785-Y787 PolarHBondContact O-N 3.12Å; K785-Y787 VanDerWaalsContact O-N 3.09Å; K785-Y788 HydrophobicContact CB-CE1 4.49Å; K785-Y788 HydrophobicContact CB-CE2 4.34Å; K785-Y788 HydrophobicContact CG-CE1 4.35Å; K785-Y788 HydrophobicContact CG-CE2 4.02Å; K785-Y788 WeakPolarHBondContact O-CB 3.38Å; K785-Y788 PolarHBondContact O-N 3.01Å
786	R	85.7	Confident	86.6	Confident	196 Å²	196	67.7 Å²	67.7	74%	0.74	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-55.9	-20.9	175.1	73.3	-174.5	-175	-151.9	2.2	114.9	P784	P784-R786 HydrophobicContact CB-CG 4.27Å; P784-R786 PolarHBondContact O-N 3.19Å
787	Y	86.1	Confident	87.3	Confident	72 Å²	72	61.7 Å²	61.7	28%	0.282	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-96.2	-4.1	178.6	-61.7	-70.9	0	0	0	114.1	P784 K785 N789 N790 V791 N807	P784-Y787 HydrophobicContact CB-CD2 3.87Å; P784-Y787 HydrophobicContact CB-CE2 4.07Å; P784-Y787 HydrophobicContact CG-CD2 4.05Å; P784-Y787 HydrophobicContact CG-CE2 4.01Å; P784-Y787 WeakPolarHBondContact O-CD2 3.45Å; P784-Y787 PolarHBondContact O-N 3.03Å; K785-Y787 PolarHBondContact O-N 3.12Å; K785-Y787 VanDerWaalsContact O-N 3.09Å; Y787-N789 PolarHBondContact O-N 2.88Å; Y787-N789 VanDerWaalsContact O-N 3.13Å; Y787-N790 CarbonylContact O-C 3.52Å; Y787-N790 PolarHBondContact O-N 2.87Å; Y787-N790 VanDerWaalsContact O-O 3.13Å; Y787-V791 WeakPolarHBondContact O-CG2 3.41Å; Y787-V791 PolarHBondContact O-N 3.1Å; Y787-N807 WeakPolarHBondContact CB-ND2 3.46Å; Y787-N807 HydrophobicContact CD1-CB 4.34Å; Y787-N807 WeakPolarHBondContact CD1-ND2 3.27Å; Y787-N807 HydrophobicContact CE1-CB 4.33Å
788	Y	88.5	Confident	87.6	Confident	41.3333 Å²	41.3333	62.9 Å²	62.9	16%	0.162	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-33.8	-175.4	-73.9	5.6	0	0	0	112.8	L733 P737 L783 K785 N790	L733-Y788 WeakPolarHBondContact CA-O 3.36Å; L733-Y788 HydrophobicContact CB-CG 4.26Å; L733-Y788 WeakPolarHBondContact CB-O 3.19Å; L733-Y788 HydrophobicContact CD1-CD1 3.8Å; L733-Y788 HydrophobicContact CD1-CE1 4.24Å; L733-Y788 HydrophobicContact CD1-CG 4.11Å; L733-Y788 PolarHBondContact N-O 3.02Å; P737-Y788 VanDerWaalsContact CD-CE2 3.45Å; P737-Y788 HydrophobicContact CG-CD2 3.64Å; P737-Y788 HydrophobicContact CG-CE1 4.43Å; P737-Y788 HydrophobicContact CG-CE2 3.44Å; P737-Y788 HydrophobicContact CG-CG 4.25Å; L783-Y788 HydrophobicContact CB-CE1 4.45Å; L783-Y788 HydrophobicContact CD2-CD1 4.04Å; L783-Y788 HydrophobicContact CD2-CE1 3.95Å; L783-Y788 HydrophobicContact CG-CD1 4.22Å; L783-Y788 HydrophobicContact CG-CE1 3.99Å; K785-Y788 HydrophobicContact CB-CE1 4.49Å; K785-Y788 HydrophobicContact CB-CE2 4.34Å; K785-Y788 HydrophobicContact CG-CE1 4.35Å; K785-Y788 HydrophobicContact CG-CE2 4.02Å; K785-Y788 WeakPolarHBondContact O-CB 3.38Å; K785-Y788 PolarHBondContact O-N 3.01Å; Y788-N790 VanDerWaalsContact C-N 3.28Å; Y788-N790 PolarHBondContact O-N 3.01Å
789	N	82.1	Confident	87.3	Confident	126.667 Å²	126.667	63.6 Å²	63.6	68%	0.677	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-17.3	175.2	-75.8	-33.9	0	0	0	114.6	Y787	Y787-N789 PolarHBondContact O-N 2.88Å; Y787-N789 VanDerWaalsContact O-N 3.13Å
790	N	85.5	Confident	86.9	Confident	81 Å²	81	67.5 Å²	67.5	43%	0.433	34%	0.335	S	S	.	.			trans	-160.8	81.5	-175.8	-171.2	-10.6	0	0	0	111.3	T730 Y787 Y788 T792 N807	T730-N790 VanDerWaalsContact CG2-OD1 3.23Å; T730-N790 WeakPolarHBondContact CG2-OD1 3.39Å; Y787-N790 CarbonylContact O-C 3.52Å; Y787-N790 PolarHBondContact O-N 2.87Å; Y787-N790 VanDerWaalsContact O-O 3.13Å; Y788-N790 VanDerWaalsContact C-N 3.28Å; Y788-N790 PolarHBondContact O-N 3.01Å; N790-T792 PolarHBondContact OD1-OG1 3.4Å; N790-N807 PolarHBondContact O-OD1 2.93Å
791	V	88.9	Confident	86.9	Confident	0 Å²	0	66 Å²	66	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	104.8	175.7	-171.4	0	0	0	0	108.8	T730 V731 L733 L783 Y787 L793 V806	T730-V791 CarbonylContact C-O 3.57Å; T730-V791 WeakPolarHBondContact CA-O 3.43Å; V731-V791 HydrophobicContact CB-CB 4.38Å; V731-V791 PolarHBondContact N-O 3.12Å; V731-V791 WeakPolarHBondContact O-CB 3.36Å; V731-V791 PolarHBondContact O-N 2.99Å; L733-V791 HydrophobicContact CD1-CG2 3.93Å; L733-V791 HydrophobicContact CG-CG2 4.02Å; L783-V791 HydrophobicContact CD1-CG1 4.05Å; L783-V791 HydrophobicContact CD1-CG2 4.33Å; L783-V791 HydrophobicContact CD2-CG1 4.23Å; L783-V791 HydrophobicContact CD2-CG2 3.86Å; Y787-V791 WeakPolarHBondContact O-CG2 3.41Å; Y787-V791 PolarHBondContact O-N 3.1Å; V791-L793 HydrophobicContact CG1-CD2 3.8Å; V791-L793 HydrophobicContact CG1-CG 4.48Å; V791-L793 PolarHBondContact O-N 2.88Å; V791-V806 HydrophobicContact CG1-CG1 3.91Å
792	T	88.9	Confident	86.7	Confident	28.6667 Å²	28.6667	64.9 Å²	64.9	18%	0.176	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	98.8	174.8	-63.1	0	0	0	0	110.2	Q728 A729 T730 N790 V806 N807	Q728-T792 HydrophobicContact CG-CG2 4.11Å; A729-T792 CarbonylContact O-C 3.6Å; T730-T792 PolarHBondContact OG1-OG1 3.15Å; N790-T792 PolarHBondContact OD1-OG1 3.4Å; T792-V806 WeakPolarHBondContact O-CA 3.22Å; T792-N807 PolarHBondContact N-OD1 3.17Å; T792-N807 PolarHBondContact O-N 3.02Å
793	L	91.9	Very high	86.7	Confident	1.66667 Å²	1.66667	62 Å²	62	1%	0.009	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	136.1	166.6	-47.8	-179.1	0	0	0	109.1	Q728 A729 V731 F740 W763 V791 L805 V806	Q728-L793 CarbonylContact C-O 3.56Å; Q728-L793 WeakPolarHBondContact CA-O 2.98Å; A729-L793 HydrophobicContact CB-CB 4.32Å; A729-L793 HydrophobicContact CB-CD1 4.33Å; A729-L793 PolarHBondContact N-O 3.1Å; A729-L793 PolarHBondContact O-N 2.97Å; V731-L793 HydrophobicContact CG2-CD1 3.99Å; V731-L793 HydrophobicContact CG2-CG 4.25Å; F740-L793 HydrophobicContact CE2-CD1 3.95Å; F740-L793 HydrophobicContact CE2-CD2 4.3Å; F740-L793 HydrophobicContact CZ-CD1 4.5Å; F740-L793 HydrophobicContact CZ-CD2 4.34Å; W763-L793 HydrophobicContact CH2-CD2 3.88Å; W763-L793 HydrophobicContact CZ3-CD2 4.04Å; V791-L793 HydrophobicContact CG1-CD2 3.8Å; V791-L793 HydrophobicContact CG1-CG 4.48Å; V791-L793 PolarHBondContact O-N 2.88Å; L793-L805 CarbonylContact C-O 3.56Å; L793-L805 WeakPolarHBondContact CA-O 3.29Å; L793-V806 HydrophobicContact CD2-CG1 4.4Å; L793-V806 HydrophobicContact CD2-CG2 3.75Å
794	T	91.5	Very high	86.7	Confident	22.6667 Å²	22.6667	61.7 Å²	61.7	14%	0.139	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	113.6	171.7	-57.4	0	0	0	0	110	I727 L796 L805	I727-T794 CarbonylContact O-C 3.55Å; I727-T794 WeakPolarHBondContact O-CA 3.22Å; T794-L796 HydrophobicContact CG2-CD2 3.76Å; T794-L796 HydrophobicContact CG2-CG 4.1Å; T794-L805 PolarHBondContact N-O 2.84Å; T794-L805 WeakPolarHBondContact O-CB 3.43Å; T794-L805 PolarHBondContact O-N 3Å
795	V	92.1	Very high	86.9	Confident	0.666667 Å²	0.666667	60.6 Å²	60.6	0%	0.004	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	108.6	171.8	-176.6	0	0	0	0	107.8	S726 I727 M742 W752 A802 Q803 V804	S726-V795 CarbonylContact C-O 3.51Å; S726-V795 WeakPolarHBondContact CA-O 3.35Å; S726-V795 WeakPolarHBondContact CB-O 3.1Å; I727-V795 HydrophobicContact CB-CB 4.34Å; I727-V795 HydrophobicContact CB-CG2 4.49Å; I727-V795 PolarHBondContact N-O 3.26Å; I727-V795 PolarHBondContact O-N 2.98Å; M742-V795 HydrophobicContact CE-CG2 3.55Å; M742-V795 VanDerWaalsContact CE-CG2 3.48Å; W752-V795 HydrophobicContact CH2-CB 4.39Å; W752-V795 HydrophobicContact CH2-CG1 4.03Å; W752-V795 HydrophobicContact CH2-CG2 4.12Å; W752-V795 HydrophobicContact CZ3-CG2 4.49Å; V795-A802 HydrophobicContact CG1-CB 3.71Å; V795-Q803 CarbonylContact C-O 3.58Å; V795-Q803 WeakPolarHBondContact CA-O 3.4Å; V795-V804 HydrophobicContact CG2-CG2 4.29Å
796	L	89.5	Confident	87.1	Confident	74.3333 Å²	74.3333	52.7 Å²	52.7	39%	0.389	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	119	175.1	-65.6	-178.5	0	0	0	109.5	T794 A802 Q803 L805	T794-L796 HydrophobicContact CG2-CD2 3.76Å; T794-L796 HydrophobicContact CG2-CG 4.1Å; L796-A802 CarbonylContact O-C 3.52Å; L796-A802 VanDerWaalsContact O-CA 3.3Å; L796-A802 WeakPolarHBondContact O-CA 3.2Å; L796-Q803 PolarHBondContact N-O 2.97Å; L796-Q803 PolarHBondContact O-N 2.84Å; L796-L805 HydrophobicContact CB-CD1 4.44Å; L796-L805 HydrophobicContact CD1-CD1 3.89Å; L796-L805 HydrophobicContact CD1-CD2 3.94Å; L796-L805 HydrophobicContact CG-CD1 4.01Å; L796-L805 HydrophobicContact CG-CD2 4.48Å
797	A	86.7	Confident	87.1	Confident	10.6667 Å²	10.6667	45.4 Å²	45.4	9%	0.088	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	122.7	-179.2	0	0	0	0	0	111	L724 R725 M801 I817	L724-A797 HydrophobicContact CB-CB 4.22Å; L724-A797 HydrophobicContact CD2-CB 4.11Å; L724-A797 HydrophobicContact CG-CB 3.88Å; L724-A797 WeakPolarHBondContact O-CB 3.17Å; R725-A797 PolarHBondContact O-N 2.9Å; A797-M801 CarbonylContact C-O 3.54Å; A797-M801 WeakPolarHBondContact CA-O 3.24Å; A797-I817 HydrophobicContact CB-CD1 4.02Å
798	Q	79.4	Confident	86.8	Confident	119.667 Å²	119.667	44 Å²	44	56%	0.559	23%	0.234	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-139	127	175.4	-172.3	-175.8	-40.9	0	0	109.2	K800 M801 R846	Q798-K800 VanDerWaalsContact C-N 3.3Å; Q798-K800 PolarHBondContact O-N 3.05Å; Q798-K800 VanDerWaalsContact O-N 3.15Å; Q798-M801 PolarHBondContact N-O 2.98Å; Q798-M801 WeakPolarHBondContact O-CA 3.44Å; Q798-M801 WeakPolarHBondContact O-CB 3.44Å; Q798-M801 PolarHBondContact O-N 2.99Å; Q798-M801 VanDerWaalsContact O-O 3.1Å; Q798-R846 VanDerWaalsContact CG-NH2 3.28Å
799	D	77.5	Confident	86.6	Confident	83.3333 Å²	83.3333	48.5 Å²	48.5	45%	0.446	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.6	39.5	172	-54.2	-40	0	0	0	114.5	M801 R843 R846	D799-M801 VanDerWaalsContact C-N 3.28Å; D799-M801 PolarHBondContact O-N 3.07Å; D799-R843 IonicContact OD1-CZ 3.2Å; D799-R843 IonicContact OD1-NH2 4Å; D799-R843 PolarHBondContact OD1-NH2 2.88Å; D799-R846 IonicContact OD1-CZ 3.68Å; D799-R846 IonicContact OD1-NH1 2.84Å; D799-R846 IonicContact OD1-NH2 2.75Å; D799-R846 PolarHBondContact OD1-NH2 2.81Å; D799-R846 IonicContact OD2-CZ 3.89Å; D799-R846 VanDerWaalsContact OD2-CZ 3.28Å; D799-R846 IonicContact OD2-NH1 3.33Å; D799-R846 PolarHBondContact OD2-NH1 3.24Å; D799-R846 IonicContact OD2-NH2 3.51Å; D799-R846 PolarHBondContact OD2-NH2 2.8Å
800	K	80.7	Confident	86.8	Confident	104 Å²	104	44.8 Å²	44.8	45%	0.452	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.6	3.4	-173.5	-58.8	-178.6	178.8	177.2	0	115.7	M723 Q798 Q816 I817 L820	M723-K800 HydrophobicContact CE-CG 4.33Å; M723-K800 VanDerWaalsContact CE-N 3.35Å; Q798-K800 VanDerWaalsContact C-N 3.3Å; Q798-K800 PolarHBondContact O-N 3.05Å; Q798-K800 VanDerWaalsContact O-N 3.15Å; K800-Q816 WeakPolarHBondContact O-CA 3.39Å; K800-I817 VanDerWaalsContact O-CG1 3.26Å; K800-I817 WeakPolarHBondContact O-CG1 3.43Å; K800-I817 PolarHBondContact O-N 3.2Å; K800-L820 HydrophobicContact CD-CD2 4.41Å; K800-L820 HydrophobicContact CG-CD2 3.86Å
801	M	85.2	Confident	87	Confident	60.75 Å²	60.75	42.1 Å²	42.1	30%	0.299	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	134.4	173.4	-54.1	-52.3	-71.1	0	0	110.1	A797 Q798 D799 K814 Y815 Q816	A797-M801 CarbonylContact C-O 3.54Å; A797-M801 WeakPolarHBondContact CA-O 3.24Å; Q798-M801 PolarHBondContact N-O 2.98Å; Q798-M801 WeakPolarHBondContact O-CA 3.44Å; Q798-M801 WeakPolarHBondContact O-CB 3.44Å; Q798-M801 PolarHBondContact O-N 2.99Å; Q798-M801 VanDerWaalsContact O-O 3.1Å; D799-M801 VanDerWaalsContact C-N 3.28Å; D799-M801 PolarHBondContact O-N 3.07Å; M801-K814 HydrophobicContact CB-CB 4.32Å; M801-K814 HydrophobicContact CE-CB 3.97Å; M801-K814 VanDerWaalsContact CE-O 3.27Å; M801-K814 WeakPolarHBondContact CE-O 3.16Å; M801-Y815 CarbonylContact C-O 3.43Å; M801-Y815 WeakPolarHBondContact CA-O 3.44Å; M801-Q816 HydrophobicContact CE-CB 4.04Å; M801-Q816 HydrophobicContact CE-CG 3.98Å; M801-Q816 VanDerWaalsContact SD-CA 3.54Å; M801-Q816 HydrophobicContact SD-CB 4.02Å; M801-Q816 HydrophobicContact SD-CG 4.12Å
802	A	85.4	Confident	86.9	Confident	1.25 Å²	1.25	42.4 Å²	42.4	1%	0.01	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	134.2	-179.9	0	0	0	0	0	110.4	V795 L796 K814 Y815 I817	V795-A802 HydrophobicContact CG1-CB 3.71Å; L796-A802 CarbonylContact O-C 3.52Å; L796-A802 VanDerWaalsContact O-CA 3.3Å; L796-A802 WeakPolarHBondContact O-CA 3.2Å; A802-K814 CarbonylContact O-C 3.51Å; A802-K814 WeakPolarHBondContact O-CA 3.42Å; A802-Y815 PolarHBondContact N-O 3.31Å; A802-Y815 PolarHBondContact O-N 3.04Å; A802-I817 HydrophobicContact CB-CG1 4.49Å; A802-I817 HydrophobicContact CB-CG2 3.53Å
803	Q	91.2	Very high	86.7	Confident	58.25 Å²	58.25	44.4 Å²	44.4	27%	0.272	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	132.2	173.3	-167	169	22	0	0	110.2	V795 L796 L805 A810 S812 K814	V795-Q803 CarbonylContact C-O 3.58Å; V795-Q803 WeakPolarHBondContact CA-O 3.4Å; L796-Q803 PolarHBondContact N-O 2.97Å; L796-Q803 PolarHBondContact O-N 2.84Å; Q803-L805 HydrophobicContact CB-CD1 4.43Å; Q803-L805 HydrophobicContact CG-CD1 4.31Å; Q803-L805 WeakPolarHBondContact O-CD1 3.44Å; Q803-A810 HydrophobicContact CG-CB 4.4Å; Q803-S812 WeakPolarHBondContact CG-O 3.36Å; Q803-S812 PolarHBondContact NE2-O 2.97Å; Q803-S812 VanDerWaalsContact NE2-O 3.09Å; Q803-K814 HydrophobicContact CB-CG 4.26Å; Q803-K814 HydrophobicContact CG-CG 4.38Å
804	V	91.1	Very high	86.4	Confident	1.25 Å²	1.25	50.4 Å²	50.4	1%	0.008	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	125.7	177.7	-174	0	0	0	0	109.7	L754 F765 V795 V806 I811 S812	L754-V804 HydrophobicContact CD1-CG1 4.41Å; L754-V804 HydrophobicContact CD1-CG2 4.14Å; L754-V804 HydrophobicContact CD2-CG1 3.79Å; L754-V804 HydrophobicContact CD2-CG2 4Å; F765-V804 HydrophobicContact CE2-CG2 3.34Å; F765-V804 HydrophobicContact CZ-CG2 3.34Å; V795-V804 HydrophobicContact CG2-CG2 4.29Å; V804-V806 HydrophobicContact CG1-CG2 4.34Å; V804-I811 HydrophobicContact CB-CG1 4.32Å; V804-I811 HydrophobicContact CG1-CD1 4.28Å; V804-I811 HydrophobicContact CG1-CG1 4.06Å; V804-I811 PolarHBondContact O-N 2.84Å; V804-S812 WeakPolarHBondContact CB-OG 3.38Å; V804-S812 WeakPolarHBondContact CG2-OG 3.44Å; V804-S812 PolarHBondContact N-OG 2.96Å; V804-S812 PolarHBondContact O-N 3.04Å
805	L	92	Very high	86.1	Confident	21.5 Å²	21.5	49.9 Å²	49.9	11%	0.113	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	137.9	169.8	-64.2	71.6	0	0	0	108.9	L793 T794 L796 Q803 K809 A810	L793-L805 CarbonylContact C-O 3.56Å; L793-L805 WeakPolarHBondContact CA-O 3.29Å; T794-L805 PolarHBondContact N-O 2.84Å; T794-L805 WeakPolarHBondContact O-CB 3.43Å; T794-L805 PolarHBondContact O-N 3Å; L796-L805 HydrophobicContact CB-CD1 4.44Å; L796-L805 HydrophobicContact CD1-CD1 3.89Å; L796-L805 HydrophobicContact CD1-CD2 3.94Å; L796-L805 HydrophobicContact CG-CD1 4.01Å; L796-L805 HydrophobicContact CG-CD2 4.48Å; Q803-L805 HydrophobicContact CB-CD1 4.43Å; Q803-L805 HydrophobicContact CG-CD1 4.31Å; Q803-L805 WeakPolarHBondContact O-CD1 3.44Å; L805-K809 CarbonylContact C-O 3.52Å; L805-K809 WeakPolarHBondContact CA-O 3.26Å; L805-K809 WeakPolarHBondContact CB-O 3.49Å; L805-A810 HydrophobicContact CD1-CB 4.49Å; L805-A810 HydrophobicContact CD2-CB 4.46Å; L805-A810 HydrophobicContact CG-CB 4.2Å
806	V	89.6	Confident	85.8	Confident	0.5 Å²	0.5	55.3 Å²	55.3	0%	0.003	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	122.5	169.8	175.7	0	0	0	0	108.4	W763 Y781 L783 V791 T792 L793 V804 G808 K809 I811	W763-V806 HydrophobicContact CH2-CG2 3.82Å; W763-V806 HydrophobicContact CZ2-CG2 4.46Å; W763-V806 HydrophobicContact CZ3-CG2 4.16Å; Y781-V806 HydrophobicContact CE1-CB 4Å; Y781-V806 HydrophobicContact CE1-CG1 3.92Å; Y781-V806 HydrophobicContact CE1-CG2 4.34Å; L783-V806 HydrophobicContact CD1-CG1 3.95Å; V791-V806 HydrophobicContact CG1-CG1 3.91Å; T792-V806 WeakPolarHBondContact O-CA 3.22Å; L793-V806 HydrophobicContact CD2-CG1 4.4Å; L793-V806 HydrophobicContact CD2-CG2 3.75Å; V804-V806 HydrophobicContact CG1-CG2 4.34Å; V806-G808 PolarHBondContact O-N 3.13Å; V806-G808 VanDerWaalsContact O-N 3.13Å; V806-K809 PolarHBondContact N-O 2.98Å; V806-K809 PolarHBondContact O-N 2.86Å; V806-I811 HydrophobicContact CB-CD1 4.25Å; V806-I811 HydrophobicContact CB-CG2 4.17Å; V806-I811 HydrophobicContact CG2-CD1 3.37Å; V806-I811 HydrophobicContact CG2-CG1 3.98Å; V806-I811 HydrophobicContact CG2-CG2 4.38Å
807	N	85.9	Confident	85.6	Confident	43.25 Å²	43.25	52 Å²	52	23%	0.231	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.8	37.1	-176.4	-60.3	-30.2	0	0	0	113	Y787 N790 T792 K809	Y787-N807 WeakPolarHBondContact CB-ND2 3.46Å; Y787-N807 HydrophobicContact CD1-CB 4.34Å; Y787-N807 WeakPolarHBondContact CD1-ND2 3.27Å; Y787-N807 HydrophobicContact CE1-CB 4.33Å; N790-N807 PolarHBondContact O-OD1 2.93Å; T792-N807 PolarHBondContact N-OD1 3.17Å; T792-N807 PolarHBondContact O-N 3.02Å; N807-K809 VanDerWaalsContact C-N 3.3Å; N807-K809 PolarHBondContact O-N 3.05Å
808	G	79.2	Confident	85.6	Confident	43.25 Å²	43.25	52.6 Å²	52.6	45%	0.446	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.2	-11.9	-179.9	0	0	0	0	0	115.7	V806 Q864	V806-G808 PolarHBondContact O-N 3.13Å; V806-G808 VanDerWaalsContact O-N 3.13Å; G808-Q864 PolarHBondContact O-NE2 2.94Å; G808-Q864 VanDerWaalsContact O-NE2 3.14Å
809	K	84.3	Confident	85.8	Confident	136 Å²	136	47.3 Å²	47.3	59%	0.591	25%	0.252	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85	127.4	172.4	-176.2	-176.6	176.5	-175.5	0	109.5	Y781 L805 V806 N807 I811	Y781-K809 HydrophobicContact CE2-CD 4.3Å; L805-K809 CarbonylContact C-O 3.52Å; L805-K809 WeakPolarHBondContact CA-O 3.26Å; L805-K809 WeakPolarHBondContact CB-O 3.49Å; V806-K809 PolarHBondContact N-O 2.98Å; V806-K809 PolarHBondContact O-N 2.86Å; N807-K809 VanDerWaalsContact C-N 3.3Å; N807-K809 PolarHBondContact O-N 3.05Å; K809-I811 HydrophobicContact CG-CG2 4.36Å; K809-I811 WeakPolarHBondContact O-CG2 3.09Å; K809-I811 PolarHBondContact O-N 3.17Å
810	A	87.3	Confident	86	Confident	48.25 Å²	48.25	45.2 Å²	45.2	40%	0.399	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	128.6	169.5	0	0	0	0	0	110.1	Q803 L805	Q803-A810 HydrophobicContact CG-CB 4.4Å; L805-A810 HydrophobicContact CD1-CB 4.49Å; L805-A810 HydrophobicContact CD2-CB 4.46Å; L805-A810 HydrophobicContact CG-CB 4.2Å
811	I	87.7	Confident	86.1	Confident	23.25 Å²	23.25	44.6 Å²	44.6	12%	0.119	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	-23.8	-177.4	66.5	159.3	0	0	0	113.2	W763 F779 Y781 V804 V806 K809	W763-I811 HydrophobicContact CD2-CD1 3.93Å; W763-I811 HydrophobicContact CE3-CD1 3.89Å; W763-I811 HydrophobicContact CG-CD1 4.35Å; W763-I811 HydrophobicContact CH2-CD1 4.27Å; W763-I811 HydrophobicContact CZ2-CD1 4.32Å; W763-I811 HydrophobicContact CZ3-CD1 4.06Å; F779-I811 VanDerWaalsContact CD2-O 3.31Å; F779-I811 WeakPolarHBondContact CD2-O 3.4Å; F779-I811 HydrophobicContact CE2-CB 4.48Å; F779-I811 HydrophobicContact CE2-CD1 3.79Å; F779-I811 HydrophobicContact CE2-CG1 3.88Å; Y781-I811 HydrophobicContact CD1-CB 4.43Å; Y781-I811 HydrophobicContact CD1-CD1 3.62Å; Y781-I811 HydrophobicContact CD1-CG2 4.04Å; Y781-I811 HydrophobicContact CD2-CB 3.94Å; Y781-I811 HydrophobicContact CD2-CG2 3.4Å; Y781-I811 VanDerWaalsContact CD2-CG2 3.42Å; Y781-I811 HydrophobicContact CE1-CD1 4.28Å; Y781-I811 HydrophobicContact CE1-CG2 4.07Å; Y781-I811 HydrophobicContact CE2-CB 4.46Å; Y781-I811 HydrophobicContact CE2-CG2 3.44Å; Y781-I811 VanDerWaalsContact CE2-CG2 3.44Å; Y781-I811 HydrophobicContact CG-CB 3.92Å; Y781-I811 HydrophobicContact CG-CD1 3.8Å; Y781-I811 HydrophobicContact CG-CG1 4.48Å; Y781-I811 HydrophobicContact CG-CG2 3.71Å; V804-I811 HydrophobicContact CB-CG1 4.32Å; V804-I811 HydrophobicContact CG1-CD1 4.28Å; V804-I811 HydrophobicContact CG1-CG1 4.06Å; V804-I811 PolarHBondContact O-N 2.84Å; V806-I811 HydrophobicContact CB-CD1 4.25Å; V806-I811 HydrophobicContact CB-CG2 4.17Å; V806-I811 HydrophobicContact CG2-CD1 3.37Å; V806-I811 HydrophobicContact CG2-CG1 3.98Å; V806-I811 HydrophobicContact CG2-CG2 4.38Å; K809-I811 HydrophobicContact CG-CG2 4.36Å; K809-I811 WeakPolarHBondContact O-CG2 3.09Å; K809-I811 PolarHBondContact O-N 3.17Å
812	S	87.9	Confident	86.1	Confident	7.25 Å²	7.25	42.2 Å²	42.2	5%	0.051	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	157.2	179.6	79.8	0	0	0	0	112.6	F779 Q803 V804	F779-S812 VanDerWaalsContact CZ-CB 3.45Å; Q803-S812 WeakPolarHBondContact CG-O 3.36Å; Q803-S812 PolarHBondContact NE2-O 2.97Å; Q803-S812 VanDerWaalsContact NE2-O 3.09Å; V804-S812 WeakPolarHBondContact CB-OG 3.38Å; V804-S812 WeakPolarHBondContact CG2-OG 3.44Å; V804-S812 PolarHBondContact N-OG 2.96Å; V804-S812 PolarHBondContact O-N 3.04Å
813	P	84.5	Confident	86	Confident	69.75 Å²	69.75	47.3 Å²	47.3	45%	0.453	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	171.7	153.2	3.8	-1.3	0	0	0	111.6	L777 Y815	L777-P813 HydrophobicContact CD2-CB 4.49Å; L777-P813 HydrophobicContact CD2-CG 3.64Å; L777-P813 HydrophobicContact CG-CG 4.27Å; P813-Y815 HydrophobicContact CB-CE1 4.36Å; P813-Y815 WeakPolarHBondContact CD-OH 3.36Å; P813-Y815 HydrophobicContact CG-CE1 4.1Å; P813-Y815 WeakPolarHBondContact CG-OH 3.45Å; P813-Y815 PolarHBondContact O-N 3.05Å
814	K	85.2	Confident	85.7	Confident	128.25 Å²	128.25	47.1 Å²	47.1	56%	0.558	25%	0.247	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-80.3	124.1	171.6	-69.7	177.7	-177.7	173.2	0	109.6	M801 A802 Q803	M801-K814 HydrophobicContact CB-CB 4.32Å; M801-K814 HydrophobicContact CE-CB 3.97Å; M801-K814 VanDerWaalsContact CE-O 3.27Å; M801-K814 WeakPolarHBondContact CE-O 3.16Å; A802-K814 CarbonylContact O-C 3.51Å; A802-K814 WeakPolarHBondContact O-CA 3.42Å; Q803-K814 HydrophobicContact CB-CG 4.26Å; Q803-K814 HydrophobicContact CG-CG 4.38Å
815	Y	85.1	Confident	85.5	Confident	12.75 Å²	12.75	47.6 Å²	47.6	5%	0.05	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	142.2	178.2	-79.8	-69.5	0	0	0	111.2	F765 Q767 R776 L777 F779 M801 A802 P813 I817	F765-Y815 HydrophobicContact CB-CD1 4.38Å; F765-Y815 HydrophobicContact CB-CD2 3.61Å; F765-Y815 HydrophobicContact CB-CE1 4.24Å; F765-Y815 HydrophobicContact CB-CE2 3.53Å; F765-Y815 VanDerWaalsContact CB-CE2 3.47Å; F765-Y815 HydrophobicContact CB-CG 4.04Å; F765-Y815 AromaticContact CD1-CD1 3.74Å; F765-Y815 HydrophobicContact CD1-CD1 4.05Å; F765-Y815 AromaticContact CD1-CD2 3.96Å; F765-Y815 HydrophobicContact CD1-CD2 4.11Å; F765-Y815 HydrophobicContact CD1-CE1 4.09Å; F765-Y815 AromaticContact CD1-CG 3.79Å; F765-Y815 HydrophobicContact CD1-CG 3.79Å; F765-Y815 AromaticContact CD2-CD2 3.55Å; F765-Y815 HydrophobicContact CD2-CD2 3.77Å; F765-Y815 VanDerWaalsContact CD2-CD2 3.48Å; F765-Y815 HydrophobicContact CD2-CE2 4.13Å; F765-Y815 AromaticContact CD2-CG 3.93Å; F765-Y815 HydrophobicContact CD2-CG 4.05Å; F765-Y815 HydrophobicContact CE1-CD1 4.02Å; F765-Y815 HydrophobicContact CE1-CG 4.21Å; F765-Y815 HydrophobicContact CE2-CD2 4.15Å; F765-Y815 HydrophobicContact CE2-CG 4.38Å; F765-Y815 HydrophobicContact CG-CD1 4.23Å; F765-Y815 AromaticContact CG-CD2 3.57Å; F765-Y815 HydrophobicContact CG-CD2 3.57Å; F765-Y815 VanDerWaalsContact CG-CD2 3.45Å; F765-Y815 HydrophobicContact CG-CE1 4.49Å; F765-Y815 AromaticContact CG-CE2 3.86Å; F765-Y815 HydrophobicContact CG-CE2 4Å; F765-Y815 AromaticContact CG-CG 3.7Å; F765-Y815 HydrophobicContact CG-CG 3.7Å; F765-Y815 HydrophobicContact CZ-CG 4.47Å; Q767-Y815 WeakPolarHBondContact CB-OH 3.33Å; R776-Y815 HydrophobicContact CB-CD1 4.19Å; R776-Y815 HydrophobicContact CB-CE1 3.98Å; L777-Y815 HydrophobicContact CB-CD1 4.27Å; L777-Y815 HydrophobicContact CB-CD2 4.14Å; L777-Y815 HydrophobicContact CB-CE1 3.58Å; L777-Y815 HydrophobicContact CB-CE2 4.2Å; L777-Y815 HydrophobicContact CD1-CD1 3.51Å; L777-Y815 HydrophobicContact CD1-CE1 3.62Å; L777-Y815 HydrophobicContact CD2-CD2 3.84Å; L777-Y815 HydrophobicContact CG-CE1 4.23Å; L777-Y815 PolarHBondContact O-OH 3.42Å; F779-Y815 HydrophobicContact CD1-CE2 4.39Å; F779-Y815 WeakPolarHBondContact CD1-OH 3.15Å; F779-Y815 AromaticContact CE1-CE2 3.9Å; F779-Y815 HydrophobicContact CE1-CE2 3.9Å; F779-Y815 AromaticContact CE1-CZ 3.96Å; F779-Y815 WeakPolarHBondContact CE1-OH 3.41Å; F779-Y815 HydrophobicContact CZ-CE2 4.4Å; M801-Y815 CarbonylContact C-O 3.43Å; M801-Y815 WeakPolarHBondContact CA-O 3.44Å; A802-Y815 PolarHBondContact N-O 3.31Å; A802-Y815 PolarHBondContact O-N 3.04Å; P813-Y815 HydrophobicContact CB-CE1 4.36Å; P813-Y815 WeakPolarHBondContact CD-OH 3.36Å; P813-Y815 HydrophobicContact CG-CE1 4.1Å; P813-Y815 WeakPolarHBondContact CG-OH 3.45Å; P813-Y815 PolarHBondContact O-N 3.05Å; Y815-I817 PolarHBondContact O-N 2.83Å
816	Q	85.3	Confident	85.3	Confident	113.5 Å²	113.5	48.2 Å²	48.2	53%	0.53	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	125	175.7	-164.4	175.9	32.6	0	0	110.6	Q767 K800 M801	Q767-Q816 PolarHBondContact NE2-O 3.43Å; K800-Q816 WeakPolarHBondContact O-CA 3.39Å; M801-Q816 HydrophobicContact CE-CB 4.04Å; M801-Q816 HydrophobicContact CE-CG 3.98Å; M801-Q816 VanDerWaalsContact SD-CA 3.54Å; M801-Q816 HydrophobicContact SD-CB 4.02Å; M801-Q816 HydrophobicContact SD-CG 4.12Å
817	I	86.9	Confident	85.2	Confident	5.25 Å²	5.25	48.7 Å²	48.7	3%	0.027	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-88.7	139.8	175.2	48	168.2	0	0	0	111.7	L724 M746 W752 F765 A797 K800 A802 Y815 G819	L724-I817 HydrophobicContact CB-CD1 4.37Å; L724-I817 HydrophobicContact CD2-CD1 4.01Å; M746-I817 HydrophobicContact CE-CD1 4.34Å; M746-I817 HydrophobicContact SD-CB 4.34Å; W752-I817 HydrophobicContact CD2-CG2 4.45Å; W752-I817 HydrophobicContact CZ2-CG2 4.21Å; F765-I817 HydrophobicContact CZ-CG2 4.32Å; A797-I817 HydrophobicContact CB-CD1 4.02Å; K800-I817 VanDerWaalsContact O-CG1 3.26Å; K800-I817 WeakPolarHBondContact O-CG1 3.43Å; K800-I817 PolarHBondContact O-N 3.2Å; A802-I817 HydrophobicContact CB-CG1 4.49Å; A802-I817 HydrophobicContact CB-CG2 3.53Å; Y815-I817 PolarHBondContact O-N 2.83Å; I817-G819 VanDerWaalsContact C-N 3.32Å; I817-G819 WeakPolarHBondContact CD1-O 3.44Å; I817-G819 PolarHBondContact O-N 2.95Å
818	P	85.4	Confident	85.2	Confident	24.25 Å²	24.25	47.3 Å²	47.3	16%	0.157	25%	0.252	C	S	.	.	S	Bend	trans	-74.7	-17.2	-169.2	25.7	-33.1	0	0	0	115	M746 K750 W752 Q767	M746-P818 HydrophobicContact CG-CG 4.35Å; M746-P818 HydrophobicContact SD-CG 3.98Å; K750-P818 HydrophobicContact CB-CB 3.94Å; K750-P818 HydrophobicContact CB-CG 4.07Å; K750-P818 HydrophobicContact CD-CB 3.89Å; K750-P818 VanDerWaalsContact CD-O 3.25Å; K750-P818 WeakPolarHBondContact CD-O 3.38Å; K750-P818 HydrophobicContact CG-CB 4.4Å; K750-P818 PolarHBondContact NZ-O 2.95Å; W752-P818 HydrophobicContact CB-CG 4.41Å; W752-P818 HydrophobicContact CG-CG 4.42Å; Q767-P818 HydrophobicContact CG-CB 4.37Å; Q767-P818 HydrophobicContact CG-CG 4.17Å; Q767-P818 VanDerWaalsContact OE1-CD 3.28Å
819	G	83.8	Confident	85.7	Confident	6.5 Å²	6.5	46.6 Å²	46.6	7%	0.067	25%	0.245	C	C	.	.			trans	-139.2	175.8	-178.5	0	0	0	0	0	113.1	M746 I817	M746-G819 VanDerWaalsContact CE-C 3.42Å; M746-G819 WeakPolarHBondContact CE-O 3.39Å; M746-G819 PolarHBondContact SD-N 3.32Å; M746-G819 VanDerWaalsContact SD-N 3.37Å; I817-G819 VanDerWaalsContact C-N 3.32Å; I817-G819 WeakPolarHBondContact CD1-O 3.44Å; I817-G819 PolarHBondContact O-N 2.95Å
820	L	82.6	Confident	85.9	Confident	40.75 Å²	40.75	42.4 Å²	42.4	21%	0.213	23%	0.229	C	C	.	.	S	Bend	trans	-104.7	-34.7	-179.5	-56.6	174	0	0	0	112.5	V722 M723 L724 E747 K800	V722-L820 WeakPolarHBondContact O-CB 3.32Å; M723-L820 CarbonylContact C-O 3.58Å; M723-L820 HydrophobicContact CB-CB 4.5Å; M723-L820 HydrophobicContact CE-CD2 4.04Å; M723-L820 HydrophobicContact CG-CB 4.49Å; M723-L820 HydrophobicContact CG-CD2 4.09Å; M723-L820 HydrophobicContact SD-CD2 4.18Å; L724-L820 VanDerWaalsContact CB-O 3.27Å; L724-L820 WeakPolarHBondContact CB-O 3.29Å; L724-L820 PolarHBondContact N-O 2.95Å; E747-L820 VanDerWaalsContact OE1-CA 3.3Å; E747-L820 WeakPolarHBondContact OE1-CA 3.32Å; E747-L820 VanDerWaalsContact OE1-CB 3.26Å; E747-L820 WeakPolarHBondContact OE1-CB 3.32Å; E747-L820 PolarHBondContact OE1-N 3.06Å; K800-L820 HydrophobicContact CD-CD2 4.41Å; K800-L820 HydrophobicContact CG-CD2 3.86Å
821	R	82.3	Confident	86	Confident	90.5 Å²	90.5	41.1 Å²	41.1	34%	0.342	22%	0.215	S	C	.	.	S	Bend	trans	-107	147.3	177.9	-151.2	176.3	155.5	-163.6	-4.9	111.5	E710 M746 E747	E710-R821 VanDerWaalsContact CD-NH2 3.3Å; E710-R821 IonicContact OE1-CZ 2.75Å; E710-R821 IonicContact OE1-NH1 2.66Å; E710-R821 IonicContact OE1-NH2 2.75Å; E710-R821 PolarHBondContact OE1-NH2 2.81Å; E710-R821 IonicContact OE2-CZ 3.36Å; E710-R821 VanDerWaalsContact OE2-CZ 3.32Å; E710-R821 IonicContact OE2-NE 2.77Å; E710-R821 PolarHBondContact OE2-NE 2.88Å; E710-R821 IonicContact OE2-NH1 3.73Å; E710-R821 PolarHBondContact OE2-NH1 3.01Å; E710-R821 IonicContact OE2-NH2 3.83Å; E710-R821 PolarHBondContact OE2-NH2 3.13Å; M746-R821 CarbonylContact C-O 3.52Å; M746-R821 VanDerWaalsContact CA-O 3.24Å; M746-R821 WeakPolarHBondContact CA-O 3.22Å; M746-R821 VanDerWaalsContact CB-O 3.3Å; M746-R821 WeakPolarHBondContact CB-O 3.32Å; M746-R821 WeakPolarHBondContact CE-O 3.35Å; E747-R821 HydrophobicContact CB-CB 4.26Å; E747-R821 HydrophobicContact CG-CB 4.43Å; E747-R821 PolarHBondContact N-O 3.09Å; E747-R821 PolarHBondContact OE1-N 2.8Å; E747-R821 VanDerWaalsContact OE2-CB 3.24Å; E747-R821 WeakPolarHBondContact OE2-CB 3.31Å; E747-R821 PolarHBondContact OE2-N 2.82Å
822	V	84.9	Confident	85.6	Confident	11 Å²	11	42 Å²	42	7%	0.067	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	126	178	175.2	0	0	0	0	108.1	W708 L724 I727 V744 K745 M746 N824 V825 V838 H840	W708-V822 HydrophobicContact CE3-CG1 4.31Å; W708-V822 HydrophobicContact CZ3-CB 4.24Å; W708-V822 HydrophobicContact CZ3-CG1 3.92Å; L724-V822 HydrophobicContact CD1-CG2 3.87Å; L724-V822 HydrophobicContact CD2-CG2 3.93Å; L724-V822 HydrophobicContact CG-CG2 4.34Å; I727-V822 HydrophobicContact CD1-CG2 4.24Å; V744-V822 HydrophobicContact CG1-CG1 3.96Å; V744-V822 HydrophobicContact CG1-CG2 4.08Å; K745-V822 CarbonylContact O-C 3.58Å; M746-V822 HydrophobicContact CE-CG2 4.11Å; M746-V822 HydrophobicContact SD-CB 4.44Å; M746-V822 HydrophobicContact SD-CG2 3.71Å; V822-N824 WeakPolarHBondContact CG1-O 3.16Å; V822-V825 HydrophobicContact CG1-CG2 3.64Å; V822-V838 HydrophobicContact CB-CG1 4.15Å; V822-V838 HydrophobicContact CG1-CG1 4.37Å; V822-V838 HydrophobicContact CG1-CG2 4.41Å; V822-V838 HydrophobicContact CG2-CG1 4.19Å; V822-H840 PolarHBondContact N-NE2 3.06Å; V822-H840 VanDerWaalsContact N-NE2 3.13Å
823	K	83.9	Confident	85.2	Confident	109 Å²	109	44.1 Å²	44.1	47%	0.474	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	-46.2	170.6	-74.3	-173.8	-179.1	-176	0	111.2	E710 K745 M746 D749	E710-K823 PolarHBondContact N-O 2.85Å; K745-K823 HydrophobicContact CB-CB 4.25Å; K745-K823 PolarHBondContact O-N 2.87Å; M746-K823 WeakPolarHBondContact O-CD 3.29Å; M746-K823 WeakPolarHBondContact O-CG 3.23Å; D749-K823 IonicContact OD1-NZ 2.79Å; D749-K823 PolarHBondContact OD1-NZ 2.92Å; D749-K823 IonicContact OD2-NZ 2.9Å; D749-K823 PolarHBondContact OD2-NZ 3.45Å
824	N	84.9	Confident	84.8	Confident	52.75 Å²	52.75	42.1 Å²	42.1	28%	0.282	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	152.7	-177.9	-165.2	3.4	0	0	0	111.8	Q706 W708 N709 V744 K745 V822	Q706-N824 PolarHBondContact O-ND2 3.36Å; Q706-N824 VanDerWaalsContact O-ND2 3.14Å; Q706-N824 PolarHBondContact O-OD1 3.02Å; W708-N824 CarbonylContact O-C 3.4Å; W708-N824 WeakPolarHBondContact O-CA 3.4Å; W708-N824 PolarHBondContact O-OD1 3.34Å; N709-N824 WeakPolarHBondContact OD1-CB 3.41Å; N709-N824 PolarHBondContact OD1-ND2 3.46Å; N709-N824 VanDerWaalsContact OD1-ND2 3.17Å; V744-N824 CarbonylContact C-O 3.58Å; V744-N824 WeakPolarHBondContact CA-O 3.38Å; K745-N824 HydrophobicContact CB-CB 4.14Å; K745-N824 HydrophobicContact CG-CB 4.25Å; K745-N824 PolarHBondContact N-O 3.1Å; K745-N824 PolarHBondContact O-N 3.05Å; K745-N824 VanDerWaalsContact O-N 3.09Å; V822-N824 WeakPolarHBondContact CG1-O 3.16Å
825	V	87.3	Confident	84.4	Confident	11.5 Å²	11.5	39.8 Å²	39.8	7%	0.07	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	120.6	168.4	-177.7	0	0	0	0	109	A707 W708 I727 M742 R743 V744 V822 V827 V836 V838	A707-V825 CarbonylContact C-O 3.51Å; A707-V825 VanDerWaalsContact CA-O 3.29Å; A707-V825 WeakPolarHBondContact CA-O 3.48Å; W708-V825 HydrophobicContact CB-CB 4.44Å; W708-V825 HydrophobicContact CE3-CG2 4.35Å; W708-V825 PolarHBondContact N-O 2.59Å; W708-V825 PolarHBondContact O-N 2.88Å; I727-V825 HydrophobicContact CD1-CG2 4.05Å; I727-V825 HydrophobicContact CG2-CG1 4.32Å; I727-V825 HydrophobicContact CG2-CG2 4.3Å; M742-V825 HydrophobicContact CG-CG1 3.83Å; M742-V825 HydrophobicContact SD-CG1 4.09Å; R743-V825 CarbonylContact O-C 3.46Å; R743-V825 WeakPolarHBondContact O-CA 3.34Å; V744-V825 HydrophobicContact CG1-CG2 4.23Å; V744-V825 HydrophobicContact CG2-CG1 4.08Å; V744-V825 HydrophobicContact CG2-CG2 4.17Å; V822-V825 HydrophobicContact CG1-CG2 3.64Å; V825-V827 HydrophobicContact CG1-CG2 4.48Å; V825-V836 HydrophobicContact CB-CG1 3.88Å; V825-V836 HydrophobicContact CG1-CG1 3.72Å; V825-V836 HydrophobicContact CG1-CG2 4.38Å; V825-V836 HydrophobicContact CG2-CG1 4.35Å; V825-V838 HydrophobicContact CG2-CG2 3.76Å
826	T	86.8	Confident	84	Confident	34.75 Å²	34.75	40.5 Å²	40.5	21%	0.213	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	133.8	174.3	-55.2	0	0	0	0	109	E705 Q706 M742 R743 A828	E705-T826 HydrophobicContact CG-CG2 3.42Å; E705-T826 VanDerWaalsContact CG-CG2 3.42Å; Q706-T826 WeakPolarHBondContact O-CA 3.49Å; M742-T826 CarbonylContact C-O 3.57Å; M742-T826 VanDerWaalsContact CA-O 3.3Å; M742-T826 WeakPolarHBondContact CA-O 3.28Å; R743-T826 PolarHBondContact N-O 3.2Å; R743-T826 PolarHBondContact O-N 2.85Å; T826-A828 HydrophobicContact CG2-CB 4.45Å
827	V	87.5	Confident	83.6	Confident	10.5 Å²	10.5	40.5 Å²	40.5	6%	0.064	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	128.7	168.3	-174	0	0	0	0	107.6	Q706 A729 V731 Y741 M742 V825 I831 A834 V836	Q706-V827 PolarHBondContact N-O 2.99Å; Q706-V827 PolarHBondContact O-N 2.87Å; A729-V827 HydrophobicContact CB-CG2 4.14Å; V731-V827 HydrophobicContact CG1-CG1 4.31Å; V731-V827 HydrophobicContact CG2-CG1 3.92Å; Y741-V827 VanDerWaalsContact O-CA 3.32Å; Y741-V827 WeakPolarHBondContact O-CA 3.37Å; Y741-V827 WeakPolarHBondContact O-CG1 2.82Å; M742-V827 HydrophobicContact CB-CG2 4.17Å; M742-V827 HydrophobicContact CG-CG2 3.97Å; M742-V827 HydrophobicContact SD-CG2 4.4Å; V825-V827 HydrophobicContact CG1-CG2 4.48Å; V827-I831 HydrophobicContact CB-CD1 4.46Å; V827-I831 HydrophobicContact CG1-CD1 4.1Å; V827-I831 VanDerWaalsContact O-CD1 3.29Å; V827-I831 WeakPolarHBondContact O-CD1 3.36Å; V827-A834 HydrophobicContact CB-CB 3.92Å; V827-A834 HydrophobicContact CG1-CB 4.05Å; V827-A834 HydrophobicContact CG2-CB 4.43Å; V827-V836 HydrophobicContact CG2-CG2 3.73Å
828	A	85.5	Confident	83.3	Confident	13.5 Å²	13.5	42.3 Å²	42.3	11%	0.112	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	175.2	-173.5	0	0	0	0	0	112.2	T704 E705 F740 Y741 T826	T704-A828 VanDerWaalsContact O-CA 3.23Å; T704-A828 WeakPolarHBondContact O-CA 3.45Å; T704-A828 VanDerWaalsContact O-CB 3.25Å; T704-A828 WeakPolarHBondContact O-CB 3.48Å; E705-A828 HydrophobicContact CG-CB 4.44Å; F740-A828 CarbonylContact C-O 3.28Å; F740-A828 WeakPolarHBondContact CA-O 3.33Å; F740-A828 WeakPolarHBondContact CB-O 3.37Å; Y741-A828 HydrophobicContact CD1-CB 4.42Å; Y741-A828 VanDerWaalsContact CD1-O 3.31Å; Y741-A828 WeakPolarHBondContact CD1-O 3.4Å; Y741-A828 HydrophobicContact CE1-CB 3.74Å; Y741-A828 HydrophobicContact CE2-CB 4.33Å; Y741-A828 PolarHBondContact N-O 2.81Å; Y741-A828 PolarHBondContact O-N 2.92Å; Y741-A828 VanDerWaalsContact O-N 3.07Å; T826-A828 HydrophobicContact CG2-CB 4.45Å
829	G	89.4	Confident	82.9	Confident	29.25 Å²	29.25	42.2 Å²	42.2	30%	0.302	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	107.6	-144.2	-171.4	0	0	0	0	0	111.1	I831	G829-I831 PolarHBondContact O-N 3.19Å
830	D	89.9	Confident	82.6	Confident	48 Å²	48	44.5 Å²	44.5	26%	0.257	25%	0.248	S	C	.	.	S	Bend	trans	-75.6	53.8	-175.8	-73.3	-32.9	0	0	0	113.5	L733 V734 P737 R738 Y739	L733-D830 WeakPolarHBondContact CA-O 3.39Å; L733-D830 WeakPolarHBondContact CD2-O 3.37Å; V734-D830 WeakPolarHBondContact CG1-O 3.4Å; V734-D830 HydrophobicContact CG2-CB 3.94Å; V734-D830 WeakPolarHBondContact CG2-O 3.43Å; V734-D830 PolarHBondContact N-O 2.97Å; P737-D830 HydrophobicContact CB-CB 3.75Å; R738-D830 WeakPolarHBondContact CA-OD2 3.35Å; R738-D830 WeakPolarHBondContact CB-OD2 3.5Å; R738-D830 PolarHBondContact N-OD2 3.15Å; Y739-D830 PolarHBondContact N-OD2 3.24Å; Y739-D830 WeakPolarHBondContact O-CB 3.35Å; Y739-D830 PolarHBondContact O-N 3.05Å
831	I	87.9	Confident	81.8	Confident	20.5 Å²	20.5	45.6 Å²	45.6	11%	0.105	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	147.8	-177.6	68.7	167.4	0	0	0	110.6	T704 V731 K732 L733 V734 F740 V827 G829 A834	T704-I831 VanDerWaalsContact CB-CD1 3.48Å; T704-I831 HydrophobicContact CG2-CD1 3.57Å; T704-I831 HydrophobicContact CG2-CG1 4.22Å; T704-I831 PolarHBondContact OG1-O 3.19Å; V731-I831 HydrophobicContact CG1-CB 3.98Å; V731-I831 HydrophobicContact CG1-CG2 3.4Å; V731-I831 VanDerWaalsContact CG1-CG2 3.5Å; K732-I831 CarbonylContact O-C 3.57Å; K732-I831 WeakPolarHBondContact O-CA 3.47Å; L733-I831 HydrophobicContact CD2-CG2 3.87Å; V734-I831 VanDerWaalsContact CG1-C 3.5Å; F740-I831 HydrophobicContact CB-CG2 3.89Å; F740-I831 HydrophobicContact CD2-CG2 4.24Å; F740-I831 HydrophobicContact CG-CG2 4.34Å; V827-I831 HydrophobicContact CB-CD1 4.46Å; V827-I831 HydrophobicContact CG1-CD1 4.1Å; V827-I831 VanDerWaalsContact O-CD1 3.29Å; V827-I831 WeakPolarHBondContact O-CD1 3.36Å; G829-I831 PolarHBondContact O-N 3.19Å; I831-A834 HydrophobicContact CD1-CB 4.09Å
832	A	80	Confident	80.3	Confident	42 Å²	42	48 Å²	48	35%	0.347	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	-23.8	172.4	0	0	0	0	0	112.4	T700 T704 K732 V734	T700-A832 HydrophobicContact CG2-CB 3.55Å; T704-A832 PolarHBondContact OG1-N 2.88Å; K732-A832 HydrophobicContact CB-CB 4.46Å; K732-A832 HydrophobicContact CD-CB 4.06Å; K732-A832 HydrophobicContact CG-CB 4.21Å; K732-A832 PolarHBondContact O-N 3Å; V734-A832 HydrophobicContact CG1-CB 4.22Å
833	S	79.1	Confident	78.3	Confident	51 Å²	51	55 Å²	55	36%	0.357	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.4	157	169.2	60.2	0	0	0	0	111.2	K732	K732-S833 PolarHBondContact N-O 3.1Å; K732-S833 PolarHBondContact O-N 2.68Å
834	A	77.6	Confident	75.7	Confident	27.75 Å²	27.75	55.4 Å²	55.4	23%	0.229	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	135.7	173.4	0	0	0	0	0	112	Q706 T730 V731 V827 I831 V836	Q706-A834 HydrophobicContact CB-CB 4.39Å; Q706-A834 PolarHBondContact OE1-O 3.44Å; T730-A834 CarbonylContact O-C 3.41Å; T730-A834 VanDerWaalsContact O-CA 3.3Å; T730-A834 WeakPolarHBondContact O-CA 3.33Å; V731-A834 HydrophobicContact CG1-CB 4.44Å; V731-A834 HydrophobicContact CG2-CB 4.25Å; V827-A834 HydrophobicContact CB-CB 3.92Å; V827-A834 HydrophobicContact CG1-CB 4.05Å; V827-A834 HydrophobicContact CG2-CB 4.43Å; I831-A834 HydrophobicContact CD1-CB 4.09Å; A834-V836 HydrophobicContact CB-CG2 4.48Å
835	V	75.3	Confident	73.2	Confident	79.75 Å²	79.75	56.8 Å²	56.8	48%	0.483	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	112.2	174.3	-180	0	0	0	0	109.1	A729 T730 R837	A729-V835 WeakPolarHBondContact CA-O 3.32Å; T730-V835 PolarHBondContact N-O 2.88Å; T730-V835 PolarHBondContact O-N 3.06Å; V835-R837 HydrophobicContact CG1-CG 4.49Å
836	V	78.2	Confident	70.4	Confident	28.5 Å²	28.5	64.2 Å²	64.2	17%	0.173	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	137.9	-176.1	-173.5	0	0	0	0	111.8	W708 I727 Q728 A729 V825 V827 A834 V838	W708-V836 HydrophobicContact CB-CB 4.19Å; W708-V836 HydrophobicContact CB-CG1 3.99Å; I727-V836 HydrophobicContact CG2-CG1 4.16Å; Q728-V836 CarbonylContact O-C 3.55Å; Q728-V836 WeakPolarHBondContact O-CA 3.39Å; A729-V836 HydrophobicContact CB-CG2 4.11Å; V825-V836 HydrophobicContact CB-CG1 3.88Å; V825-V836 HydrophobicContact CG1-CG1 3.72Å; V825-V836 HydrophobicContact CG1-CG2 4.38Å; V825-V836 HydrophobicContact CG2-CG1 4.35Å; V827-V836 HydrophobicContact CG2-CG2 3.73Å; A834-V836 HydrophobicContact CB-CG2 4.48Å; V836-V838 HydrophobicContact CG1-CG2 4.33Å
837	R	77	Confident	67.5	Low	113.75 Å²	113.75	67.5 Å²	67.5	43%	0.429	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	126.9	178	-64.3	174.4	171.9	-153	-0.1	109.7	I727 Q728 V835	I727-R837 CarbonylContact C-O 3.44Å; I727-R837 WeakPolarHBondContact CA-O 3.42Å; Q728-R837 HydrophobicContact CB-CB 4.48Å; Q728-R837 PolarHBondContact N-O 3.02Å; Q728-R837 PolarHBondContact O-N 2.84Å; V835-R837 HydrophobicContact CG1-CG 4.49Å
838	V	80.5	Confident	64.6	Low	42.25 Å²	42.25	72.5 Å²	72.5	26%	0.256	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	132.5	178.9	-175.7	0	0	0	0	109.6	W708 L724 I727 V822 V825 V836 H840	W708-V838 HydrophobicContact CD2-CB 4.15Å; W708-V838 HydrophobicContact CD2-CG2 3.67Å; W708-V838 HydrophobicContact CE3-CB 4.01Å; W708-V838 HydrophobicContact CE3-CG2 3.44Å; W708-V838 VanDerWaalsContact CE3-CG2 3.44Å; W708-V838 HydrophobicContact CG-CG2 4.34Å; W708-V838 HydrophobicContact CH2-CB 3.72Å; W708-V838 HydrophobicContact CH2-CG1 4.04Å; W708-V838 HydrophobicContact CH2-CG2 4.12Å; W708-V838 HydrophobicContact CZ2-CB 3.85Å; W708-V838 HydrophobicContact CZ2-CG2 4.31Å; W708-V838 HydrophobicContact CZ3-CB 3.8Å; W708-V838 HydrophobicContact CZ3-CG1 4.07Å; W708-V838 HydrophobicContact CZ3-CG2 3.69Å; L724-V838 HydrophobicContact CD1-CG1 3.71Å; I727-V838 HydrophobicContact CG1-CG1 4.4Å; I727-V838 HydrophobicContact CG1-CG2 4.38Å; I727-V838 HydrophobicContact CG2-CG2 4.35Å; V822-V838 HydrophobicContact CB-CG1 4.15Å; V822-V838 HydrophobicContact CG1-CG1 4.37Å; V822-V838 HydrophobicContact CG1-CG2 4.41Å; V822-V838 HydrophobicContact CG2-CG1 4.19Å; V825-V838 HydrophobicContact CG2-CG2 3.76Å; V836-V838 HydrophobicContact CG1-CG2 4.33Å; V838-H840 VanDerWaalsContact CG1-CE1 3.49Å; V838-H840 WeakPolarHBondContact CG1-CE1 3.33Å
839	A	76.7	Confident	61.9	Low	22.5 Å²	22.5	81.5 Å²	81.5	19%	0.186	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	120.6	176.4	0	0	0	0	0	111	M681 R725 S726	M681-A839 HydrophobicContact CE-CB 3.79Å; M681-A839 HydrophobicContact SD-CB 4.4Å; R725-A839 WeakPolarHBondContact CA-O 3.43Å; R725-A839 HydrophobicContact CB-CB 4.28Å; R725-A839 WeakPolarHBondContact CB-O 3.33Å; R725-A839 PolarHBondContact N-O 3.04Å; S726-A839 PolarHBondContact N-O 3.17Å; S726-A839 VanDerWaalsContact N-O 3.1Å; S726-A839 PolarHBondContact O-N 3.07Å
840	H	78	Confident	58.9	Low	54 Å²	54	85.4 Å²	85.4	25%	0.25	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	148.6	169.2	-50.9	93.7	0	0	0	111.1	E710 V722 M723 V822 V838 K842	E710-H840 IonicContact OE1-CE1 3.53Å; E710-H840 PolarHBondContact OE1-CE1 2.81Å; E710-H840 IonicContact OE1-ND1 3.28Å; V722-H840 HydrophobicContact CG1-CB 3.38Å; V722-H840 VanDerWaalsContact CG1-CB 3.45Å; M723-H840 CarbonylContact O-C 3.53Å; M723-H840 VanDerWaalsContact O-CA 3.28Å; M723-H840 WeakPolarHBondContact O-CA 3.22Å; M723-H840 WeakPolarHBondContact O-CB 3.38Å; V822-H840 PolarHBondContact N-NE2 3.06Å; V822-H840 VanDerWaalsContact N-NE2 3.13Å; V838-H840 VanDerWaalsContact CG1-CE1 3.49Å; V838-H840 WeakPolarHBondContact CG1-CE1 3.33Å; H840-K842 PolarHBondContact O-N 3.22Å
841	V	65.1	Low	56	Low	64.25 Å²	64.25	89.3 Å²	89.3	39%	0.389	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	127.5	173.1	178.7	0	0	0	0	109	M723 R725 R843	M723-V841 PolarHBondContact N-O 2.92Å; M723-V841 PolarHBondContact O-N 2.84Å; R725-V841 HydrophobicContact CB-CG2 3.85Å; R725-V841 HydrophobicContact CG-CG2 4.26Å; V841-R843 PolarHBondContact O-N 3.24Å; V841-R843 VanDerWaalsContact O-N 3.08Å
842	K	49.7	Very low	53	Low	141.5 Å²	141.5	96.9 Å²	96.9	62%	0.615	51%	0.509	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.2	115.1	161.2	-79.5	-174.5	175.2	-171	0	107.8	S720 V722 H840 V844	S720-K842 WeakPolarHBondContact OG-CE 3.42Å; V722-K842 HydrophobicContact CG2-CD 4.42Å; V722-K842 HydrophobicContact CG2-CG 3.96Å; H840-K842 PolarHBondContact O-N 3.22Å; K842-V844 PolarHBondContact O-N 3.37Å; K842-V844 VanDerWaalsContact O-N 3.11Å
843	R	43	Very low	50.6	Low	158 Å²	158	97.7 Å²	97.7	60%	0.596	52%	0.521	S	S	*	.			trans	-68.5	112.7	169.9	-110.8	-174.7	-178	-179.8	1.7	108.5	S721 D799 V841 A845	S721-R843 WeakPolarHBondContact O-CA 3.12Å; S721-R843 WeakPolarHBondContact O-CB 3.49Å; S721-R843 PolarHBondContact O-N 3.07Å; D799-R843 IonicContact OD1-CZ 3.2Å; D799-R843 IonicContact OD1-NH2 4Å; D799-R843 PolarHBondContact OD1-NH2 2.88Å; V841-R843 PolarHBondContact O-N 3.24Å; V841-R843 VanDerWaalsContact O-N 3.08Å; R843-A845 VanDerWaalsContact C-N 3.27Å; R843-A845 PolarHBondContact O-N 2.97Å
844	V	31.1	Very low	48.2	Very low	116.5 Å²	116.5	104.5 Å²	104.5	71%	0.706	55%	0.548	S	S	*	.			trans	-82.2	117.1	162.7	179.5	0	0	0	0	105.8	K842 R846	K842-V844 PolarHBondContact O-N 3.37Å; K842-V844 VanDerWaalsContact O-N 3.11Å; V844-R846 PolarHBondContact O-N 3.19Å
845	A	32.5	Very low	46	Very low	82 Å²	82	106.5 Å²	106.5	68%	0.678	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-60.4	129.7	172.2	0	0	0	0	0	108.8	R843	R843-A845 VanDerWaalsContact C-N 3.27Å; R843-A845 PolarHBondContact O-N 2.97Å
846	R	27.9	Very low	43.9	Very low	167 Å²	167	111 Å²	111	63%	0.63	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-69.1	134.6	169.2	-75	-178.7	170.7	-178.4	0.9	108.4	Q798 D799 V844 T848	Q798-R846 VanDerWaalsContact CG-NH2 3.28Å; D799-R846 IonicContact OD1-CZ 3.68Å; D799-R846 IonicContact OD1-NH1 2.84Å; D799-R846 IonicContact OD1-NH2 2.75Å; D799-R846 PolarHBondContact OD1-NH2 2.81Å; D799-R846 IonicContact OD2-CZ 3.89Å; D799-R846 VanDerWaalsContact OD2-CZ 3.28Å; D799-R846 IonicContact OD2-NH1 3.33Å; D799-R846 PolarHBondContact OD2-NH1 3.24Å; D799-R846 IonicContact OD2-NH2 3.51Å; D799-R846 PolarHBondContact OD2-NH2 2.8Å; V844-R846 PolarHBondContact O-N 3.19Å; R846-T848 PolarHBondContact O-N 2.98Å
847	P	26.5	Very low	41.7	Very low	104.25 Å²	104.25	114.4 Å²	114.4	68%	0.677	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-66.3	119.7	166.8	25	-26.3	0	0	0	108.8	Y849	P847-Y849 VanDerWaalsContact C-N 3.34Å; P847-Y849 HydrophobicContact CB-CD2 4.14Å; P847-Y849 HydrophobicContact CB-CE2 4.24Å; P847-Y849 HydrophobicContact CG-CD2 4.33Å; P847-Y849 HydrophobicContact CG-CE2 4.31Å; P847-Y849 PolarHBondContact O-N 2.97Å
848	T	26.6	Very low	39.5	Very low	116 Å²	116	114.7 Å²	114.7	71%	0.712	62%	0.618	S	S	*	*			trans	-80.7	112.6	168.7	-47.2	0	0	0	0	107.6	R846 V850	R846-T848 PolarHBondContact O-N 2.98Å; T848-V850 HydrophobicContact CG2-CG2 4.36Å; T848-V850 PolarHBondContact O-N 2.76Å; T848-V850 VanDerWaalsContact O-N 3.1Å
849	Y	27.4	Very low	37.4	Very low	201.75 Å²	201.75	117.5 Å²	117.5	79%	0.791	64%	0.635	S	S	*	*			trans	-91	120.1	168.2	-80.9	-89.4	0	0	0	108.8	P847 I851	P847-Y849 VanDerWaalsContact C-N 3.34Å; P847-Y849 HydrophobicContact CB-CD2 4.14Å; P847-Y849 HydrophobicContact CB-CE2 4.24Å; P847-Y849 HydrophobicContact CG-CD2 4.33Å; P847-Y849 HydrophobicContact CG-CE2 4.31Å; P847-Y849 PolarHBondContact O-N 2.97Å; Y849-I851 PolarHBondContact O-N 2.78Å
850	V	26	Very low	35.3	Very low	112 Å²	112	121.9 Å²	121.9	68%	0.679	66%	0.655	S	S	*	*			trans	-105.8	129.4	169.3	-177.4	0	0	0	0	107.3	T848 Q852	T848-V850 HydrophobicContact CG2-CG2 4.36Å; T848-V850 PolarHBondContact O-N 2.76Å; T848-V850 VanDerWaalsContact O-N 3.1Å; V850-Q852 HydrophobicContact CG1-CG 4.34Å
851	I	29	Very low	33.2	Very low	129.25 Å²	129.25	125.5 Å²	125.5	66%	0.663	68%	0.676	S	S	*	*			trans	-115.8	121.9	166.6	-56.2	175.4	0	0	0	108.5	K672 K673 Y714 Y849 G853	K672-I851 VanDerWaalsContact O-CG2 3.31Å; K672-I851 WeakPolarHBondContact O-CG2 3.41Å; K673-I851 WeakPolarHBondContact CD-O 3.44Å; K673-I851 WeakPolarHBondContact CE-O 3.49Å; K673-I851 WeakPolarHBondContact CG-O 3.49Å; Y714-I851 HydrophobicContact CD1-CD1 4.39Å; Y714-I851 HydrophobicContact CE1-CD1 4.27Å; Y714-I851 HydrophobicContact CE1-CG1 4.01Å; Y849-I851 PolarHBondContact O-N 2.78Å; I851-G853 PolarHBondContact O-N 3.01Å
852	Q	26.4	Very low	31.7	Very low	181 Å²	181	125.8 Å²	125.8	85%	0.846	69%	0.686	S	S	*	*			trans	-91.9	144.7	169	-71.6	174.8	-33.5	0	0	109.2	K672 V850	K672-Q852 CarbonylContact O-C 3.54Å; V850-Q852 HydrophobicContact CG1-CG 4.34Å
853	G	29.2	Very low	30.8	Very low	58 Å²	58	127.3 Å²	127.3	60%	0.598	69%	0.692	S	S	*	*			trans	167.2	99	178	0	0	0	0	0	113.6	K672 I851	K672-G853 WeakPolarHBondContact CD-O 3.34Å; K672-G853 PolarHBondContact NZ-O 3.31Å; I851-G853 PolarHBondContact O-N 3.01Å
854	Q	28.8	Very low	30.3	Very low	195 Å²	195	127.4 Å²	127.4	91%	0.911	70%	0.699	S	S	*	*			trans	47.7	129.4	138.8	-79.3	168.3	-54.9	0	0	114.4	K672	K672-Q854 PolarHBondContact NZ-O 2.73Å
855	G	31.6	Very low	30.4	Very low	69.5 Å²	69.5	129.4 Å²	129.4	72%	0.716	70%	0.701	S	S	*	*			trans	173	131.6	146.9	0	0	0	0	0	110.1
856	E	31.1	Very low	30.3	Very low	173.25 Å²	173.25	129.5 Å²	129.5	81%	0.81	70%	0.695	S	S	*	*				70.7	138	58.9	-99.1	-174.9	173.1	0	0	115.4	K682	K682-E856 WeakPolarHBondContact CD-O 3.25Å; K682-E856 WeakPolarHBondContact CE-O 3.31Å; K682-E856 PolarHBondContact NZ-O 3.08Å
857	T	31.7	Very low	30.4	Very low	100.25 Å²	100.25	128.2 Å²	128.2	62%	0.615	70%	0.696	S	S	*	*				-171.8	148.9	57.2	34.6	0	0	0	0	115.3
858	D	31.7	Very low	30.6	Very low	121 Å²	121	130.8 Å²	130.8	65%	0.647	70%	0.699	S	S	*	*				76	145.5	122.7	-72.4	-14.3	0	0	0	120.2	M681 K682	M681-D858 CarbonylContact O-C 3.58Å; M681-D858 WeakPolarHBondContact O-CA 3.41Å; K682-D858 WeakPolarHBondContact CE-OD1 3.46Å; K682-D858 VanDerWaalsContact CG-OD1 3.32Å; K682-D858 WeakPolarHBondContact CG-OD1 3.39Å; K682-D858 IonicContact NZ-OD1 3.85Å
859	T	34.6	Very low	30.8	Very low	99.5 Å²	99.5	133.1 Å²	133.1	61%	0.61	70%	0.701	S	S	*	*			trans	105	133.9	146.1	49.9	0	0	0	0	116.7	M681	M681-T859 VanDerWaalsContact CA-C 3.46Å; M681-T859 WeakPolarHBondContact CB-O 3.24Å; M681-T859 PolarHBondContact O-N 2.98Å
860	D	33.2	Very low	31	Very low	115.75 Å²	115.75	128.9 Å²	128.9	62%	0.619	70%	0.697	S	S	*	*			cis	-153	-179.4	38.1	-114.2	-38	0	0	0	111.2	V679 H680 M681 R725	V679-D860 WeakPolarHBondContact CG1-O 3.15Å; H680-D860 VanDerWaalsContact N-N 3.16Å; M681-D860 VanDerWaalsContact CA-OD2 3.26Å; M681-D860 WeakPolarHBondContact CA-OD2 3.47Å; M681-D860 VanDerWaalsContact CB-CA 3.48Å; M681-D860 HydrophobicContact CB-CB 3.51Å; M681-D860 WeakPolarHBondContact CB-OD1 3.43Å; M681-D860 WeakPolarHBondContact CB-OD2 3.24Å; M681-D860 HydrophobicContact CG-CB 4.35Å; M681-D860 WeakPolarHBondContact CG-OD1 3.37Å; M681-D860 VanDerWaalsContact CG-OD2 3.28Å; M681-D860 WeakPolarHBondContact CG-OD2 3.45Å; M681-D860 PolarHBondContact N-OD2 2.76Å; R725-D860 IonicContact CZ-OD1 2.63Å; R725-D860 IonicContact CZ-OD2 3.33Å; R725-D860 VanDerWaalsContact NH1-CG 3.26Å; R725-D860 IonicContact NH1-OD1 2.71Å; R725-D860 PolarHBondContact NH1-OD1 2.96Å; R725-D860 IonicContact NH1-OD2 3.79Å; R725-D860 PolarHBondContact NH1-OD2 2.82Å; R725-D860 IonicContact NH2-OD2 3.54Å
861	D	33.5	Very low	31.1	Very low	130.25 Å²	130.25	134.2 Å²	134.2	70%	0.697	71%	0.705	S	S	*	*			trans	-152.7	152.4	148.2	-108.4	-34.9	0	0	0	114.8	V678 V679 R725 K863	V678-D861 VanDerWaalsContact O-CB 3.26Å; V678-D861 WeakPolarHBondContact O-CB 3.31Å; V679-D861 VanDerWaalsContact CG1-N 3.29Å; R725-D861 IonicContact CZ-OD1 2.86Å; R725-D861 IonicContact CZ-OD2 3.64Å; R725-D861 IonicContact NH2-OD1 3.2Å; R725-D861 PolarHBondContact NH2-OD1 3.39Å; R725-D861 IonicContact NH2-OD2 2.78Å; R725-D861 PolarHBondContact NH2-OD2 2.71Å; D861-K863 IonicContact OD1-NZ 2.73Å
862	A	33.5	Very low	31.1	Very low	70.25 Å²	70.25	137.9 Å²	137.9	58%	0.581	72%	0.716	S	S	*	*			trans	128.1	127.7	135.9	0	0	0	0	0	117.6	N677 V678	N677-A862 CarbonylContact C-O 3.53Å; N677-A862 WeakPolarHBondContact CA-O 3.47Å; N677-A862 WeakPolarHBondContact CB-O 3.33Å; N677-A862 PolarHBondContact OD1-O 2.76Å; V678-A862 PolarHBondContact N-O 3.5Å; V678-A862 WeakPolarHBondContact O-CB 3.17Å
863	K	31.2	Very low	31.2	Very low	172.75 Å²	172.75	140.7 Å²	140.7	75%	0.751	72%	0.719	S	S	*	*			trans	67	123.1	138.9	-71.5	168.9	-160.5	153.2	0	116.6	T675 V676 N677 D861	T675-K863 CarbonylContact C-O 3.55Å; V676-K863 CarbonylContact C-O 3.54Å; V676-K863 WeakPolarHBondContact CA-O 3.25Å; V676-K863 PolarHBondContact N-O 2.93Å; N677-K863 VanDerWaalsContact OD1-C 3.23Å; N677-K863 WeakPolarHBondContact OD1-CA 3.49Å; N677-K863 PolarHBondContact OD1-N 3.38Å; D861-K863 IonicContact OD1-NZ 2.73Å
864	Q	32.5	Very low	31.2	Very low	159.75 Å²	159.75	142.9 Å²	142.9	75%	0.746	72%	0.72	S	S	*	*			trans	132.8	147.2	144.4	-88.7	146.8	21	0	0	115.1	T675 N677 G808	T675-Q864 CarbonylContact O-C 3.56Å; T675-Q864 WeakPolarHBondContact O-CA 3.33Å; T675-Q864 VanDerWaalsContact O-CB 3.28Å; T675-Q864 WeakPolarHBondContact O-CB 3.22Å; N677-Q864 VanDerWaalsContact CG-O 3.26Å; N677-Q864 PolarHBondContact ND2-O 2.89Å; N677-Q864 VanDerWaalsContact ND2-O 3.13Å; N677-Q864 PolarHBondContact OD1-N 2.84Å; N677-Q864 PolarHBondContact OD1-O 3.31Å; G808-Q864 PolarHBondContact O-NE2 2.94Å; G808-Q864 VanDerWaalsContact O-NE2 3.14Å
865	Q	32.6	Very low	31.3	Very low	158.5 Å²	158.5	138 Å²	138	74%	0.741	70%	0.701	S	S	*	*				-149.7	176.6	118.1	-97	-175.5	-33.8	0	0	110.3	E630 T675	E630-Q865 PolarHBondContact OE1-NE2 2.9Å; T675-Q865 CarbonylContact O-C 3.56Å; T675-Q865 WeakPolarHBondContact O-CA 3.23Å; T675-Q865 PolarHBondContact O-N 2.83Å
866	P	30.9	Very low	31.3	Very low	85.25 Å²	85.25	141.9 Å²	141.9	55%	0.554	70%	0.704	S	S	*	*			cis	-110	145.9	-46.6	20.5	-7.2	0	0	0	116.6	K673 C674 T675	K673-P866 VanDerWaalsContact C-C 3.43Å; K673-P866 CarbonylContact C-O 3.54Å; K673-P866 VanDerWaalsContact CA-O 3.23Å; K673-P866 WeakPolarHBondContact CA-O 3.43Å; K673-P866 WeakPolarHBondContact CD-O 3.46Å; K673-P866 WeakPolarHBondContact CE-O 3.37Å; K673-P866 HydrophobicContact CG-CB 4.37Å; K673-P866 WeakPolarHBondContact CG-O 3.46Å; K673-P866 PolarHBondContact NZ-O 3.38Å; K673-P866 VanDerWaalsContact O-CB 3.31Å; K673-P866 WeakPolarHBondContact O-CB 3.19Å; C674-P866 HydrophobicContact CB-CB 3.43Å; C674-P866 VanDerWaalsContact CB-CB 3.43Å; C674-P866 HydrophobicContact CB-CG 2.69Å; C674-P866 PolarHBondContact N-O 3.13Å; C674-P866 WeakPolarHBondContact O-CA 3.48Å; C674-P866 WeakPolarHBondContact O-CB 3.33Å; C674-P866 VanDerWaalsContact O-CG 3.25Å; C674-P866 WeakPolarHBondContact O-CG 3.43Å; C674-P866 VanDerWaalsContact O-N 3.09Å; C674-P866 WeakPolarHBondContact SG-CD 3.46Å; C674-P866 WeakPolarHBondContact SG-CG 3.23Å; T675-P866 VanDerWaalsContact N-N 3.14Å; T675-P866 WeakPolarHBondContact O-CD 3.02Å
867	Q	30.7	Very low	31.5	Very low	139.75 Å²	139.75	142.6 Å²	142.6	65%	0.653	70%	0.699	S	S	*	*			trans	-52.2	140.5	170.1	-57.3	-173.1	-49.6	0	0	117.5	V671 K672 K673 C674	V671-Q867 HydrophobicContact CB-CG 4.43Å; V671-Q867 HydrophobicContact CG1-CB 4.31Å; V671-Q867 VanDerWaalsContact CG1-CD 3.47Å; V671-Q867 HydrophobicContact CG1-CG 3.58Å; K672-Q867 VanDerWaalsContact C-OE1 3.23Å; K672-Q867 HydrophobicContact CB-CB 3.86Å; K673-Q867 WeakPolarHBondContact CD-O 3.25Å; K673-Q867 PolarHBondContact NZ-O 2.74Å; C674-Q867 VanDerWaalsContact N-CD 3.33Å
868	E	30.7	Very low	31.7	Very low	157.5 Å²	157.5	147.1 Å²	147.1	74%	0.736	71%	0.705	S	S	*	*				-159.9	131.8	129.8	-95.2	-169.1	126.3	0	0	112.3	K672 K673	K672-E868 VanDerWaalsContact CB-N 3.33Å; K672-E868 WeakPolarHBondContact CB-O 3.25Å; K673-E868 HydrophobicContact CB-CB 4.24Å; K673-E868 HydrophobicContact CD-CB 3.36Å; K673-E868 HydrophobicContact CG-CB 4.35Å
869	E	31.3	Very low	31.9	Very low	164.25 Å²	164.25	147.4 Å²	147.4	77%	0.768	71%	0.706	S	S	*	*				-153.2	144.4	121.7	-94.1	-156.7	154.3	0	0	115.3	K672 R871	K672-E869 HydrophobicContact CB-CB 4.48Å; K672-E869 PolarHBondContact NZ-O 3.11Å; E869-R871 PolarHBondContact O-N 3.12Å
870	T	31	Very low	32.2	Very low	114.75 Å²	114.75	149.3 Å²	149.3	70%	0.704	71%	0.708	S	S	*	*			trans	-5	126	171.9	33.1	0	0	0	0	119.6
871	R	28.1	Very low	32.7	Very low	223.25 Å²	223.25	149.1 Å²	149.1	84%	0.842	70%	0.703	S	S	*	*			trans	73.8	123.3	130.4	-79.2	177	178.2	176.6	0.7	115.8	E869	E869-R871 PolarHBondContact O-N 3.12Å
872	K	29.5	Very low	33.6	Very low	206.25 Å²	206.25	147.6 Å²	147.6	90%	0.897	69%	0.691	S	S	*	*			trans	-161.7	147.9	137.6	-98.8	162.9	-174.8	175.2	0	114.1	V874	K872-V874 PolarHBondContact O-N 3.15Å
873	R	28	Very low	34.8	Very low	240.5 Å²	240.5	148.5 Å²	148.5	91%	0.908	68%	0.683	S	S	*	*			trans	-74	129.6	178.3	-97.7	-166.8	176	163.9	-2.2	112.2
874	V	29.1	Very low	36.2	Very low	102.75 Å²	102.75	143.2 Å²	143.2	62%	0.623	66%	0.658	S	S	*	*			trans	-105.4	124.6	156.5	178.2	0	0	0	0	109.4	K872 L876 R878 E881	K872-V874 PolarHBondContact O-N 3.15Å; V874-L876 HydrophobicContact CG2-CD1 4.36Å; V874-L876 PolarHBondContact O-N 2.89Å; V874-R878 HydrophobicContact CB-CG 4.45Å; V874-R878 HydrophobicContact CG1-CG 3.41Å; V874-R878 VanDerWaalsContact CG1-CG 3.41Å; V874-E881 WeakPolarHBondContact CG1-OE1 3.35Å
875	D	31.1	Very low	37.4	Very low	93.25 Å²	93.25	139.2 Å²	139.2	50%	0.499	65%	0.645	S	S	.	*			trans	-71.8	132.7	133.5	-163.4	-10.1	0	0	0	111.4	R877	D875-R877 HydrophobicContact CB-CG 4.4Å; D875-R877 VanDerWaalsContact CG-NE 3.28Å; D875-R877 PolarHBondContact O-N 2.95Å; D875-R877 VanDerWaalsContact O-N 3.13Å; D875-R877 WeakPolarHBondContact OD1-CB 3.17Å; D875-R877 VanDerWaalsContact OD1-CG 3.24Å; D875-R877 WeakPolarHBondContact OD1-CG 3.4Å; D875-R877 IonicContact OD1-CZ 3.34Å; D875-R877 PolarHBondContact OD1-N 3.36Å; D875-R877 IonicContact OD1-NE 3.15Å; D875-R877 PolarHBondContact OD1-NE 2.9Å; D875-R877 VanDerWaalsContact OD2-CD 3.29Å; D875-R877 WeakPolarHBondContact OD2-CD 3.32Å; D875-R877 WeakPolarHBondContact OD2-CG 3.5Å; D875-R877 IonicContact OD2-CZ 3.41Å; D875-R877 VanDerWaalsContact OD2-CZ 3.27Å; D875-R877 IonicContact OD2-NE 2.99Å; D875-R877 PolarHBondContact OD2-NE 3.14Å; D875-R877 IonicContact OD2-NH2 3.6Å; D875-R877 PolarHBondContact OD2-NH2 3.37Å
876	L	32.3	Very low	38.6	Very low	150.75 Å²	150.75	132.5 Å²	132.5	79%	0.789	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	10.1	-177.9	-72.6	165.6	0	0	0	115.3	V874 R878 L879 Q880	V874-L876 HydrophobicContact CG2-CD1 4.36Å; V874-L876 PolarHBondContact O-N 2.89Å; L876-R878 PolarHBondContact O-N 2.71Å; L876-L879 PolarHBondContact O-N 2.96Å; L876-Q880 PolarHBondContact O-NE2 3.49Å; L876-Q880 VanDerWaalsContact O-NE2 3.13Å
877	R	35.2	Very low	40	Very low	188.25 Å²	188.25	133.1 Å²	133.1	71%	0.71	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	-9.7	-178.9	-63.7	-174.3	-168.5	-157.6	0.7	116	D875 L879 Q880 E881	D875-R877 HydrophobicContact CB-CG 4.4Å; D875-R877 VanDerWaalsContact CG-NE 3.28Å; D875-R877 PolarHBondContact O-N 2.95Å; D875-R877 VanDerWaalsContact O-N 3.13Å; D875-R877 WeakPolarHBondContact OD1-CB 3.17Å; D875-R877 VanDerWaalsContact OD1-CG 3.24Å; D875-R877 WeakPolarHBondContact OD1-CG 3.4Å; D875-R877 IonicContact OD1-CZ 3.34Å; D875-R877 PolarHBondContact OD1-N 3.36Å; D875-R877 IonicContact OD1-NE 3.15Å; D875-R877 PolarHBondContact OD1-NE 2.9Å; D875-R877 VanDerWaalsContact OD2-CD 3.29Å; D875-R877 WeakPolarHBondContact OD2-CD 3.32Å; D875-R877 WeakPolarHBondContact OD2-CG 3.5Å; D875-R877 IonicContact OD2-CZ 3.41Å; D875-R877 VanDerWaalsContact OD2-CZ 3.27Å; D875-R877 IonicContact OD2-NE 2.99Å; D875-R877 PolarHBondContact OD2-NE 3.14Å; D875-R877 IonicContact OD2-NH2 3.6Å; D875-R877 PolarHBondContact OD2-NH2 3.37Å; R877-L879 VanDerWaalsContact C-N 3.29Å; R877-L879 PolarHBondContact O-N 3.27Å; R877-L879 VanDerWaalsContact O-N 3.08Å; R877-Q880 HydrophobicContact CB-CB 4.12Å; R877-Q880 HydrophobicContact CB-CG 4.13Å; R877-Q880 HydrophobicContact CG-CG 4.48Å; R877-Q880 CarbonylContact O-C 3.46Å; R877-Q880 WeakPolarHBondContact O-CA 3.45Å; R877-Q880 WeakPolarHBondContact O-CB 3.29Å; R877-Q880 PolarHBondContact O-N 2.95Å; R877-E881 PolarHBondContact O-N 3.09Å
878	R	35.7	Very low	41.4	Very low	195.5 Å²	195.5	127.4 Å²	127.4	74%	0.738	58%	0.584	S	S	*	*	G	3₁₀ helix	trans	-80.1	-8.2	-173	-93.9	-173.7	163.8	162.1	4	116.7	V874 L876 Q880 E881 K882	V874-R878 HydrophobicContact CB-CG 4.45Å; V874-R878 HydrophobicContact CG1-CG 3.41Å; V874-R878 VanDerWaalsContact CG1-CG 3.41Å; L876-R878 PolarHBondContact O-N 2.71Å; R878-Q880 VanDerWaalsContact C-N 3.3Å; R878-Q880 PolarHBondContact O-N 2.81Å; R878-E881 HydrophobicContact CB-CB 4.46Å; R878-E881 HydrophobicContact CG-CG 4.26Å; R878-E881 WeakPolarHBondContact CG-OE2 3.41Å; R878-E881 IonicContact CZ-OE1 2.69Å; R878-E881 IonicContact CZ-OE2 3.43Å; R878-E881 VanDerWaalsContact NE-CD 3.3Å; R878-E881 IonicContact NE-OE1 3.39Å; R878-E881 IonicContact NE-OE2 3.25Å; R878-E881 PolarHBondContact NE-OE2 2.93Å; R878-E881 IonicContact NH2-OE1 3.42Å; R878-E881 PolarHBondContact NH2-OE1 3.48Å; R878-E881 IonicContact NH2-OE2 3.28Å; R878-E881 PolarHBondContact NH2-OE2 3.17Å; R878-E881 PolarHBondContact O-N 3.11Å; R878-K882 VanDerWaalsContact O-CE 3.25Å; R878-K882 WeakPolarHBondContact O-CE 3.31Å
879	L	35.2	Very low	42.6	Very low	126 Å²	126	123.4 Å²	123.4	66%	0.66	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-87.2	-0.9	175.3	-83.2	160.9	0	0	0	114.4	L876 R877 E881 K882 L907	L876-L879 PolarHBondContact O-N 2.96Å; R877-L879 VanDerWaalsContact C-N 3.29Å; R877-L879 PolarHBondContact O-N 3.27Å; R877-L879 VanDerWaalsContact O-N 3.08Å; L879-E881 PolarHBondContact O-N 2.91Å; L879-K882 HydrophobicContact CD2-CD 3.71Å; L879-K882 HydrophobicContact CD2-CG 4.34Å; L879-L907 HydrophobicContact CD2-CD1 4.48Å
880	Q	40.8	Very low	43.3	Very low	139.75 Å²	139.75	117 Å²	117	65%	0.653	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-11.3	179.8	-61.5	-167.7	-10.8	0	0	115	L876 R877 R878 K882	L876-Q880 PolarHBondContact O-NE2 3.49Å; L876-Q880 VanDerWaalsContact O-NE2 3.13Å; R877-Q880 HydrophobicContact CB-CB 4.12Å; R877-Q880 HydrophobicContact CB-CG 4.13Å; R877-Q880 HydrophobicContact CG-CG 4.48Å; R877-Q880 CarbonylContact O-C 3.46Å; R877-Q880 WeakPolarHBondContact O-CA 3.45Å; R877-Q880 WeakPolarHBondContact O-CB 3.29Å; R877-Q880 PolarHBondContact O-N 2.95Å; R878-Q880 VanDerWaalsContact C-N 3.3Å; R878-Q880 PolarHBondContact O-N 2.81Å; Q880-K882 WeakPolarHBondContact O-CD 3.48Å; Q880-K882 WeakPolarHBondContact O-CG 3.33Å; Q880-K882 PolarHBondContact O-N 2.91Å; Q880-K882 PolarHBondContact O-NZ 2.86Å
881	E	43	Very low	44	Very low	112 Å²	112	117 Å²	117	52%	0.523	54%	0.535	S	S	.	.			trans	-95.4	68.9	178	-69.5	-166.3	166.7	0	0	111.9	V874 R877 R878 L879 E883	V874-E881 WeakPolarHBondContact CG1-OE1 3.35Å; R877-E881 PolarHBondContact O-N 3.09Å; R878-E881 HydrophobicContact CB-CB 4.46Å; R878-E881 HydrophobicContact CG-CG 4.26Å; R878-E881 WeakPolarHBondContact CG-OE2 3.41Å; R878-E881 IonicContact CZ-OE1 2.69Å; R878-E881 IonicContact CZ-OE2 3.43Å; R878-E881 VanDerWaalsContact NE-CD 3.3Å; R878-E881 IonicContact NE-OE1 3.39Å; R878-E881 IonicContact NE-OE2 3.25Å; R878-E881 PolarHBondContact NE-OE2 2.93Å; R878-E881 IonicContact NH2-OE1 3.42Å; R878-E881 PolarHBondContact NH2-OE1 3.48Å; R878-E881 IonicContact NH2-OE2 3.28Å; R878-E881 PolarHBondContact NH2-OE2 3.17Å; R878-E881 PolarHBondContact O-N 3.11Å; L879-E881 PolarHBondContact O-N 2.91Å; E881-E883 PolarHBondContact O-N 3.16Å
882	K	53	Low	44.7	Very low	98.5 Å²	98.5	115.6 Å²	115.6	43%	0.428	53%	0.53	S	S	.	.			trans	-62	45.4	174	-69	179.6	179	160.8	0	114.3	R878 L879 Q880 F901 K902 S903 K904 L905	R878-K882 VanDerWaalsContact O-CE 3.25Å; R878-K882 WeakPolarHBondContact O-CE 3.31Å; L879-K882 HydrophobicContact CD2-CD 3.71Å; L879-K882 HydrophobicContact CD2-CG 4.34Å; Q880-K882 WeakPolarHBondContact O-CD 3.48Å; Q880-K882 WeakPolarHBondContact O-CG 3.33Å; Q880-K882 PolarHBondContact O-N 2.91Å; Q880-K882 PolarHBondContact O-NZ 2.86Å; K882-F901 VanDerWaalsContact O-O 3.12Å; K882-K902 HydrophobicContact CB-CB 4.34Å; K882-K902 CarbonylContact O-C 3.58Å; K882-K902 VanDerWaalsContact O-CA 3.29Å; K882-K902 WeakPolarHBondContact O-CA 3.35Å; K882-S903 VanDerWaalsContact CB-O 3.25Å; K882-S903 WeakPolarHBondContact CB-O 3.32Å; K882-S903 WeakPolarHBondContact CD-O 3.28Å; K882-S903 WeakPolarHBondContact CG-O 3.34Å; K882-S903 PolarHBondContact O-N 3.2Å; K882-K904 PolarHBondContact NZ-O 3.34Å; K882-L905 WeakPolarHBondContact CE-O 3.41Å
883	E	58.5	Low	45.3	Very low	88.75 Å²	88.75	109.7 Å²	109.7	42%	0.415	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	122.9	-170.1	-168.1	163.4	-176.6	0	0	112	E881 T885 S900 F901 K902	E881-E883 PolarHBondContact O-N 3.16Å; E883-T885 HydrophobicContact CG-CG2 4.04Å; E883-T885 PolarHBondContact O-N 2.92Å; E883-S900 VanDerWaalsContact OE1-CB 3.27Å; E883-S900 WeakPolarHBondContact OE1-CB 3.39Å; E883-S900 PolarHBondContact OE1-OG 2.79Å; E883-F901 WeakPolarHBondContact CA-O 3.46Å; E883-K902 HydrophobicContact CB-CG 4.19Å; E883-K902 VanDerWaalsContact CD-CE 3.46Å; E883-K902 HydrophobicContact CG-CG 4.2Å; E883-K902 WeakPolarHBondContact OE1-CE 3.26Å; E883-K902 WeakPolarHBondContact OE2-CE 3.33Å; E883-K902 IonicContact OE2-NZ 3.12Å; E883-K902 PolarHBondContact OE2-NZ 2.74Å
884	W	61.6	Low	46.5	Very low	61.25 Å²	61.25	104.5 Å²	104.5	23%	0.232	49%	0.491	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	119.2	178	-70.6	63.8	0	0	0	108.9	S900 F901 L905 L907 F913 L915 L928 L933	W884-S900 WeakPolarHBondContact O-CA 3.36Å; W884-F901 HydrophobicContact CB-CD1 3.94Å; W884-F901 HydrophobicContact CB-CD2 4.3Å; W884-F901 HydrophobicContact CB-CE1 3.4Å; W884-F901 VanDerWaalsContact CB-CE1 3.42Å; W884-F901 HydrophobicContact CB-CE2 3.8Å; W884-F901 HydrophobicContact CB-CG 4.36Å; W884-F901 HydrophobicContact CB-CZ 3.31Å; W884-F901 VanDerWaalsContact CB-CZ 3.45Å; W884-F901 WeakPolarHBondContact CB-O 3.39Å; W884-F901 AromaticContact CD1-CE2 3.71Å; W884-F901 AromaticContact CD1-CZ 3.93Å; W884-F901 HydrophobicContact CD2-CE2 4.36Å; W884-F901 AromaticContact CD2-CZ 3.93Å; W884-F901 HydrophobicContact CD2-CZ 4.05Å; W884-F901 HydrophobicContact CE3-CZ 4.23Å; W884-F901 HydrophobicContact CG-CD2 4.49Å; W884-F901 HydrophobicContact CG-CE1 4.23Å; W884-F901 AromaticContact CG-CE2 3.81Å; W884-F901 HydrophobicContact CG-CE2 3.87Å; W884-F901 AromaticContact CG-CZ 3.63Å; W884-F901 HydrophobicContact CG-CZ 3.63Å; W884-F901 VanDerWaalsContact CG-CZ 3.41Å; W884-F901 PolarHBondContact N-O 3.1Å; W884-F901 WeakPolarHBondContact O-CD1 3.46Å; W884-F901 PolarHBondContact O-N 2.97Å; W884-F901 VanDerWaalsContact O-N 3.14Å; W884-L905 HydrophobicContact CH2-CD2 4.29Å; W884-L905 HydrophobicContact CZ2-CD1 3.81Å; W884-L905 HydrophobicContact CZ2-CD2 3.7Å; W884-L905 HydrophobicContact CZ2-CG 3.68Å; W884-L907 HydrophobicContact CH2-CD1 4.13Å; W884-L907 HydrophobicContact CH2-CD2 4.46Å; W884-L907 HydrophobicContact CZ2-CD1 3.67Å; W884-L907 HydrophobicContact CZ2-CD2 4.15Å; W884-L907 HydrophobicContact CZ2-CG 3.96Å; W884-F913 HydrophobicContact CH2-CD2 4.02Å; W884-F913 AromaticContact CH2-CE2 3.67Å; W884-F913 HydrophobicContact CH2-CE2 3.67Å; W884-F913 AromaticContact CH2-CZ 3.99Å; W884-F913 HydrophobicContact CH2-CZ 4.24Å; W884-F913 HydrophobicContact CZ3-CE2 4.24Å; W884-L915 HydrophobicContact CZ3-CD1 4.05Å; W884-L915 HydrophobicContact CZ3-CD2 4.22Å; W884-L928 HydrophobicContact CH2-CD1 4.02Å; W884-L928 HydrophobicContact CH2-CD2 3.93Å; W884-L928 HydrophobicContact CH2-CG 4.28Å; W884-L928 HydrophobicContact CZ2-CD1 4.21Å; W884-L928 HydrophobicContact CZ2-CD2 3.56Å; W884-L928 HydrophobicContact CZ2-CG 4.39Å; W884-L928 HydrophobicContact CZ3-CD1 4.5Å; W884-L933 HydrophobicContact CE3-CD1 3.75Å; W884-L933 HydrophobicContact CZ3-CD1 3.73Å
885	T	57.3	Low	47.7	Very low	76.5 Å²	76.5	103.8 Å²	103.8	47%	0.469	48%	0.481	S	S	.	.			trans	-104.8	128.4	174.2	58.8	0	0	0	0	110.3	E883	E883-T885 HydrophobicContact CG-CG2 4.04Å; E883-T885 PolarHBondContact O-N 2.92Å
886	S	57.8	Low	48.9	Very low	18 Å²	18	104.3 Å²	104.3	13%	0.126	48%	0.481	C	S	.	.			trans	-98.6	137.6	174.2	75.2	0	0	0	0	110.4	Q897 D899 Y937	S886-Q897 PolarHBondContact O-N 3.02Å; S886-Q897 VanDerWaalsContact O-N 3.13Å; S886-Q897 WeakPolarHBondContact OG-CG 3.24Å; S886-D899 PolarHBondContact OG-O 2.85Å; S886-Y937 VanDerWaalsContact CB-CE1 3.45Å; S886-Y937 VanDerWaalsContact CB-CZ 3.46Å; S886-Y937 WeakPolarHBondContact CB-OH 3.48Å; S886-Y937 VanDerWaalsContact OG-CD1 3.31Å; S886-Y937 WeakPolarHBondContact OG-CD1 3.12Å; S886-Y937 VanDerWaalsContact OG-CE1 3.22Å; S886-Y937 WeakPolarHBondContact OG-CE1 3.42Å
887	K	60.3	Low	50.1	Low	98 Å²	98	99.6 Å²	99.6	43%	0.426	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	131.4	174.8	-54.2	-165.5	179.5	-162.2	0	108.9	W894 E895 Q896	K887-W894 HydrophobicContact CB-CB 4.12Å; K887-W894 HydrophobicContact CB-CD2 4.21Å; K887-W894 HydrophobicContact CB-CE3 3.61Å; K887-W894 VanDerWaalsContact CB-CE3 3.46Å; K887-W894 HydrophobicContact CB-CZ3 4.16Å; K887-W894 HydrophobicContact CD-CB 4.12Å; K887-W894 WeakPolarHBondContact O-CZ3 3.19Å; K887-E895 CarbonylContact C-O 3.42Å; K887-E895 VanDerWaalsContact CA-O 3.3Å; K887-E895 WeakPolarHBondContact CA-O 3.39Å; K887-Q896 HydrophobicContact CD-CB 4.33Å; K887-Q896 HydrophobicContact CG-CB 4.21Å; K887-Q896 HydrophobicContact CG-CG 4.45Å
888	T	59.6	Low	50.9	Low	18.75 Å²	18.75	99.8 Å²	99.8	12%	0.115	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	133.6	177.7	-57.5	0	0	0	0	108.5	T890 W894 E895 Q897 L939 P940	T888-T890 WeakPolarHBondContact CG2-OG1 3.48Å; T888-T890 PolarHBondContact O-N 3.37Å; T888-W894 CarbonylContact O-C 3.5Å; T888-W894 WeakPolarHBondContact O-CA 3.32Å; T888-E895 PolarHBondContact N-O 2.92Å; T888-E895 PolarHBondContact O-N 2.83Å; T888-E895 VanDerWaalsContact O-N 3.07Å; T888-Q897 PolarHBondContact OG1-NE2 3.12Å; T888-Q897 PolarHBondContact OG1-OE1 3.22Å; T888-L939 HydrophobicContact CG2-CD2 4.31Å; T888-P940 VanDerWaalsContact CG2-CD 3.44Å; T888-P940 HydrophobicContact CG2-CG 4.07Å
889	L	55.2	Low	51.9	Low	75.25 Å²	75.25	95.1 Å²	95.1	39%	0.394	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	78.5	176.9	-174.2	63.7	0	0	0	110	R892 V893 W894 I948	L889-R892 VanDerWaalsContact CD1-C 3.41Å; L889-R892 VanDerWaalsContact CD1-CA 3.5Å; L889-R892 WeakPolarHBondContact CD1-O 3.39Å; L889-V893 CarbonylContact C-O 3.43Å; L889-V893 WeakPolarHBondContact CA-O 3.4Å; L889-V893 WeakPolarHBondContact CD1-O 3.35Å; L889-W894 HydrophobicContact CB-CD2 4.2Å; L889-W894 HydrophobicContact CB-CE3 4Å; L889-W894 HydrophobicContact CB-CH2 4.12Å; L889-W894 HydrophobicContact CB-CZ2 4.22Å; L889-W894 HydrophobicContact CB-CZ3 4.04Å; L889-W894 HydrophobicContact CD1-CD2 3.92Å; L889-W894 HydrophobicContact CD1-CE3 4.46Å; L889-W894 HydrophobicContact CD1-CG 4Å; L889-W894 HydrophobicContact CD1-CZ2 4.39Å; L889-W894 HydrophobicContact CD2-CZ2 3.96Å; L889-W894 HydrophobicContact CG-CZ2 4.24Å; L889-I948 HydrophobicContact CD2-CD1 4.39Å
890	T	47.5	Very low	52.8	Low	28 Å²	28	91.6 Å²	91.6	17%	0.172	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	133.7	174.5	-42.6	0	0	0	0	108	T888 R892 V893 E895 P940	T888-T890 WeakPolarHBondContact CG2-OG1 3.48Å; T888-T890 PolarHBondContact O-N 3.37Å; T890-R892 PolarHBondContact O-N 3.24Å; T890-V893 PolarHBondContact N-O 2.91Å; T890-V893 VanDerWaalsContact N-O 3.17Å; T890-V893 WeakPolarHBondContact O-CA 3.34Å; T890-V893 PolarHBondContact O-N 2.69Å; T890-V893 VanDerWaalsContact O-O 3.06Å; T890-E895 VanDerWaalsContact CB-CD 3.47Å; T890-E895 WeakPolarHBondContact CB-OE1 3.38Å; T890-E895 WeakPolarHBondContact CB-OE2 3.25Å; T890-E895 WeakPolarHBondContact CG2-OE1 3.48Å; T890-E895 VanDerWaalsContact OG1-CD 3.31Å; T890-E895 PolarHBondContact OG1-OE2 2.95Å; T890-P940 HydrophobicContact CG2-CB 3.82Å; T890-P940 HydrophobicContact CG2-CG 3.85Å; T890-P940 WeakPolarHBondContact OG1-CG 3.35Å
891	N	45.4	Very low	53.8	Low	116.5 Å²	116.5	85.8 Å²	85.8	62%	0.623	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	25.7	171.8	-71.8	-19.5	0	0	0	115.4	V893 A1339 S1342	N891-V893 VanDerWaalsContact C-N 3.29Å; N891-V893 PolarHBondContact O-N 3.23Å; N891-A1339 CarbonylContact C-O 3.41Å; N891-A1339 WeakPolarHBondContact CA-O 3.45Å; N891-A1339 HydrophobicContact CB-CB 3.71Å; N891-A1339 WeakPolarHBondContact CB-O 3.25Å; N891-A1339 PolarHBondContact ND2-O 3.36Å; N891-A1339 CarbonylContact O-C 3.56Å; N891-A1339 WeakPolarHBondContact O-CA 3.33Å; N891-A1339 PolarHBondContact OD1-O 3.19Å; N891-S1342 VanDerWaalsContact CA-CB 3.48Å; N891-S1342 WeakPolarHBondContact CA-OG 3.27Å; N891-S1342 PolarHBondContact N-OG 3.17Å
892	R	42.9	Very low	54.4	Low	193.75 Å²	193.75	86.8 Å²	86.8	73%	0.731	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.3	5.6	-173.2	-54.2	-177.5	174.7	-168.4	-2.6	115.7	L889 T890 R1337 S1342	L889-R892 VanDerWaalsContact CD1-C 3.41Å; L889-R892 VanDerWaalsContact CD1-CA 3.5Å; L889-R892 WeakPolarHBondContact CD1-O 3.39Å; T890-R892 PolarHBondContact O-N 3.24Å; R892-R1337 HydrophobicContact CB-CB 4.4Å; R892-S1342 PolarHBondContact N-OG 3.39Å
893	V	41.7	Very low	54.4	Low	80.75 Å²	80.75	82.7 Å²	82.7	49%	0.489	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	135.3	167.9	-179	0	0	0	0	108.3	L889 T890 N891 E895 A1339	L889-V893 CarbonylContact C-O 3.43Å; L889-V893 WeakPolarHBondContact CA-O 3.4Å; L889-V893 WeakPolarHBondContact CD1-O 3.35Å; T890-V893 PolarHBondContact N-O 2.91Å; T890-V893 VanDerWaalsContact N-O 3.17Å; T890-V893 WeakPolarHBondContact O-CA 3.34Å; T890-V893 PolarHBondContact O-N 2.69Å; T890-V893 VanDerWaalsContact O-O 3.06Å; N891-V893 VanDerWaalsContact C-N 3.29Å; N891-V893 PolarHBondContact O-N 3.23Å; V893-E895 VanDerWaalsContact C-N 3.25Å; V893-E895 HydrophobicContact CG1-CG 4.42Å; V893-E895 PolarHBondContact O-N 3.05Å; V893-A1339 HydrophobicContact CB-CB 4.38Å; V893-A1339 HydrophobicContact CG2-CB 3.95Å; V893-A1339 VanDerWaalsContact CG2-N 3.28Å
894	W	52.8	Low	54.1	Low	132 Å²	132	87 Å²	87	50%	0.5	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	93.3	170.1	-76.9	104.3	0	0	0	109	K887 T888 L889 Q896 I948 N1078	K887-W894 HydrophobicContact CB-CB 4.12Å; K887-W894 HydrophobicContact CB-CD2 4.21Å; K887-W894 HydrophobicContact CB-CE3 3.61Å; K887-W894 VanDerWaalsContact CB-CE3 3.46Å; K887-W894 HydrophobicContact CB-CZ3 4.16Å; K887-W894 HydrophobicContact CD-CB 4.12Å; K887-W894 WeakPolarHBondContact O-CZ3 3.19Å; T888-W894 CarbonylContact O-C 3.5Å; T888-W894 WeakPolarHBondContact O-CA 3.32Å; L889-W894 HydrophobicContact CB-CD2 4.2Å; L889-W894 HydrophobicContact CB-CE3 4Å; L889-W894 HydrophobicContact CB-CH2 4.12Å; L889-W894 HydrophobicContact CB-CZ2 4.22Å; L889-W894 HydrophobicContact CB-CZ3 4.04Å; L889-W894 HydrophobicContact CD1-CD2 3.92Å; L889-W894 HydrophobicContact CD1-CE3 4.46Å; L889-W894 HydrophobicContact CD1-CG 4Å; L889-W894 HydrophobicContact CD1-CZ2 4.39Å; L889-W894 HydrophobicContact CD2-CZ2 3.96Å; L889-W894 HydrophobicContact CG-CZ2 4.24Å; W894-Q896 PolarHBondContact O-N 3.06Å; W894-I948 HydrophobicContact CH2-CB 3.93Å; W894-I948 HydrophobicContact CH2-CD1 3.75Å; W894-I948 HydrophobicContact CH2-CG1 4.42Å; W894-I948 HydrophobicContact CH2-CG2 4.09Å; W894-I948 HydrophobicContact CZ2-CD1 4.03Å; W894-I948 HydrophobicContact CZ2-CG2 4.46Å; W894-N1078 VanDerWaalsContact CE2-ND2 3.33Å; W894-N1078 HydrophobicContact CH2-CB 4Å; W894-N1078 HydrophobicContact CZ2-CB 3.22Å; W894-N1078 WeakPolarHBondContact CZ2-ND2 3.41Å
895	E	54.6	Low	53.9	Low	88 Å²	88	85.5 Å²	85.5	41%	0.411	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	111.1	171.1	-71.8	165.2	-173.3	0	0	108	K887 T888 T890 V893 Q897	K887-E895 CarbonylContact C-O 3.42Å; K887-E895 VanDerWaalsContact CA-O 3.3Å; K887-E895 WeakPolarHBondContact CA-O 3.39Å; T888-E895 PolarHBondContact N-O 2.92Å; T888-E895 PolarHBondContact O-N 2.83Å; T888-E895 VanDerWaalsContact O-N 3.07Å; T890-E895 VanDerWaalsContact CB-CD 3.47Å; T890-E895 WeakPolarHBondContact CB-OE1 3.38Å; T890-E895 WeakPolarHBondContact CB-OE2 3.25Å; T890-E895 WeakPolarHBondContact CG2-OE1 3.48Å; T890-E895 VanDerWaalsContact OG1-CD 3.31Å; T890-E895 PolarHBondContact OG1-OE2 2.95Å; V893-E895 VanDerWaalsContact C-N 3.25Å; V893-E895 HydrophobicContact CG1-CG 4.42Å; V893-E895 PolarHBondContact O-N 3.05Å; E895-Q897 PolarHBondContact O-N 2.95Å
896	Q	56.2	Low	53.6	Low	104.75 Å²	104.75	84.9 Å²	84.9	49%	0.489	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	124.3	167.7	178.6	165.4	-30.2	0	0	107.6	K887 W894 E898	K887-Q896 HydrophobicContact CD-CB 4.33Å; K887-Q896 HydrophobicContact CG-CB 4.21Å; K887-Q896 HydrophobicContact CG-CG 4.45Å; W894-Q896 PolarHBondContact O-N 3.06Å; Q896-E898 PolarHBondContact O-N 2.87Å
897	Q	56.9	Low	53.5	Low	51 Å²	51	87.4 Å²	87.4	24%	0.238	42%	0.421	C	S	.	.			trans	-72.7	141.3	170.5	-60	-133.7	-33.1	0	0	107.5	S886 T888 E895 D899 Y937 T938	S886-Q897 PolarHBondContact O-N 3.02Å; S886-Q897 VanDerWaalsContact O-N 3.13Å; S886-Q897 WeakPolarHBondContact OG-CG 3.24Å; T888-Q897 PolarHBondContact OG1-NE2 3.12Å; T888-Q897 PolarHBondContact OG1-OE1 3.22Å; E895-Q897 PolarHBondContact O-N 2.95Å; Q897-D899 PolarHBondContact O-N 3.18Å; Q897-D899 VanDerWaalsContact O-N 3.14Å; Q897-Y937 HydrophobicContact CB-CD1 4.05Å; Q897-Y937 HydrophobicContact CB-CE1 4.27Å; Q897-Y937 HydrophobicContact CG-CD1 3.93Å; Q897-Y937 HydrophobicContact CG-CE1 4.45Å; Q897-T938 PolarHBondContact NE2-O 3.02Å
898	E	53	Low	52.9	Low	193.5 Å²	193.5	87.3 Å²	87.3	90%	0.904	43%	0.425	S	S	*	.	S	Bend	trans	-64	-19.7	-163.2	-64.9	-179.3	137.2	0	0	113.4	Q896 S900	Q896-E898 PolarHBondContact O-N 2.87Å; E898-S900 PolarHBondContact O-N 3.27Å
899	D	56.6	Low	52.3	Low	96.75 Å²	96.75	93.6 Å²	93.6	52%	0.517	46%	0.458	S	S	.	.			trans	-94.2	103.5	179.8	-61.6	-46.5	0	0	0	112.7	S886 Q897 L935	S886-D899 PolarHBondContact OG-O 2.85Å; Q897-D899 PolarHBondContact O-N 3.18Å; Q897-D899 VanDerWaalsContact O-N 3.14Å; D899-L935 HydrophobicContact CB-CD1 3.83Å; D899-L935 HydrophobicContact CB-CD2 3.33Å; D899-L935 VanDerWaalsContact CB-CD2 3.42Å; D899-L935 HydrophobicContact CB-CG 3.94Å; D899-L935 VanDerWaalsContact O-CD2 3.29Å; D899-L935 WeakPolarHBondContact O-CD2 3.29Å; D899-L935 WeakPolarHBondContact OD2-CD2 3.43Å
900	S	54.8	Low	51.8	Low	51.75 Å²	51.75	97.4 Å²	97.4	36%	0.362	47%	0.474	S	S	.	.			trans	-80.6	146.9	152.2	64.9	0	0	0	0	109.7	E883 W884 E898	E883-S900 VanDerWaalsContact OE1-CB 3.27Å; E883-S900 WeakPolarHBondContact OE1-CB 3.39Å; E883-S900 PolarHBondContact OE1-OG 2.79Å; W884-S900 WeakPolarHBondContact O-CA 3.36Å; E898-S900 PolarHBondContact O-N 3.27Å
901	F	60.5	Low	52.2	Low	17.5 Å²	17.5	104.8 Å²	104.8	8%	0.077	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	140	177	69.2	-81.4	0	0	0	111.9	K882 E883 W884 S903 L933 P934 L935 Y937	K882-F901 VanDerWaalsContact O-O 3.12Å; E883-F901 WeakPolarHBondContact CA-O 3.46Å; W884-F901 HydrophobicContact CB-CD1 3.94Å; W884-F901 HydrophobicContact CB-CD2 4.3Å; W884-F901 HydrophobicContact CB-CE1 3.4Å; W884-F901 VanDerWaalsContact CB-CE1 3.42Å; W884-F901 HydrophobicContact CB-CE2 3.8Å; W884-F901 HydrophobicContact CB-CG 4.36Å; W884-F901 HydrophobicContact CB-CZ 3.31Å; W884-F901 VanDerWaalsContact CB-CZ 3.45Å; W884-F901 WeakPolarHBondContact CB-O 3.39Å; W884-F901 AromaticContact CD1-CE2 3.71Å; W884-F901 AromaticContact CD1-CZ 3.93Å; W884-F901 HydrophobicContact CD2-CE2 4.36Å; W884-F901 AromaticContact CD2-CZ 3.93Å; W884-F901 HydrophobicContact CD2-CZ 4.05Å; W884-F901 HydrophobicContact CE3-CZ 4.23Å; W884-F901 HydrophobicContact CG-CD2 4.49Å; W884-F901 HydrophobicContact CG-CE1 4.23Å; W884-F901 AromaticContact CG-CE2 3.81Å; W884-F901 HydrophobicContact CG-CE2 3.87Å; W884-F901 AromaticContact CG-CZ 3.63Å; W884-F901 HydrophobicContact CG-CZ 3.63Å; W884-F901 VanDerWaalsContact CG-CZ 3.41Å; W884-F901 PolarHBondContact N-O 3.1Å; W884-F901 WeakPolarHBondContact O-CD1 3.46Å; W884-F901 PolarHBondContact O-N 2.97Å; W884-F901 VanDerWaalsContact O-N 3.14Å; F901-S903 PolarHBondContact O-N 2.98Å; F901-L933 HydrophobicContact CD2-CB 4.44Å; F901-L933 HydrophobicContact CD2-CD2 4.28Å; F901-L933 HydrophobicContact CE1-CD1 4.28Å; F901-L933 HydrophobicContact CE2-CB 3.86Å; F901-L933 HydrophobicContact CE2-CD1 4.11Å; F901-L933 VanDerWaalsContact CE2-CD1 3.46Å; F901-L933 HydrophobicContact CE2-CD2 3.9Å; F901-L933 HydrophobicContact CE2-CG 4.17Å; F901-L933 HydrophobicContact CZ-CB 4.07Å; F901-L933 HydrophobicContact CZ-CD1 3.73Å; F901-L933 HydrophobicContact CZ-CD2 4.28Å; F901-L933 HydrophobicContact CZ-CG 4.2Å; F901-P934 HydrophobicContact CB-CG 4.3Å; F901-P934 HydrophobicContact CD2-CG 4.16Å; F901-P934 HydrophobicContact CG-CG 4.27Å; F901-L935 HydrophobicContact CB-CD1 3.83Å; F901-L935 HydrophobicContact CD1-CB 4.28Å; F901-L935 HydrophobicContact CD1-CD1 4Å; F901-L935 HydrophobicContact CD1-CD2 3.5Å; F901-L935 VanDerWaalsContact CD1-CD2 3.5Å; F901-L935 HydrophobicContact CD1-CG 4.12Å; F901-L935 HydrophobicContact CE1-CD2 4.01Å; F901-L935 HydrophobicContact CG-CD1 3.9Å; F901-L935 HydrophobicContact CG-CD2 4.43Å; F901-Y937 WeakPolarHBondContact CD1-OH 3.48Å; F901-Y937 HydrophobicContact CE1-CE2 4.34Å; F901-Y937 WeakPolarHBondContact CE1-OH 3.33Å
902	K	55.3	Low	52.6	Low	133.25 Å²	133.25	103.5 Å²	103.5	58%	0.579	50%	0.495	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.5	106.7	174.3	-69.3	-175.5	177.8	-176.4	0	109.9	K882 E883 K904	K882-K902 HydrophobicContact CB-CB 4.34Å; K882-K902 CarbonylContact O-C 3.58Å; K882-K902 VanDerWaalsContact O-CA 3.29Å; K882-K902 WeakPolarHBondContact O-CA 3.35Å; E883-K902 HydrophobicContact CB-CG 4.19Å; E883-K902 VanDerWaalsContact CD-CE 3.46Å; E883-K902 HydrophobicContact CG-CG 4.2Å; E883-K902 WeakPolarHBondContact OE1-CE 3.26Å; E883-K902 WeakPolarHBondContact OE2-CE 3.33Å; E883-K902 IonicContact OE2-NZ 3.12Å; E883-K902 PolarHBondContact OE2-NZ 2.74Å; K902-K904 PolarHBondContact O-N 3Å; K902-K904 VanDerWaalsContact O-N 3.09Å
903	S	54.7	Low	53.6	Low	12.25 Å²	12.25	96.8 Å²	96.8	9%	0.086	47%	0.471	C	S	.	.			trans	-86.6	115.8	178	-172	0	0	0	0	110.5	K882 F901 L905 L933	K882-S903 VanDerWaalsContact CB-O 3.25Å; K882-S903 WeakPolarHBondContact CB-O 3.32Å; K882-S903 WeakPolarHBondContact CD-O 3.28Å; K882-S903 WeakPolarHBondContact CG-O 3.34Å; K882-S903 PolarHBondContact O-N 3.2Å; F901-S903 PolarHBondContact O-N 2.98Å; S903-L905 PolarHBondContact O-N 3.08Å; S903-L905 WeakPolarHBondContact OG-CB 3.08Å; S903-L905 VanDerWaalsContact OG-CD1 3.31Å; S903-L905 WeakPolarHBondContact OG-CD1 3.36Å; S903-L905 WeakPolarHBondContact OG-CG 3.44Å; S903-L905 PolarHBondContact OG-N 2.96Å; S903-L933 WeakPolarHBondContact OG-CD2 3.23Å
904	K	52.1	Low	54.5	Low	179.5 Å²	179.5	97.4 Å²	97.4	78%	0.78	47%	0.472	S	S	*	.			trans	-66.6	20.8	173.9	-69.8	-173.2	178.6	178.9	0	111.9	K882 K902 P906	K882-K904 PolarHBondContact NZ-O 3.34Å; K902-K904 PolarHBondContact O-N 3Å; K902-K904 VanDerWaalsContact O-N 3.09Å; K904-P906 WeakPolarHBondContact O-CD 3.42Å
905	L	55.5	Low	55.3	Low	30.25 Å²	30.25	93.8 Å²	93.8	16%	0.158	46%	0.462	C	S	.	.			trans	-76.6	120.6	175.3	-76.3	145.5	0	0	0	109.7	K882 W884 S903 L907 F913 L928 N929 R931 L933 P1189	K882-L905 WeakPolarHBondContact CE-O 3.41Å; W884-L905 HydrophobicContact CH2-CD2 4.29Å; W884-L905 HydrophobicContact CZ2-CD1 3.81Å; W884-L905 HydrophobicContact CZ2-CD2 3.7Å; W884-L905 HydrophobicContact CZ2-CG 3.68Å; S903-L905 PolarHBondContact O-N 3.08Å; S903-L905 WeakPolarHBondContact OG-CB 3.08Å; S903-L905 VanDerWaalsContact OG-CD1 3.31Å; S903-L905 WeakPolarHBondContact OG-CD1 3.36Å; S903-L905 WeakPolarHBondContact OG-CG 3.44Å; S903-L905 PolarHBondContact OG-N 2.96Å; L905-L907 HydrophobicContact CB-CD2 4.44Å; L905-L907 HydrophobicContact CB-CG 4.24Å; L905-L907 HydrophobicContact CD2-CD2 4.28Å; L905-L907 PolarHBondContact O-N 3.05Å; L905-F913 HydrophobicContact CD2-CD1 4.24Å; L905-F913 HydrophobicContact CD2-CE1 4.48Å; L905-F913 HydrophobicContact CD2-CG 4.36Å; L905-L928 HydrophobicContact CB-CD2 4.3Å; L905-L928 HydrophobicContact CD1-CB 4.09Å; L905-L928 HydrophobicContact CD1-CD2 4Å; L905-L928 HydrophobicContact CD1-CG 4.12Å; L905-L928 HydrophobicContact CD2-CB 4.32Å; L905-L928 HydrophobicContact CD2-CD1 4.48Å; L905-L928 HydrophobicContact CD2-CD2 4.2Å; L905-L928 HydrophobicContact CD2-CG 4.42Å; L905-L928 WeakPolarHBondContact CD2-O 3.44Å; L905-L928 HydrophobicContact CG-CD2 4.36Å; L905-N929 HydrophobicContact CD2-CB 4.14Å; L905-R931 HydrophobicContact CD1-CB 4.06Å; L905-R931 HydrophobicContact CD2-CB 3.82Å; L905-R931 HydrophobicContact CD2-CG 3.94Å; L905-R931 HydrophobicContact CG-CB 4.29Å; L905-R931 HydrophobicContact CG-CG 4.4Å; L905-L933 HydrophobicContact CD1-CD2 3.78Å; L905-P1189 HydrophobicContact CD2-CG 3.91Å
906	P	51.9	Low	56.1	Low	63.75 Å²	63.75	92 Å²	92	41%	0.414	46%	0.455	S	S	.	.			trans	-68.2	120.1	163.7	30.9	-31.7	0	0	0	108.2	K904 D908 N929	K904-P906 WeakPolarHBondContact O-CD 3.42Å; P906-D908 VanDerWaalsContact C-N 3.3Å; P906-D908 VanDerWaalsContact CB-OD1 3.32Å; P906-D908 WeakPolarHBondContact CB-OD1 3.29Å; P906-D908 VanDerWaalsContact CG-OD1 3.23Å; P906-D908 WeakPolarHBondContact CG-OD1 3.49Å; P906-D908 PolarHBondContact O-N 2.88Å; P906-N929 PolarHBondContact O-ND2 2.68Å
907	L	55.7	Low	56.9	Low	70.75 Å²	70.75	88.4 Å²	88.4	37%	0.37	44%	0.443	S	S	.	.			trans	-78.3	90.9	156.9	-66	174.6	0	0	0	105	L879 W884 L905 D909 E910 F913 L928	L879-L907 HydrophobicContact CD2-CD1 4.48Å; W884-L907 HydrophobicContact CH2-CD1 4.13Å; W884-L907 HydrophobicContact CH2-CD2 4.46Å; W884-L907 HydrophobicContact CZ2-CD1 3.67Å; W884-L907 HydrophobicContact CZ2-CD2 4.15Å; W884-L907 HydrophobicContact CZ2-CG 3.96Å; L905-L907 HydrophobicContact CB-CD2 4.44Å; L905-L907 HydrophobicContact CB-CG 4.24Å; L905-L907 HydrophobicContact CD2-CD2 4.28Å; L905-L907 PolarHBondContact O-N 3.05Å; L907-D909 PolarHBondContact O-N 2.76Å; L907-D909 VanDerWaalsContact O-N 3.15Å; L907-E910 PolarHBondContact O-N 2.89Å; L907-F913 HydrophobicContact CD1-CE1 4.5Å; L907-F913 HydrophobicContact CD2-CB 3.71Å; L907-F913 HydrophobicContact CD2-CD1 3.91Å; L907-F913 HydrophobicContact CD2-CE1 3.95Å; L907-F913 HydrophobicContact CD2-CG 4.19Å; L907-L928 HydrophobicContact CD2-CD1 4.18Å; L907-L928 HydrophobicContact CD2-CD2 4.27Å; L907-L928 HydrophobicContact CD2-CG 4.47Å
908	D	48.6	Very low	57.6	Low	94.25 Å²	94.25	88.6 Å²	88.6	50%	0.504	44%	0.443	S	S	.	.			trans	-58.9	142.6	175.3	-71.6	-33.7	0	0	0	109.4	P906 E910 R911	P906-D908 VanDerWaalsContact C-N 3.3Å; P906-D908 VanDerWaalsContact CB-OD1 3.32Å; P906-D908 WeakPolarHBondContact CB-OD1 3.29Å; P906-D908 VanDerWaalsContact CG-OD1 3.23Å; P906-D908 WeakPolarHBondContact CG-OD1 3.49Å; P906-D908 PolarHBondContact O-N 2.88Å; D908-E910 PolarHBondContact O-N 2.88Å; D908-R911 HydrophobicContact CB-CB 4.35Å; D908-R911 HydrophobicContact CB-CG 4.34Å; D908-R911 PolarHBondContact O-N 3.11Å; D908-R911 VanDerWaalsContact O-N 3.1Å; D908-R911 WeakPolarHBondContact OD2-CD 2.98Å; D908-R911 IonicContact OD2-CZ 3.84Å; D908-R911 IonicContact OD2-NE 2.73Å; D908-R911 IonicContact OD2-NH1 3.88Å; D908-R911 PolarHBondContact OD2-NH1 3Å
909	D	45.9	Very low	58.6	Low	151.75 Å²	151.75	80.9 Å²	80.9	81%	0.811	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-34.2	88.6	-174.8	-56.2	-40.6	0	0	0	114.6	L907 R911	L907-D909 PolarHBondContact O-N 2.76Å; L907-D909 VanDerWaalsContact O-N 3.15Å; D909-R911 VanDerWaalsContact C-N 3.3Å; D909-R911 PolarHBondContact O-N 3.09Å
910	E	45.8	Very low	59.3	Low	156 Å²	156	81.2 Å²	81.2	73%	0.729	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.9	12.9	171.4	-56.6	-172.6	155.7	0	0	118	L907 D908 T912 K999 R1105	L907-E910 PolarHBondContact O-N 2.89Å; D908-E910 PolarHBondContact O-N 2.88Å; E910-T912 PolarHBondContact O-N 2.79Å; E910-K999 IonicContact OE2-NZ 3.22Å; E910-K999 PolarHBondContact OE2-NZ 3.2Å; E910-R1105 PolarHBondContact O-NH2 3.39Å; E910-R1105 VanDerWaalsContact O-NH2 3.1Å
911	R	55.1	Low	60.1	Low	182 Å²	182	83.9 Å²	83.9	69%	0.687	42%	0.416	S	S	*	.	S	Bend	trans	-127.3	68.6	-175.5	-63.1	177.3	178.5	-165.1	2.3	115.1	D908 D909 R1080	D908-R911 HydrophobicContact CB-CB 4.35Å; D908-R911 HydrophobicContact CB-CG 4.34Å; D908-R911 PolarHBondContact O-N 3.11Å; D908-R911 VanDerWaalsContact O-N 3.1Å; D908-R911 WeakPolarHBondContact OD2-CD 2.98Å; D908-R911 IonicContact OD2-CZ 3.84Å; D908-R911 IonicContact OD2-NE 2.73Å; D908-R911 IonicContact OD2-NH1 3.88Å; D908-R911 PolarHBondContact OD2-NH1 3Å; D909-R911 VanDerWaalsContact C-N 3.3Å; D909-R911 PolarHBondContact O-N 3.09Å; R911-R1080 VanDerWaalsContact CD-NH2 3.34Å
912	T	53.5	Low	60.8	Low	89.75 Å²	89.75	89.1 Å²	89.1	55%	0.551	44%	0.435	S	S	*	.			trans	-86.1	143.3	175.9	31.4	0	0	0	0	111.9	E910 A955 L996	E910-T912 PolarHBondContact O-N 2.79Å; T912-A955 HydrophobicContact CG2-CB 3.5Å; T912-L996 HydrophobicContact CG2-CD2 4.22Å
913	F	63.7	Low	61.7	Low	54.25 Å²	54.25	88.5 Å²	88.5	24%	0.238	43%	0.433	C	S	.	.			trans	-135.1	150.7	171.4	64.6	-98.6	0	0	0	112.2	W884 L905 L907 L915 L928 N929 I949 V953 F956 I957	W884-F913 HydrophobicContact CH2-CD2 4.02Å; W884-F913 AromaticContact CH2-CE2 3.67Å; W884-F913 HydrophobicContact CH2-CE2 3.67Å; W884-F913 AromaticContact CH2-CZ 3.99Å; W884-F913 HydrophobicContact CH2-CZ 4.24Å; W884-F913 HydrophobicContact CZ3-CE2 4.24Å; L905-F913 HydrophobicContact CD2-CD1 4.24Å; L905-F913 HydrophobicContact CD2-CE1 4.48Å; L905-F913 HydrophobicContact CD2-CG 4.36Å; L907-F913 HydrophobicContact CD1-CE1 4.5Å; L907-F913 HydrophobicContact CD2-CB 3.71Å; L907-F913 HydrophobicContact CD2-CD1 3.91Å; L907-F913 HydrophobicContact CD2-CE1 3.95Å; L907-F913 HydrophobicContact CD2-CG 4.19Å; F913-L915 HydrophobicContact CD2-CB 4.33Å; F913-L915 HydrophobicContact CE2-CB 4.31Å; F913-L928 HydrophobicContact CB-CD1 4.13Å; F913-L928 HydrophobicContact CD1-CD1 4.14Å; F913-L928 HydrophobicContact CD2-CD1 3.46Å; F913-L928 VanDerWaalsContact CD2-CD1 3.49Å; F913-L928 HydrophobicContact CE1-CD1 4.24Å; F913-L928 HydrophobicContact CE2-CD1 4.07Å; F913-L928 VanDerWaalsContact CE2-CD1 3.41Å; F913-L928 HydrophobicContact CG-CD1 3.97Å; F913-L928 HydrophobicContact CZ-CD1 3.91Å; F913-N929 VanDerWaalsContact CA-OD1 3.23Å; F913-N929 WeakPolarHBondContact CA-OD1 3.31Å; F913-N929 WeakPolarHBondContact CB-ND2 3.38Å; F913-N929 VanDerWaalsContact CB-OD1 3.28Å; F913-N929 WeakPolarHBondContact CB-OD1 3.38Å; F913-I949 HydrophobicContact CE2-CD1 3.91Å; F913-I949 HydrophobicContact CE2-CG2 4.32Å; F913-I949 HydrophobicContact CZ-CD1 4.5Å; F913-I949 HydrophobicContact CZ-CG2 3.92Å; F913-V953 HydrophobicContact CD1-CG1 4.02Å; F913-V953 HydrophobicContact CE1-CB 4.09Å; F913-V953 HydrophobicContact CE1-CG1 3.29Å; F913-V953 HydrophobicContact CE1-CG2 4.12Å; F913-V953 HydrophobicContact CZ-CB 4.4Å; F913-V953 HydrophobicContact CZ-CG1 4.08Å; F913-V953 HydrophobicContact CZ-CG2 4.01Å; F913-F956 HydrophobicContact CD2-CB 4.31Å; F913-F956 HydrophobicContact CE2-CB 4.04Å; F913-F956 HydrophobicContact CZ-CB 4.43Å; F913-F956 WeakPolarHBondContact O-CA 3.42Å; F913-I957 PolarHBondContact O-N 2.61Å
914	N	61.7	Low	62.8	Low	92.75 Å²	92.75	89.4 Å²	89.4	50%	0.496	44%	0.436	S	S	.	.			trans	-99.9	114.5	177.7	-67.9	-56.6	0	0	0	109.7	L928 N929 K1085	N914-L928 CarbonylContact O-C 3.29Å; N914-L928 WeakPolarHBondContact O-CA 3.32Å; N914-N929 PolarHBondContact N-OD1 2.96Å; N914-N929 WeakPolarHBondContact O-CA 3.1Å; N914-N929 PolarHBondContact O-N 2.82Å; N914-N929 PolarHBondContact O-OD1 2.79Å; N914-K1085 PolarHBondContact ND2-NZ 3.04Å; N914-K1085 WeakPolarHBondContact OD1-CD 3.45Å
915	L	69.5	Low	64.2	Low	56.5 Å²	56.5	81.6 Å²	81.6	30%	0.296	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	107.6	172.2	-172.7	72.1	0	0	0	109.8	W884 F913 L926 W927 L928 L933 I947 I949 I957 V958 N959	W884-L915 HydrophobicContact CZ3-CD1 4.05Å; W884-L915 HydrophobicContact CZ3-CD2 4.22Å; F913-L915 HydrophobicContact CD2-CB 4.33Å; F913-L915 HydrophobicContact CE2-CB 4.31Å; L915-L926 HydrophobicContact CD1-CB 4.4Å; L915-L926 HydrophobicContact CD1-CD1 4.31Å; L915-L926 HydrophobicContact CD2-CD2 4.32Å; L915-W927 CarbonylContact C-O 3.08Å; L915-W927 VanDerWaalsContact CA-O 3.26Å; L915-W927 WeakPolarHBondContact CA-O 3.34Å; L915-L928 HydrophobicContact CD1-CB 4.27Å; L915-L928 HydrophobicContact CD1-CD1 4.36Å; L915-L933 HydrophobicContact CD1-CD1 4.23Å; L915-I947 HydrophobicContact CD2-CG2 4.1Å; L915-I949 HydrophobicContact CB-CD1 3.59Å; L915-I949 HydrophobicContact CD2-CD1 3.84Å; L915-I949 VanDerWaalsContact CD2-CD1 3.42Å; L915-I949 HydrophobicContact CD2-CG1 3.74Å; L915-I949 HydrophobicContact CG-CD1 4.11Å; L915-I957 CarbonylContact C-O 3.58Å; L915-I957 PolarHBondContact N-O 3.07Å; L915-V958 VanDerWaalsContact O-CA 3.32Å; L915-V958 WeakPolarHBondContact O-CA 3.4Å; L915-N959 PolarHBondContact O-N 2.67Å
916	L	70.4	Confident	65.1	Low	50.25 Å²	50.25	81.1 Å²	81.1	26%	0.263	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	137.8	171.7	176.4	70.3	0	0	0	109.6	K918 L926 W927 N959 L961 P1005 F1008 D1128 N1129	L916-K918 HydrophobicContact CD2-CG 4.46Å; L916-K918 HydrophobicContact CG-CG 4.47Å; L916-L926 CarbonylContact O-C 3.56Å; L916-L926 VanDerWaalsContact O-CA 3.28Å; L916-L926 WeakPolarHBondContact O-CA 3.38Å; L916-W927 HydrophobicContact CB-CB 4.07Å; L916-W927 HydrophobicContact CB-CD2 4.46Å; L916-W927 HydrophobicContact CB-CE3 4.41Å; L916-W927 HydrophobicContact CB-CG 3.96Å; L916-W927 HydrophobicContact CD2-CB 4.47Å; L916-W927 HydrophobicContact CD2-CD2 4.27Å; L916-W927 HydrophobicContact CD2-CE3 4.08Å; L916-W927 HydrophobicContact CD2-CG 4.2Å; L916-W927 HydrophobicContact CD2-CZ3 4.49Å; L916-W927 HydrophobicContact CG-CB 4.17Å; L916-W927 HydrophobicContact CG-CD2 4Å; L916-W927 HydrophobicContact CG-CE3 4.22Å; L916-W927 HydrophobicContact CG-CG 3.92Å; L916-W927 PolarHBondContact N-O 3.21Å; L916-W927 WeakPolarHBondContact O-CB 3.47Å; L916-W927 PolarHBondContact O-N 3.19Å; L916-N959 CarbonylContact C-O 3.52Å; L916-N959 HydrophobicContact CB-CB 4.47Å; L916-N959 HydrophobicContact CD1-CB 3.83Å; L916-L961 HydrophobicContact CD1-CB 4.31Å; L916-L961 HydrophobicContact CD1-CD1 3.84Å; L916-L961 HydrophobicContact CD1-CG 3.79Å; L916-P1005 HydrophobicContact CD1-CG 3.94Å; L916-P1005 HydrophobicContact CD2-CB 4.45Å; L916-P1005 HydrophobicContact CD2-CG 3.38Å; L916-P1005 HydrophobicContact CG-CG 4.25Å; L916-F1008 HydrophobicContact CD1-CD2 4.36Å; L916-F1008 HydrophobicContact CD1-CE2 3.6Å; L916-F1008 HydrophobicContact CD1-CZ 4.26Å; L916-D1128 WeakPolarHBondContact CD2-OD2 3.18Å; L916-N1129 HydrophobicContact CD1-CB 4Å; L916-N1129 WeakPolarHBondContact CD1-ND2 3.41Å
917	A	74	Confident	66.4	Low	28 Å²	28	80 Å²	80	23%	0.231	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	120.4	171.3	0	0	0	0	0	109.5	M924 Q925 L926 I947 N959 A960 L961	A917-M924 HydrophobicContact CB-CG 4.09Å; A917-M924 HydrophobicContact CB-SD 4.09Å; A917-Q925 VanDerWaalsContact CA-O 3.27Å; A917-Q925 WeakPolarHBondContact CA-O 3.28Å; A917-L926 HydrophobicContact CB-CD2 3.6Å; A917-I947 HydrophobicContact CB-CD1 3.95Å; A917-I947 HydrophobicContact CB-CG1 4.07Å; A917-N959 PolarHBondContact N-O 3.36Å; A917-A960 WeakPolarHBondContact O-CA 3.33Å; A917-L961 PolarHBondContact O-N 3.44Å
918	K	71.9	Confident	67.1	Low	55.75 Å²	55.75	76.8 Å²	76.8	24%	0.242	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	127.6	171.6	-120.2	-174.2	167.6	-169.9	0	108.5	L916 M924 Q925 W927 L961 E963 E1007 N1129 E1193 Y1195 G1284	L916-K918 HydrophobicContact CD2-CG 4.46Å; L916-K918 HydrophobicContact CG-CG 4.47Å; K918-M924 CarbonylContact O-C 3.6Å; K918-M924 VanDerWaalsContact O-CA 3.27Å; K918-M924 WeakPolarHBondContact O-CA 3.3Å; K918-Q925 PolarHBondContact N-O 3.16Å; K918-Q925 VanDerWaalsContact N-O 3.14Å; K918-Q925 PolarHBondContact O-N 3.34Å; K918-W927 HydrophobicContact CB-CE3 4.21Å; K918-W927 HydrophobicContact CB-CH2 3.66Å; K918-W927 VanDerWaalsContact CB-CH2 3.41Å; K918-W927 HydrophobicContact CB-CZ2 4.48Å; K918-W927 HydrophobicContact CB-CZ3 3.41Å; K918-W927 VanDerWaalsContact CB-CZ3 3.47Å; K918-W927 HydrophobicContact CD-CH2 3.56Å; K918-W927 HydrophobicContact CD-CZ2 4.14Å; K918-W927 HydrophobicContact CD-CZ3 4.04Å; K918-W927 HydrophobicContact CG-CE3 4.37Å; K918-W927 HydrophobicContact CG-CH2 3.82Å; K918-W927 HydrophobicContact CG-CZ3 3.78Å; K918-W927 VanDerWaalsContact CG-CZ3 3.47Å; K918-L961 WeakPolarHBondContact CA-O 3.29Å; K918-E963 WeakPolarHBondContact CD-OE2 3.44Å; K918-E963 VanDerWaalsContact CE-CD 3.47Å; K918-E963 WeakPolarHBondContact CE-OE2 3.25Å; K918-E963 IonicContact NZ-OE1 3.49Å; K918-E963 PolarHBondContact NZ-OE1 2.89Å; K918-E963 IonicContact NZ-OE2 2.69Å; K918-E963 PolarHBondContact NZ-OE2 3.05Å; K918-E1007 IonicContact NZ-OE1 3.46Å; K918-E1007 PolarHBondContact NZ-OE1 3.38Å; K918-E1007 IonicContact NZ-OE2 3.99Å; K918-N1129 WeakPolarHBondContact CG-ND2 3.34Å; K918-E1193 IonicContact NZ-OE1 3.81Å; K918-E1193 PolarHBondContact NZ-OE1 3.45Å; K918-Y1195 HydrophobicContact CD-CE1 4.36Å; K918-Y1195 VanDerWaalsContact CE-CD1 3.45Å; K918-Y1195 VanDerWaalsContact CE-CZ 3.49Å; K918-Y1195 VanDerWaalsContact NZ-CE1 3.29Å; K918-G1284 VanDerWaalsContact NZ-CA 3.27Å
919	V	73	Confident	68.1	Low	32.75 Å²	32.75	74.8 Å²	74.8	20%	0.198	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	120.8	175.1	-177.4	0	0	0	0	108.9	K923 M924 L939 E942 A944 L961 E963	V919-K923 WeakPolarHBondContact CA-O 3.22Å; V919-M924 HydrophobicContact CG2-CB 4.21Å; V919-M924 HydrophobicContact CG2-CG 4.23Å; V919-L939 HydrophobicContact CB-CD1 4.37Å; V919-L939 HydrophobicContact CG1-CD1 3.7Å; V919-L939 HydrophobicContact CG2-CD1 3.78Å; V919-E942 VanDerWaalsContact CG1-O 3.25Å; V919-E942 WeakPolarHBondContact CG1-O 3.23Å; V919-A944 HydrophobicContact CG2-CB 3.75Å; V919-L961 PolarHBondContact N-O 3.01Å; V919-E963 PolarHBondContact O-N 3.05Å
920	K	70.9	Confident	69.2	Low	102 Å²	102	69.8 Å²	69.8	44%	0.443	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	132	174	-173.6	-172.7	179.7	-145.4	0	108.7	R922 K923 E963 Y1195	K920-R922 VanDerWaalsContact C-N 3.31Å; K920-R922 PolarHBondContact O-N 2.96Å; K920-K923 PolarHBondContact N-O 2.95Å; K920-K923 CarbonylContact O-C 3.56Å; K920-K923 VanDerWaalsContact O-CA 3.29Å; K920-K923 WeakPolarHBondContact O-CA 3.26Å; K920-K923 VanDerWaalsContact O-CB 3.23Å; K920-K923 WeakPolarHBondContact O-CB 3.35Å; K920-K923 PolarHBondContact O-N 2.9Å; K920-K923 VanDerWaalsContact O-O 3.1Å; K920-E963 HydrophobicContact CB-CB 3.9Å; K920-E963 HydrophobicContact CB-CG 4.48Å; K920-E963 WeakPolarHBondContact CB-OE2 3.32Å; K920-E963 HydrophobicContact CD-CB 4.4Å; K920-E963 VanDerWaalsContact CD-OE2 3.32Å; K920-E963 WeakPolarHBondContact CD-OE2 3.42Å; K920-E963 HydrophobicContact CG-CB 3.78Å; K920-E963 HydrophobicContact CG-CG 4.49Å; K920-E963 WeakPolarHBondContact CG-OE2 3.25Å; K920-Y1195 HydrophobicContact CD-CD1 4.42Å; K920-Y1195 HydrophobicContact CD-CE1 4.33Å
921	D	72.9	Confident	70.2	Confident	108 Å²	108	69.1 Å²	69.1	58%	0.578	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	43.3	175.3	-46.9	-35.9	0	0	0	113.5	K923 I965	D921-K923 PolarHBondContact O-N 3.12Å; D921-K923 VanDerWaalsContact O-N 3.12Å; D921-I965 WeakPolarHBondContact OD1-CG1 3.41Å; D921-I965 WeakPolarHBondContact OD1-CG2 3.45Å
922	R	74.5	Confident	71.2	Confident	126.5 Å²	126.5	65.1 Å²	65.1	48%	0.477	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.3	-1.7	-169.5	-62.5	-178.4	-92.5	176.6	-1.8	115.6	K920 M924 T938 L939 E942	K920-R922 VanDerWaalsContact C-N 3.31Å; K920-R922 PolarHBondContact O-N 2.96Å; R922-M924 PolarHBondContact O-N 3.42Å; R922-T938 HydrophobicContact CB-CG2 4.21Å; R922-T938 CarbonylContact O-C 3.55Å; R922-T938 WeakPolarHBondContact O-CA 3.37Å; R922-L939 VanDerWaalsContact O-CB 3.22Å; R922-L939 WeakPolarHBondContact O-CB 3.44Å; R922-L939 VanDerWaalsContact O-CG 3.29Å; R922-L939 WeakPolarHBondContact O-CG 3.07Å; R922-L939 PolarHBondContact O-N 3.03Å; R922-E942 HydrophobicContact CG-CB 4.41Å; R922-E942 HydrophobicContact CG-CG 3.82Å; R922-E942 IonicContact CZ-OE1 2.73Å; R922-E942 IonicContact NE-OE1 2.71Å; R922-E942 IonicContact NH2-OE1 2.74Å; R922-E942 PolarHBondContact NH2-OE1 3.32Å
923	K	73.4	Confident	72	Confident	121.75 Å²	121.75	61 Å²	61	53%	0.529	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	115.1	175.6	-67.1	-177	-179.9	-177.3	0	110.5	V919 K920 D921 T936 Y937	V919-K923 WeakPolarHBondContact CA-O 3.22Å; K920-K923 PolarHBondContact N-O 2.95Å; K920-K923 CarbonylContact O-C 3.56Å; K920-K923 VanDerWaalsContact O-CA 3.29Å; K920-K923 WeakPolarHBondContact O-CA 3.26Å; K920-K923 VanDerWaalsContact O-CB 3.23Å; K920-K923 WeakPolarHBondContact O-CB 3.35Å; K920-K923 PolarHBondContact O-N 2.9Å; K920-K923 VanDerWaalsContact O-O 3.1Å; D921-K923 PolarHBondContact O-N 3.12Å; D921-K923 VanDerWaalsContact O-N 3.12Å; K923-T936 HydrophobicContact CB-CG2 3.75Å; K923-T936 HydrophobicContact CD-CG2 4.28Å; K923-T936 HydrophobicContact CG-CG2 4.28Å; K923-Y937 CarbonylContact C-O 3.41Å; K923-Y937 VanDerWaalsContact CA-O 3.29Å; K923-Y937 WeakPolarHBondContact CA-O 3.32Å
924	M	78.7	Confident	72.2	Confident	31.75 Å²	31.75	62.8 Å²	62.8	16%	0.156	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	116.5	170.8	-179.4	178.1	72.8	0	0	109.9	A917 K918 V919 R922 L926 T936 Y937 L939 A944 I947	A917-M924 HydrophobicContact CB-CG 4.09Å; A917-M924 HydrophobicContact CB-SD 4.09Å; K918-M924 CarbonylContact O-C 3.6Å; K918-M924 VanDerWaalsContact O-CA 3.27Å; K918-M924 WeakPolarHBondContact O-CA 3.3Å; V919-M924 HydrophobicContact CG2-CB 4.21Å; V919-M924 HydrophobicContact CG2-CG 4.23Å; R922-M924 PolarHBondContact O-N 3.42Å; M924-L926 HydrophobicContact CE-CD1 4.06Å; M924-L926 HydrophobicContact CE-CD2 4.14Å; M924-L926 HydrophobicContact CE-CG 4.3Å; M924-L926 HydrophobicContact CG-CD2 3.98Å; M924-L926 HydrophobicContact CG-CG 4.41Å; M924-L926 HydrophobicContact SD-CD2 4.06Å; M924-T936 CarbonylContact O-C 3.49Å; M924-T936 WeakPolarHBondContact O-CA 3.17Å; M924-Y937 HydrophobicContact CE-CD2 3.72Å; M924-Y937 HydrophobicContact CE-CE2 4.29Å; M924-Y937 HydrophobicContact CE-CG 4.12Å; M924-Y937 PolarHBondContact N-O 2.98Å; M924-Y937 PolarHBondContact O-N 3.09Å; M924-L939 HydrophobicContact CB-CD1 4.13Å; M924-L939 HydrophobicContact CB-CD2 4.16Å; M924-L939 HydrophobicContact CB-CG 3.93Å; M924-L939 HydrophobicContact CE-CD2 4.32Å; M924-L939 HydrophobicContact SD-CD2 4.21Å; M924-A944 HydrophobicContact SD-CB 4.17Å; M924-I947 HydrophobicContact SD-CG1 4.13Å
925	Q	81	Confident	72.3	Confident	15 Å²	15	59.7 Å²	59.7	7%	0.07	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	141.4	168.5	-179.1	59	67.1	0	0	109.3	A917 K918 W927 K932 L933 L935 T936 D1285	A917-Q925 VanDerWaalsContact CA-O 3.27Å; A917-Q925 WeakPolarHBondContact CA-O 3.28Å; K918-Q925 PolarHBondContact N-O 3.16Å; K918-Q925 VanDerWaalsContact N-O 3.14Å; K918-Q925 PolarHBondContact O-N 3.34Å; Q925-W927 VanDerWaalsContact C-CZ3 3.48Å; Q925-W927 HydrophobicContact CB-CE3 4.44Å; Q925-W927 HydrophobicContact CB-CH2 3.5Å; Q925-W927 VanDerWaalsContact CB-CH2 3.48Å; Q925-W927 HydrophobicContact CB-CZ2 4.4Å; Q925-W927 HydrophobicContact CB-CZ3 3.52Å; Q925-W927 HydrophobicContact CG-CD2 4.32Å; Q925-W927 HydrophobicContact CG-CE3 4.04Å; Q925-W927 HydrophobicContact CG-CH2 3.2Å; Q925-W927 HydrophobicContact CG-CZ2 3.67Å; Q925-W927 HydrophobicContact CG-CZ3 3.42Å; Q925-W927 VanDerWaalsContact CG-CZ3 3.43Å; Q925-W927 VanDerWaalsContact O-CZ3 3.28Å; Q925-W927 WeakPolarHBondContact O-CZ3 3.28Å; Q925-K932 HydrophobicContact CG-CD 4.41Å; Q925-K932 HydrophobicContact CG-CG 4.11Å; Q925-K932 VanDerWaalsContact OE1-NZ 3.14Å; Q925-L933 PolarHBondContact NE2-O 2.98Å; Q925-L935 VanDerWaalsContact CD-O 3.31Å; Q925-L935 PolarHBondContact NE2-O 3.08Å; Q925-L935 VanDerWaalsContact NE2-O 3.09Å; Q925-L935 PolarHBondContact OE1-O 3.22Å; Q925-L935 VanDerWaalsContact OE1-O 3.07Å; Q925-T936 HydrophobicContact CB-CG2 4.32Å; Q925-T936 VanDerWaalsContact OE1-CB 3.3Å; Q925-T936 PolarHBondContact OE1-OG1 3.12Å; Q925-D1285 WeakPolarHBondContact CG-OD1 3.15Å
926	L	75.5	Confident	72.3	Confident	19 Å²	19	60.1 Å²	60.1	10%	0.099	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	147.8	176.3	-61.7	-177.1	0	0	0	112.5	L915 L916 A917 M924 L933 Y937	L915-L926 HydrophobicContact CD1-CB 4.4Å; L915-L926 HydrophobicContact CD1-CD1 4.31Å; L915-L926 HydrophobicContact CD2-CD2 4.32Å; L916-L926 CarbonylContact O-C 3.56Å; L916-L926 VanDerWaalsContact O-CA 3.28Å; L916-L926 WeakPolarHBondContact O-CA 3.38Å; A917-L926 HydrophobicContact CB-CD2 3.6Å; M924-L926 HydrophobicContact CE-CD1 4.06Å; M924-L926 HydrophobicContact CE-CD2 4.14Å; M924-L926 HydrophobicContact CE-CG 4.3Å; M924-L926 HydrophobicContact CG-CD2 3.98Å; M924-L926 HydrophobicContact CG-CG 4.41Å; M924-L926 HydrophobicContact SD-CD2 4.06Å; L926-L933 HydrophobicContact CB-CB 4.28Å; L926-L933 HydrophobicContact CB-CD1 3.75Å; L926-L933 HydrophobicContact CB-CG 4.27Å; L926-L933 HydrophobicContact CD1-CD1 4.19Å; L926-L933 PolarHBondContact O-N 3.01Å; L926-L933 VanDerWaalsContact O-N 3.16Å; L926-Y937 HydrophobicContact CD1-CD2 4.24Å; L926-Y937 HydrophobicContact CD1-CE2 3.67Å; L926-Y937 HydrophobicContact CG-CD2 4.28Å; L926-Y937 HydrophobicContact CG-CE2 4.04Å
927	W	77.6	Confident	72.2	Confident	42 Å²	42	58.1 Å²	58.1	16%	0.159	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	127.1	170.8	-65.5	-116.9	0	0	0	109.8	L915 L916 K918 Q925 R931 K932 G1284 D1285	L915-W927 CarbonylContact C-O 3.08Å; L915-W927 VanDerWaalsContact CA-O 3.26Å; L915-W927 WeakPolarHBondContact CA-O 3.34Å; L916-W927 HydrophobicContact CB-CB 4.07Å; L916-W927 HydrophobicContact CB-CD2 4.46Å; L916-W927 HydrophobicContact CB-CE3 4.41Å; L916-W927 HydrophobicContact CB-CG 3.96Å; L916-W927 HydrophobicContact CD2-CB 4.47Å; L916-W927 HydrophobicContact CD2-CD2 4.27Å; L916-W927 HydrophobicContact CD2-CE3 4.08Å; L916-W927 HydrophobicContact CD2-CG 4.2Å; L916-W927 HydrophobicContact CD2-CZ3 4.49Å; L916-W927 HydrophobicContact CG-CB 4.17Å; L916-W927 HydrophobicContact CG-CD2 4Å; L916-W927 HydrophobicContact CG-CE3 4.22Å; L916-W927 HydrophobicContact CG-CG 3.92Å; L916-W927 PolarHBondContact N-O 3.21Å; L916-W927 WeakPolarHBondContact O-CB 3.47Å; L916-W927 PolarHBondContact O-N 3.19Å; K918-W927 HydrophobicContact CB-CE3 4.21Å; K918-W927 HydrophobicContact CB-CH2 3.66Å; K918-W927 VanDerWaalsContact CB-CH2 3.41Å; K918-W927 HydrophobicContact CB-CZ2 4.48Å; K918-W927 HydrophobicContact CB-CZ3 3.41Å; K918-W927 VanDerWaalsContact CB-CZ3 3.47Å; K918-W927 HydrophobicContact CD-CH2 3.56Å; K918-W927 HydrophobicContact CD-CZ2 4.14Å; K918-W927 HydrophobicContact CD-CZ3 4.04Å; K918-W927 HydrophobicContact CG-CE3 4.37Å; K918-W927 HydrophobicContact CG-CH2 3.82Å; K918-W927 HydrophobicContact CG-CZ3 3.78Å; K918-W927 VanDerWaalsContact CG-CZ3 3.47Å; Q925-W927 VanDerWaalsContact C-CZ3 3.48Å; Q925-W927 HydrophobicContact CB-CE3 4.44Å; Q925-W927 HydrophobicContact CB-CH2 3.5Å; Q925-W927 VanDerWaalsContact CB-CH2 3.48Å; Q925-W927 HydrophobicContact CB-CZ2 4.4Å; Q925-W927 HydrophobicContact CB-CZ3 3.52Å; Q925-W927 HydrophobicContact CG-CD2 4.32Å; Q925-W927 HydrophobicContact CG-CE3 4.04Å; Q925-W927 HydrophobicContact CG-CH2 3.2Å; Q925-W927 HydrophobicContact CG-CZ2 3.67Å; Q925-W927 HydrophobicContact CG-CZ3 3.42Å; Q925-W927 VanDerWaalsContact CG-CZ3 3.43Å; Q925-W927 VanDerWaalsContact O-CZ3 3.28Å; Q925-W927 WeakPolarHBondContact O-CZ3 3.28Å; W927-R931 CarbonylContact C-O 3.32Å; W927-R931 VanDerWaalsContact CA-O 3.24Å; W927-R931 WeakPolarHBondContact CA-O 3.34Å; W927-R931 WeakPolarHBondContact CB-O 3.23Å; W927-K932 VanDerWaalsContact CD1-CA 3.41Å; W927-K932 VanDerWaalsContact CD1-N 3.29Å; W927-K932 HydrophobicContact CG-CB 4.4Å; W927-K932 HydrophobicContact CZ2-CD 4.43Å; W927-K932 HydrophobicContact CZ2-CG 4.37Å; W927-G1284 WeakPolarHBondContact CZ2-O 3.44Å; W927-G1284 PolarHBondContact NE1-O 2.8Å; W927-D1285 VanDerWaalsContact CZ2-OD1 3.22Å; W927-D1285 WeakPolarHBondContact CZ2-OD1 3.41Å
928	L	71.6	Confident	72	Confident	2.75 Å²	2.75	60.5 Å²	60.5	1%	0.014	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	121.7	176.2	-179.3	66.5	0	0	0	109.8	W884 L905 L907 F913 N914 L915 G930 R931 L933	W884-L928 HydrophobicContact CH2-CD1 4.02Å; W884-L928 HydrophobicContact CH2-CD2 3.93Å; W884-L928 HydrophobicContact CH2-CG 4.28Å; W884-L928 HydrophobicContact CZ2-CD1 4.21Å; W884-L928 HydrophobicContact CZ2-CD2 3.56Å; W884-L928 HydrophobicContact CZ2-CG 4.39Å; W884-L928 HydrophobicContact CZ3-CD1 4.5Å; L905-L928 HydrophobicContact CB-CD2 4.3Å; L905-L928 HydrophobicContact CD1-CB 4.09Å; L905-L928 HydrophobicContact CD1-CD2 4Å; L905-L928 HydrophobicContact CD1-CG 4.12Å; L905-L928 HydrophobicContact CD2-CB 4.32Å; L905-L928 HydrophobicContact CD2-CD1 4.48Å; L905-L928 HydrophobicContact CD2-CD2 4.2Å; L905-L928 HydrophobicContact CD2-CG 4.42Å; L905-L928 WeakPolarHBondContact CD2-O 3.44Å; L905-L928 HydrophobicContact CG-CD2 4.36Å; L907-L928 HydrophobicContact CD2-CD1 4.18Å; L907-L928 HydrophobicContact CD2-CD2 4.27Å; L907-L928 HydrophobicContact CD2-CG 4.47Å; F913-L928 HydrophobicContact CB-CD1 4.13Å; F913-L928 HydrophobicContact CD1-CD1 4.14Å; F913-L928 HydrophobicContact CD2-CD1 3.46Å; F913-L928 VanDerWaalsContact CD2-CD1 3.49Å; F913-L928 HydrophobicContact CE1-CD1 4.24Å; F913-L928 HydrophobicContact CE2-CD1 4.07Å; F913-L928 VanDerWaalsContact CE2-CD1 3.41Å; F913-L928 HydrophobicContact CG-CD1 3.97Å; F913-L928 HydrophobicContact CZ-CD1 3.91Å; N914-L928 CarbonylContact O-C 3.29Å; N914-L928 WeakPolarHBondContact O-CA 3.32Å; L915-L928 HydrophobicContact CD1-CB 4.27Å; L915-L928 HydrophobicContact CD1-CD1 4.36Å; L928-G930 VanDerWaalsContact C-N 3.31Å; L928-G930 CarbonylContact O-C 3.59Å; L928-G930 PolarHBondContact O-N 2.93Å; L928-R931 VanDerWaalsContact C-N 3.33Å; L928-R931 PolarHBondContact N-O 2.88Å; L928-R931 WeakPolarHBondContact O-CA 3.24Å; L928-R931 WeakPolarHBondContact O-CB 3.33Å; L928-R931 PolarHBondContact O-N 3.04Å; L928-L933 HydrophobicContact CB-CD1 4.24Å; L928-L933 HydrophobicContact CB-CD2 3.92Å; L928-L933 HydrophobicContact CB-CG 4.24Å; L928-L933 HydrophobicContact CD2-CD2 4.15Å
929	N	69.9	Low	71.7	Confident	52.5 Å²	52.5	59.1 Å²	59.1	28%	0.281	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.5	44	-172.5	-71.6	-17.9	0	0	0	112.2	L905 P906 F913 N914 R931 Q1287	L905-N929 HydrophobicContact CD2-CB 4.14Å; P906-N929 PolarHBondContact O-ND2 2.68Å; F913-N929 VanDerWaalsContact CA-OD1 3.23Å; F913-N929 WeakPolarHBondContact CA-OD1 3.31Å; F913-N929 WeakPolarHBondContact CB-ND2 3.38Å; F913-N929 VanDerWaalsContact CB-OD1 3.28Å; F913-N929 WeakPolarHBondContact CB-OD1 3.38Å; N914-N929 PolarHBondContact N-OD1 2.96Å; N914-N929 WeakPolarHBondContact O-CA 3.1Å; N914-N929 PolarHBondContact O-N 2.82Å; N914-N929 PolarHBondContact O-OD1 2.79Å; N929-R931 VanDerWaalsContact C-N 3.3Å; N929-R931 PolarHBondContact O-N 3Å; N929-Q1287 PolarHBondContact O-NE2 2.63Å
930	G	67.5	Low	71.3	Confident	46.25 Å²	46.25	61.2 Å²	61.2	48%	0.477	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.3	2.1	-175.5	0	0	0	0	0	115	L928 K932 Q1188 Q1287	L928-G930 VanDerWaalsContact C-N 3.31Å; L928-G930 CarbonylContact O-C 3.59Å; L928-G930 PolarHBondContact O-N 2.93Å; G930-K932 PolarHBondContact O-N 2.78Å; G930-Q1188 WeakPolarHBondContact O-CG 3.09Å; G930-Q1188 PolarHBondContact O-NE2 3.4Å; G930-Q1188 VanDerWaalsContact O-NE2 3.14Å; G930-Q1287 WeakPolarHBondContact O-CA 3.43Å; G930-Q1287 WeakPolarHBondContact O-CB 3.38Å; G930-Q1287 WeakPolarHBondContact O-CG 3.31Å
931	R	67.1	Low	70.9	Confident	142 Å²	142	58.5 Å²	58.5	54%	0.536	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	124.9	176	-59.1	-168.8	-179.3	-167.2	1.6	111	L905 W927 L928 N929 L933 Q1188 P1189 Q1287	L905-R931 HydrophobicContact CD1-CB 4.06Å; L905-R931 HydrophobicContact CD2-CB 3.82Å; L905-R931 HydrophobicContact CD2-CG 3.94Å; L905-R931 HydrophobicContact CG-CB 4.29Å; L905-R931 HydrophobicContact CG-CG 4.4Å; W927-R931 CarbonylContact C-O 3.32Å; W927-R931 VanDerWaalsContact CA-O 3.24Å; W927-R931 WeakPolarHBondContact CA-O 3.34Å; W927-R931 WeakPolarHBondContact CB-O 3.23Å; L928-R931 VanDerWaalsContact C-N 3.33Å; L928-R931 PolarHBondContact N-O 2.88Å; L928-R931 WeakPolarHBondContact O-CA 3.24Å; L928-R931 WeakPolarHBondContact O-CB 3.33Å; L928-R931 PolarHBondContact O-N 3.04Å; N929-R931 VanDerWaalsContact C-N 3.3Å; N929-R931 PolarHBondContact O-N 3Å; R931-L933 PolarHBondContact O-N 2.9Å; R931-Q1188 VanDerWaalsContact N-NE2 3.15Å; R931-P1189 VanDerWaalsContact CB-CD 3.43Å; R931-P1189 HydrophobicContact CB-CG 3.73Å; R931-P1189 HydrophobicContact CG-CG 4.02Å; R931-Q1287 HydrophobicContact CG-CG 4.48Å; R931-Q1287 VanDerWaalsContact CZ-OE1 3.28Å; R931-Q1287 VanDerWaalsContact NE-CD 3.34Å
932	K	75.8	Confident	70.3	Confident	97.75 Å²	97.75	59.4 Å²	59.4	43%	0.425	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	124.7	178.6	-166.3	-167.8	176.7	177	0	108.9	Q925 W927 G930 Q1188 D1190 S1192 D1285	Q925-K932 HydrophobicContact CG-CD 4.41Å; Q925-K932 HydrophobicContact CG-CG 4.11Å; Q925-K932 VanDerWaalsContact OE1-NZ 3.14Å; W927-K932 VanDerWaalsContact CD1-CA 3.41Å; W927-K932 VanDerWaalsContact CD1-N 3.29Å; W927-K932 HydrophobicContact CG-CB 4.4Å; W927-K932 HydrophobicContact CZ2-CD 4.43Å; W927-K932 HydrophobicContact CZ2-CG 4.37Å; G930-K932 PolarHBondContact O-N 2.78Å; K932-Q1188 VanDerWaalsContact CA-CD 3.48Å; K932-Q1188 HydrophobicContact CB-CB 3.45Å; K932-Q1188 VanDerWaalsContact CB-CB 3.45Å; K932-Q1188 HydrophobicContact CB-CG 4.14Å; K932-Q1188 VanDerWaalsContact N-CG 3.32Å; K932-Q1188 VanDerWaalsContact N-OE1 3.14Å; K932-D1190 WeakPolarHBondContact CD-O 3.25Å; K932-S1192 PolarHBondContact NZ-OG 3.07Å; K932-D1285 HydrophobicContact CB-CB 4.48Å; K932-D1285 HydrophobicContact CD-CB 4.38Å; K932-D1285 VanDerWaalsContact CD-OD2 3.26Å; K932-D1285 WeakPolarHBondContact CD-OD2 3.33Å; K932-D1285 WeakPolarHBondContact CE-OD1 3.29Å; K932-D1285 VanDerWaalsContact CE-OD2 3.29Å; K932-D1285 WeakPolarHBondContact CE-OD2 3.23Å; K932-D1285 HydrophobicContact CG-CB 4.27Å; K932-D1285 IonicContact NZ-OD1 2.68Å; K932-D1285 PolarHBondContact NZ-OD1 2.86Å; K932-D1285 IonicContact NZ-OD2 2.73Å; K932-D1285 PolarHBondContact NZ-OD2 2.82Å
933	L	71.5	Confident	69.5	Low	3.5 Å²	3.5	60.5 Å²	60.5	2%	0.018	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	141.4	169.9	-60.2	-179.8	0	0	0	108.3	W884 F901 S903 L905 L915 Q925 L926 L928 R931 L935	W884-L933 HydrophobicContact CE3-CD1 3.75Å; W884-L933 HydrophobicContact CZ3-CD1 3.73Å; F901-L933 HydrophobicContact CD2-CB 4.44Å; F901-L933 HydrophobicContact CD2-CD2 4.28Å; F901-L933 HydrophobicContact CE1-CD1 4.28Å; F901-L933 HydrophobicContact CE2-CB 3.86Å; F901-L933 HydrophobicContact CE2-CD1 4.11Å; F901-L933 VanDerWaalsContact CE2-CD1 3.46Å; F901-L933 HydrophobicContact CE2-CD2 3.9Å; F901-L933 HydrophobicContact CE2-CG 4.17Å; F901-L933 HydrophobicContact CZ-CB 4.07Å; F901-L933 HydrophobicContact CZ-CD1 3.73Å; F901-L933 HydrophobicContact CZ-CD2 4.28Å; F901-L933 HydrophobicContact CZ-CG 4.2Å; S903-L933 WeakPolarHBondContact OG-CD2 3.23Å; L905-L933 HydrophobicContact CD1-CD2 3.78Å; L915-L933 HydrophobicContact CD1-CD1 4.23Å; Q925-L933 PolarHBondContact NE2-O 2.98Å; L926-L933 HydrophobicContact CB-CB 4.28Å; L926-L933 HydrophobicContact CB-CD1 3.75Å; L926-L933 HydrophobicContact CB-CG 4.27Å; L926-L933 HydrophobicContact CD1-CD1 4.19Å; L926-L933 PolarHBondContact O-N 3.01Å; L926-L933 VanDerWaalsContact O-N 3.16Å; L928-L933 HydrophobicContact CB-CD1 4.24Å; L928-L933 HydrophobicContact CB-CD2 3.92Å; L928-L933 HydrophobicContact CB-CG 4.24Å; L928-L933 HydrophobicContact CD2-CD2 4.15Å; R931-L933 PolarHBondContact O-N 2.9Å; L933-L935 VanDerWaalsContact C-N 3.31Å; L933-L935 PolarHBondContact O-N 3.12Å; L933-L935 VanDerWaalsContact O-N 3.12Å
934	P	66.8	Low	68.8	Low	91.75 Å²	91.75	56.3 Å²	56.3	60%	0.596	30%	0.302	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.9	-27	-169.3	-2.8	1.5	0	0	0	113.9	F901 D1190	F901-P934 HydrophobicContact CB-CG 4.3Å; F901-P934 HydrophobicContact CD2-CG 4.16Å; F901-P934 HydrophobicContact CG-CG 4.27Å; P934-D1190 HydrophobicContact CB-CB 3.84Å
935	L	65.7	Low	67.6	Low	27 Å²	27	63.3 Å²	63.3	14%	0.141	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	140.1	-173.9	-97.3	93.4	0	0	0	113.8	D899 F901 Q925 L933 Y937	D899-L935 HydrophobicContact CB-CD1 3.83Å; D899-L935 HydrophobicContact CB-CD2 3.33Å; D899-L935 VanDerWaalsContact CB-CD2 3.42Å; D899-L935 HydrophobicContact CB-CG 3.94Å; D899-L935 VanDerWaalsContact O-CD2 3.29Å; D899-L935 WeakPolarHBondContact O-CD2 3.29Å; D899-L935 WeakPolarHBondContact OD2-CD2 3.43Å; F901-L935 HydrophobicContact CB-CD1 3.83Å; F901-L935 HydrophobicContact CD1-CB 4.28Å; F901-L935 HydrophobicContact CD1-CD1 4Å; F901-L935 HydrophobicContact CD1-CD2 3.5Å; F901-L935 VanDerWaalsContact CD1-CD2 3.5Å; F901-L935 HydrophobicContact CD1-CG 4.12Å; F901-L935 HydrophobicContact CE1-CD2 4.01Å; F901-L935 HydrophobicContact CG-CD1 3.9Å; F901-L935 HydrophobicContact CG-CD2 4.43Å; Q925-L935 VanDerWaalsContact CD-O 3.31Å; Q925-L935 PolarHBondContact NE2-O 3.08Å; Q925-L935 VanDerWaalsContact NE2-O 3.09Å; Q925-L935 PolarHBondContact OE1-O 3.22Å; Q925-L935 VanDerWaalsContact OE1-O 3.07Å; L933-L935 VanDerWaalsContact C-N 3.31Å; L933-L935 PolarHBondContact O-N 3.12Å; L933-L935 VanDerWaalsContact O-N 3.12Å; L935-Y937 HydrophobicContact CB-CE1 3.93Å; L935-Y937 HydrophobicContact CB-CE2 4.22Å; L935-Y937 WeakPolarHBondContact CB-OH 3.28Å; L935-Y937 HydrophobicContact CD2-CD1 4.03Å; L935-Y937 HydrophobicContact CD2-CE1 3.64Å; L935-Y937 HydrophobicContact CD2-CE2 4.33Å; L935-Y937 HydrophobicContact CG-CE1 4.34Å
936	T	67.9	Low	66.2	Low	65 Å²	65	67.8 Å²	67.8	40%	0.399	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	121.6	166.5	-30.6	0	0	0	0	108.6	K923 M924 Q925	K923-T936 HydrophobicContact CB-CG2 3.75Å; K923-T936 HydrophobicContact CD-CG2 4.28Å; K923-T936 HydrophobicContact CG-CG2 4.28Å; M924-T936 CarbonylContact O-C 3.49Å; M924-T936 WeakPolarHBondContact O-CA 3.17Å; Q925-T936 HydrophobicContact CB-CG2 4.32Å; Q925-T936 VanDerWaalsContact OE1-CB 3.3Å; Q925-T936 PolarHBondContact OE1-OG1 3.12Å
937	Y	69.5	Low	65.4	Low	8.5 Å²	8.5	69.5 Å²	69.5	3%	0.033	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	138.1	-177.3	-56.8	-74.2	0	0	0	111	S886 Q897 F901 K923 M924 L926 L935 L939	S886-Y937 VanDerWaalsContact CB-CE1 3.45Å; S886-Y937 VanDerWaalsContact CB-CZ 3.46Å; S886-Y937 WeakPolarHBondContact CB-OH 3.48Å; S886-Y937 VanDerWaalsContact OG-CD1 3.31Å; S886-Y937 WeakPolarHBondContact OG-CD1 3.12Å; S886-Y937 VanDerWaalsContact OG-CE1 3.22Å; S886-Y937 WeakPolarHBondContact OG-CE1 3.42Å; Q897-Y937 HydrophobicContact CB-CD1 4.05Å; Q897-Y937 HydrophobicContact CB-CE1 4.27Å; Q897-Y937 HydrophobicContact CG-CD1 3.93Å; Q897-Y937 HydrophobicContact CG-CE1 4.45Å; F901-Y937 WeakPolarHBondContact CD1-OH 3.48Å; F901-Y937 HydrophobicContact CE1-CE2 4.34Å; F901-Y937 WeakPolarHBondContact CE1-OH 3.33Å; K923-Y937 CarbonylContact C-O 3.41Å; K923-Y937 VanDerWaalsContact CA-O 3.29Å; K923-Y937 WeakPolarHBondContact CA-O 3.32Å; M924-Y937 HydrophobicContact CE-CD2 3.72Å; M924-Y937 HydrophobicContact CE-CE2 4.29Å; M924-Y937 HydrophobicContact CE-CG 4.12Å; M924-Y937 PolarHBondContact N-O 2.98Å; M924-Y937 PolarHBondContact O-N 3.09Å; L926-Y937 HydrophobicContact CD1-CD2 4.24Å; L926-Y937 HydrophobicContact CD1-CE2 3.67Å; L926-Y937 HydrophobicContact CG-CD2 4.28Å; L926-Y937 HydrophobicContact CG-CE2 4.04Å; L935-Y937 HydrophobicContact CB-CE1 3.93Å; L935-Y937 HydrophobicContact CB-CE2 4.22Å; L935-Y937 WeakPolarHBondContact CB-OH 3.28Å; L935-Y937 HydrophobicContact CD2-CD1 4.03Å; L935-Y937 HydrophobicContact CD2-CE1 3.64Å; L935-Y937 HydrophobicContact CD2-CE2 4.33Å; L935-Y937 HydrophobicContact CG-CE1 4.34Å; Y937-L939 PolarHBondContact O-N 3.07Å
938	T	69.7	Low	64.1	Low	79.75 Å²	79.75	71.6 Å²	71.6	49%	0.489	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	118.2	170.8	-56.9	0	0	0	0	109.4	Q897 R922	Q897-T938 PolarHBondContact NE2-O 3.02Å; R922-T938 HydrophobicContact CB-CG2 4.21Å; R922-T938 CarbonylContact O-C 3.55Å; R922-T938 WeakPolarHBondContact O-CA 3.37Å
939	L	66.1	Low	63.3	Low	25.75 Å²	25.75	73.3 Å²	73.3	14%	0.135	38%	0.381	C	S	.	.			trans	-77.1	144.1	172.9	-63.2	178.7	0	0	0	110.5	T888 V919 R922 M924 Y937 A941 A944	T888-L939 HydrophobicContact CG2-CD2 4.31Å; V919-L939 HydrophobicContact CB-CD1 4.37Å; V919-L939 HydrophobicContact CG1-CD1 3.7Å; V919-L939 HydrophobicContact CG2-CD1 3.78Å; R922-L939 VanDerWaalsContact O-CB 3.22Å; R922-L939 WeakPolarHBondContact O-CB 3.44Å; R922-L939 VanDerWaalsContact O-CG 3.29Å; R922-L939 WeakPolarHBondContact O-CG 3.07Å; R922-L939 PolarHBondContact O-N 3.03Å; M924-L939 HydrophobicContact CB-CD1 4.13Å; M924-L939 HydrophobicContact CB-CD2 4.16Å; M924-L939 HydrophobicContact CB-CG 3.93Å; M924-L939 HydrophobicContact CE-CD2 4.32Å; M924-L939 HydrophobicContact SD-CD2 4.21Å; Y937-L939 PolarHBondContact O-N 3.07Å; L939-A941 VanDerWaalsContact CB-O 3.24Å; L939-A941 WeakPolarHBondContact CB-O 3.38Å; L939-A941 PolarHBondContact O-N 3.08Å; L939-A941 VanDerWaalsContact O-N 3.12Å; L939-A944 HydrophobicContact CD1-CB 3.84Å; L939-A944 HydrophobicContact CD2-CB 4.42Å
940	P	63.2	Low	62.2	Low	76.5 Å²	76.5	73.4 Å²	73.4	50%	0.497	40%	0.395	S	S	.	.	S	Bend	trans	-68.9	-11.9	176.9	30.4	-38.1	0	0	0	113.2	T888 T890	T888-P940 VanDerWaalsContact CG2-CD 3.44Å; T888-P940 HydrophobicContact CG2-CG 4.07Å; T890-P940 HydrophobicContact CG2-CB 3.82Å; T890-P940 HydrophobicContact CG2-CG 3.85Å; T890-P940 WeakPolarHBondContact OG1-CG 3.35Å
941	A	63.4	Low	61.8	Low	46 Å²	46	74.2 Å²	74.2	38%	0.38	40%	0.403	S	S	.	.	S	Bend	trans	-143.6	157.2	179	0	0	0	0	0	110.6	L939 R943	L939-A941 VanDerWaalsContact CB-O 3.24Å; L939-A941 WeakPolarHBondContact CB-O 3.38Å; L939-A941 PolarHBondContact O-N 3.08Å; L939-A941 VanDerWaalsContact O-N 3.12Å; A941-R943 PolarHBondContact O-N 2.97Å
942	E	60.8	Low	61.1	Low	125.5 Å²	125.5	76.8 Å²	76.8	59%	0.586	42%	0.421	S	S	*	.	S	Bend	trans	-66.3	-21.9	-179.3	-67.8	166.2	-169.4	0	0	114.2	V919 R922	V919-E942 VanDerWaalsContact CG1-O 3.25Å; V919-E942 WeakPolarHBondContact CG1-O 3.23Å; R922-E942 HydrophobicContact CG-CB 4.41Å; R922-E942 HydrophobicContact CG-CG 3.82Å; R922-E942 IonicContact CZ-OE1 2.73Å; R922-E942 IonicContact NE-OE1 2.71Å; R922-E942 IonicContact NH2-OE1 2.74Å; R922-E942 PolarHBondContact NH2-OE1 3.32Å
943	R	56.3	Low	60	Low	150.75 Å²	150.75	74 Å²	74	57%	0.569	41%	0.412	S	S	*	.	S	Bend	trans	-127.7	123.4	-177.7	-60.1	-177	-177	-176.7	-0.2	111	A941 K945 H962 E1348	A941-R943 PolarHBondContact O-N 2.97Å; R943-K945 PolarHBondContact O-N 3.05Å; R943-K945 VanDerWaalsContact O-N 3.16Å; R943-H962 WeakPolarHBondContact CA-NE2 3.45Å; R943-E1348 WeakPolarHBondContact CD-OE2 3.39Å; R943-E1348 IonicContact CZ-OE2 2.74Å; R943-E1348 IonicContact NE-OE2 3.62Å; R943-E1348 VanDerWaalsContact NH1-CD 3.31Å; R943-E1348 IonicContact NH1-OE1 3.9Å; R943-E1348 PolarHBondContact NH1-OE1 3Å; R943-E1348 IonicContact NH1-OE2 2.83Å; R943-E1348 PolarHBondContact NH1-OE2 2.92Å
944	A	59.5	Low	58.7	Low	33 Å²	33	82 Å²	82	27%	0.273	45%	0.45	S	S	.	.			trans	-70.9	111.6	167.1	0	0	0	0	0	109.5	V919 M924 L939 K946 I947 H962	V919-A944 HydrophobicContact CG2-CB 3.75Å; M924-A944 HydrophobicContact SD-CB 4.17Å; L939-A944 HydrophobicContact CD1-CB 3.84Å; L939-A944 HydrophobicContact CD2-CB 4.42Å; A944-K946 VanDerWaalsContact C-N 3.3Å; A944-K946 PolarHBondContact O-N 3.44Å; A944-I947 HydrophobicContact CB-CG1 4.35Å; A944-H962 PolarHBondContact N-NE2 2.8Å; A944-H962 PolarHBondContact O-CE1 3.11Å; A944-H962 PolarHBondContact O-NE2 2.92Å; A944-H962 VanDerWaalsContact O-NE2 3.16Å
945	K	54.2	Low	57.6	Low	179.75 Å²	179.75	80.4 Å²	80.4	78%	0.782	44%	0.443	S	S	*	.	S	Bend	trans	-76.6	-30.1	177.8	-69.4	-176.9	171.5	-176.7	0	113	R943 G1104 R1105 N1106	R943-K945 PolarHBondContact O-N 3.05Å; R943-K945 VanDerWaalsContact O-N 3.16Å; K945-G1104 CarbonylContact C-O 3.59Å; K945-G1104 WeakPolarHBondContact CA-O 3.3Å; K945-G1104 WeakPolarHBondContact CB-O 3.48Å; K945-G1104 CarbonylContact O-C 3.59Å; K945-G1104 VanDerWaalsContact O-CA 3.26Å; K945-G1104 WeakPolarHBondContact O-CA 3.27Å; K945-R1105 HydrophobicContact CB-CB 4.41Å; K945-R1105 HydrophobicContact CB-CG 4.02Å; K945-N1106 WeakPolarHBondContact CB-OD1 3.49Å; K945-N1106 HydrophobicContact CD-CB 4.16Å; K945-N1106 WeakPolarHBondContact CD-OD1 3.46Å; K945-N1106 WeakPolarHBondContact CE-OD1 3.17Å; K945-N1106 VanDerWaalsContact CG-OD1 3.27Å; K945-N1106 WeakPolarHBondContact CG-OD1 3.36Å
946	K	50.3	Low	57	Low	109 Å²	109	82.3 Å²	82.3	47%	0.474	45%	0.451	S	S	.	.			trans	-142.8	136.2	175.5	-164.7	169.7	-179.5	170.6	0	109.1	A944 I948 N1078 V1102 N1103 R1105	A944-K946 VanDerWaalsContact C-N 3.3Å; A944-K946 PolarHBondContact O-N 3.44Å; K946-I948 HydrophobicContact CB-CG1 4.29Å; K946-I948 HydrophobicContact CD-CD1 3.88Å; K946-I948 HydrophobicContact CD-CG1 4.05Å; K946-I948 HydrophobicContact CG-CD1 4.34Å; K946-I948 HydrophobicContact CG-CG1 3.98Å; K946-N1078 PolarHBondContact NZ-O 2.73Å; K946-V1102 WeakPolarHBondContact CD-O 3.47Å; K946-V1102 WeakPolarHBondContact CE-O 3.32Å; K946-V1102 WeakPolarHBondContact CG-O 3.11Å; K946-N1103 HydrophobicContact CD-CB 4.11Å; K946-N1103 WeakPolarHBondContact CE-OD1 3.44Å; K946-N1103 VanDerWaalsContact CG-C 3.48Å; K946-N1103 HydrophobicContact CG-CB 3.72Å; K946-N1103 VanDerWaalsContact CG-O 3.23Å; K946-N1103 WeakPolarHBondContact CG-O 3.28Å; K946-N1103 PolarHBondContact NZ-OD1 2.99Å; K946-R1105 HydrophobicContact CB-CB 3.5Å; K946-R1105 HydrophobicContact CB-CG 3.45Å; K946-R1105 VanDerWaalsContact CB-CG 3.45Å; K946-R1105 HydrophobicContact CD-CB 4Å; K946-R1105 HydrophobicContact CG-CB 4.13Å; K946-R1105 PolarHBondContact O-NH2 3.4Å; K946-R1105 VanDerWaalsContact O-NH2 3.13Å
947	I	58.6	Low	56	Low	54 Å²	54	84.1 Å²	84.1	28%	0.277	46%	0.457	S	S	.	.			trans	-106.8	139.7	163.1	-61.5	163	0	0	0	107	L915 A917 M924 A944 V958 A960 I991	L915-I947 HydrophobicContact CD2-CG2 4.1Å; A917-I947 HydrophobicContact CB-CD1 3.95Å; A917-I947 HydrophobicContact CB-CG1 4.07Å; M924-I947 HydrophobicContact SD-CG1 4.13Å; A944-I947 HydrophobicContact CB-CG1 4.35Å; I947-V958 HydrophobicContact CB-CG1 4.12Å; I947-V958 HydrophobicContact CD1-CG1 3.9Å; I947-V958 HydrophobicContact CG1-CG1 4.35Å; I947-V958 HydrophobicContact CG2-CG1 4.04Å; I947-V958 HydrophobicContact CG2-CG2 4.26Å; I947-A960 HydrophobicContact CD1-CB 3.8Å; I947-A960 HydrophobicContact CG1-CB 4.23Å; I947-I991 HydrophobicContact CB-CD1 3.99Å; I947-I991 WeakPolarHBondContact O-CD1 3.46Å
948	I	51	Low	55.2	Low	86.5 Å²	86.5	85.9 Å²	85.9	44%	0.444	47%	0.469	S	S	.	.			trans	-130.2	122.1	179.7	-52.9	179.1	0	0	0	107	L889 W894 K946 N1078 R1080 D1083	L889-I948 HydrophobicContact CD2-CD1 4.39Å; W894-I948 HydrophobicContact CH2-CB 3.93Å; W894-I948 HydrophobicContact CH2-CD1 3.75Å; W894-I948 HydrophobicContact CH2-CG1 4.42Å; W894-I948 HydrophobicContact CH2-CG2 4.09Å; W894-I948 HydrophobicContact CZ2-CD1 4.03Å; W894-I948 HydrophobicContact CZ2-CG2 4.46Å; K946-I948 HydrophobicContact CB-CG1 4.29Å; K946-I948 HydrophobicContact CD-CD1 3.88Å; K946-I948 HydrophobicContact CD-CG1 4.05Å; K946-I948 HydrophobicContact CG-CD1 4.34Å; K946-I948 HydrophobicContact CG-CG1 3.98Å; I948-N1078 WeakPolarHBondContact CD1-O 3.32Å; I948-R1080 PolarHBondContact O-NH1 2.99Å; I948-D1083 VanDerWaalsContact CG2-CG 3.46Å; I948-D1083 VanDerWaalsContact CG2-OD1 3.32Å; I948-D1083 WeakPolarHBondContact CG2-OD1 3.34Å; I948-D1083 WeakPolarHBondContact CG2-OD2 3.35Å
949	I	55	Low	54.2	Low	38.25 Å²	38.25	85.3 Å²	85.3	20%	0.196	46%	0.463	C	S	.	.			trans	-97.7	142.8	169.1	-62.6	-176.3	0	0	0	107.6	F913 L915 V953 F956 V958 R1080 T1082	F913-I949 HydrophobicContact CE2-CD1 3.91Å; F913-I949 HydrophobicContact CE2-CG2 4.32Å; F913-I949 HydrophobicContact CZ-CD1 4.5Å; F913-I949 HydrophobicContact CZ-CG2 3.92Å; L915-I949 HydrophobicContact CB-CD1 3.59Å; L915-I949 HydrophobicContact CD2-CD1 3.84Å; L915-I949 VanDerWaalsContact CD2-CD1 3.42Å; L915-I949 HydrophobicContact CD2-CG1 3.74Å; L915-I949 HydrophobicContact CG-CD1 4.11Å; I949-V953 HydrophobicContact CG2-CB 4.32Å; I949-V953 HydrophobicContact CG2-CG1 4.24Å; I949-V953 HydrophobicContact CG2-CG2 4.24Å; I949-F956 HydrophobicContact CB-CB 4.33Å; I949-F956 HydrophobicContact CB-CD1 3.82Å; I949-F956 HydrophobicContact CB-CD2 4.19Å; I949-F956 HydrophobicContact CB-CE1 3.83Å; I949-F956 HydrophobicContact CB-CE2 4.22Å; I949-F956 HydrophobicContact CB-CG 4.05Å; I949-F956 HydrophobicContact CB-CZ 4.08Å; I949-F956 HydrophobicContact CD1-CB 3.91Å; I949-F956 HydrophobicContact CD1-CD1 4.34Å; I949-F956 HydrophobicContact CD1-CD2 3.83Å; I949-F956 HydrophobicContact CD1-CE2 4.35Å; I949-F956 HydrophobicContact CD1-CG 3.82Å; I949-F956 HydrophobicContact CG1-CD2 4.28Å; I949-F956 HydrophobicContact CG1-CE2 4.41Å; I949-F956 HydrophobicContact CG1-CG 4.34Å; I949-F956 HydrophobicContact CG2-CB 4.09Å; I949-F956 HydrophobicContact CG2-CD1 3.79Å; I949-F956 HydrophobicContact CG2-CE1 4.07Å; I949-F956 HydrophobicContact CG2-CG 4.16Å; I949-F956 VanDerWaalsContact O-CE1 3.3Å; I949-F956 WeakPolarHBondContact O-CE1 3.48Å; I949-V958 HydrophobicContact CD1-CG2 3.55Å; I949-V958 HydrophobicContact CG1-CG2 4.08Å; I949-R1080 WeakPolarHBondContact O-CB 3.28Å; I949-R1080 VanDerWaalsContact O-CD 3.29Å; I949-R1080 WeakPolarHBondContact O-CD 3.14Å; I949-R1080 PolarHBondContact O-NH1 3.31Å; I949-T1082 PolarHBondContact O-OG1 2.86Å
950	G	46.3	Very low	53.6	Low	55 Å²	55	85.8 Å²	85.8	57%	0.567	47%	0.47	S	S	*	.			trans	-157.6	162.3	-179	0	0	0	0	0	111.3	R1080 T1082	G950-R1080 VanDerWaalsContact N-NH1 3.18Å; G950-T1082 VanDerWaalsContact C-CG2 3.49Å; G950-T1082 WeakPolarHBondContact CA-OG1 3.43Å; G950-T1082 PolarHBondContact N-OG1 2.86Å
951	G	58.8	Low	53	Low	62.5 Å²	62.5	85.1 Å²	85.1	64%	0.644	46%	0.462	S	S	*	.	S	Bend	trans	116.9	-162.1	-166.6	0	0	0	0	0	110.6	V953 T1082	G951-V953 PolarHBondContact O-N 3.16Å; G951-T1082 WeakPolarHBondContact O-CG2 3.43Å
952	E	53.2	Low	52.5	Low	197.25 Å²	197.25	86.7 Å²	86.7	92%	0.922	46%	0.462	S	S	*	.	S	Bend	trans	-85.4	69.4	176.2	-62.9	-179.6	164	0	0	110.2
953	V	52	Low	52	Low	38.25 Å²	38.25	85.3 Å²	85.3	23%	0.232	46%	0.455	C	S	.	.			trans	-118.3	113.3	-178.4	-178.7	0	0	0	0	108.9	F913 I949 G951 A955 F956 T1082	F913-V953 HydrophobicContact CD1-CG1 4.02Å; F913-V953 HydrophobicContact CE1-CB 4.09Å; F913-V953 HydrophobicContact CE1-CG1 3.29Å; F913-V953 HydrophobicContact CE1-CG2 4.12Å; F913-V953 HydrophobicContact CZ-CB 4.4Å; F913-V953 HydrophobicContact CZ-CG1 4.08Å; F913-V953 HydrophobicContact CZ-CG2 4.01Å; I949-V953 HydrophobicContact CG2-CB 4.32Å; I949-V953 HydrophobicContact CG2-CG1 4.24Å; I949-V953 HydrophobicContact CG2-CG2 4.24Å; G951-V953 PolarHBondContact O-N 3.16Å; V953-A955 VanDerWaalsContact C-N 3.34Å; V953-A955 VanDerWaalsContact CG1-O 3.3Å; V953-A955 WeakPolarHBondContact CG1-O 3.17Å; V953-A955 PolarHBondContact O-N 3.38Å; V953-F956 HydrophobicContact CG1-CB 4.2Å; V953-F956 HydrophobicContact CG1-CD1 4.13Å; V953-T1082 HydrophobicContact CB-CG2 3.41Å; V953-T1082 VanDerWaalsContact CB-CG2 3.41Å; V953-T1082 HydrophobicContact CG2-CG2 3.57Å
954	E	44	Very low	51.3	Low	173 Å²	173	86.6 Å²	86.6	81%	0.808	46%	0.46	S	S	*	.	S	Bend	trans	-67.9	-39.4	-177	-124	-161.2	161.7	0	0	112.7	K1085	E954-K1085 WeakPolarHBondContact O-CD 3.43Å; E954-K1085 PolarHBondContact O-NZ 2.95Å; E954-K1085 WeakPolarHBondContact OE1-CE 3.45Å; E954-K1085 IonicContact OE1-NZ 2.62Å; E954-K1085 PolarHBondContact OE1-NZ 2.87Å; E954-K1085 IonicContact OE2-NZ 2.7Å; E954-K1085 PolarHBondContact OE2-NZ 2.85Å
955	A	43.3	Very low	50.4	Low	56.25 Å²	56.25	90.3 Å²	90.3	47%	0.465	47%	0.474	S	S	.	.			trans	-155.4	151.6	174.5	0	0	0	0	0	111	T912 V953 K993 L996	T912-A955 HydrophobicContact CG2-CB 3.5Å; V953-A955 VanDerWaalsContact C-N 3.34Å; V953-A955 VanDerWaalsContact CG1-O 3.3Å; V953-A955 WeakPolarHBondContact CG1-O 3.17Å; V953-A955 PolarHBondContact O-N 3.38Å; A955-K993 CarbonylContact C-O 3.58Å; A955-K993 WeakPolarHBondContact CA-O 3.29Å; A955-K993 VanDerWaalsContact CB-O 3.25Å; A955-K993 WeakPolarHBondContact CB-O 3.26Å; A955-L996 HydrophobicContact CB-CB 4.22Å; A955-L996 HydrophobicContact CB-CD1 3.42Å; A955-L996 VanDerWaalsContact CB-CD1 3.42Å; A955-L996 HydrophobicContact CB-CG 3.63Å; A955-L996 WeakPolarHBondContact O-CD1 3.37Å
956	F	54.4	Low	49.5	Very low	67.75 Å²	67.75	85.5 Å²	85.5	30%	0.297	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	155.9	174.4	61	-102.6	0	0	0	112.1	F913 I949 V953 V958 I991 Q992 K993 L996 T1082	F913-F956 HydrophobicContact CD2-CB 4.31Å; F913-F956 HydrophobicContact CE2-CB 4.04Å; F913-F956 HydrophobicContact CZ-CB 4.43Å; F913-F956 WeakPolarHBondContact O-CA 3.42Å; I949-F956 HydrophobicContact CB-CB 4.33Å; I949-F956 HydrophobicContact CB-CD1 3.82Å; I949-F956 HydrophobicContact CB-CD2 4.19Å; I949-F956 HydrophobicContact CB-CE1 3.83Å; I949-F956 HydrophobicContact CB-CE2 4.22Å; I949-F956 HydrophobicContact CB-CG 4.05Å; I949-F956 HydrophobicContact CB-CZ 4.08Å; I949-F956 HydrophobicContact CD1-CB 3.91Å; I949-F956 HydrophobicContact CD1-CD1 4.34Å; I949-F956 HydrophobicContact CD1-CD2 3.83Å; I949-F956 HydrophobicContact CD1-CE2 4.35Å; I949-F956 HydrophobicContact CD1-CG 3.82Å; I949-F956 HydrophobicContact CG1-CD2 4.28Å; I949-F956 HydrophobicContact CG1-CE2 4.41Å; I949-F956 HydrophobicContact CG1-CG 4.34Å; I949-F956 HydrophobicContact CG2-CB 4.09Å; I949-F956 HydrophobicContact CG2-CD1 3.79Å; I949-F956 HydrophobicContact CG2-CE1 4.07Å; I949-F956 HydrophobicContact CG2-CG 4.16Å; I949-F956 VanDerWaalsContact O-CE1 3.3Å; I949-F956 WeakPolarHBondContact O-CE1 3.48Å; V953-F956 HydrophobicContact CG1-CB 4.2Å; V953-F956 HydrophobicContact CG1-CD1 4.13Å; F956-V958 HydrophobicContact CD2-CG2 3.83Å; F956-V958 HydrophobicContact CE2-CG2 4.04Å; F956-I991 HydrophobicContact CE2-CG2 4.11Å; F956-Q992 WeakPolarHBondContact O-CA 3.46Å; F956-K993 HydrophobicContact CD1-CB 3.71Å; F956-K993 HydrophobicContact CD1-CD 4.06Å; F956-K993 HydrophobicContact CD1-CG 4.49Å; F956-K993 HydrophobicContact CD2-CB 4.34Å; F956-K993 HydrophobicContact CE1-CB 3.35Å; F956-K993 HydrophobicContact CE1-CD 3.44Å; F956-K993 VanDerWaalsContact CE1-CD 3.44Å; F956-K993 HydrophobicContact CE1-CG 4.02Å; F956-K993 HydrophobicContact CE2-CB 4.01Å; F956-K993 HydrophobicContact CG-CB 4.22Å; F956-K993 HydrophobicContact CZ-CB 3.5Å; F956-K993 VanDerWaalsContact CZ-CB 3.5Å; F956-K993 HydrophobicContact CZ-CD 4.18Å; F956-K993 HydrophobicContact CZ-CG 4.46Å; F956-K993 PolarHBondContact N-O 3.13Å; F956-K993 PolarHBondContact O-N 3.35Å; F956-L996 VanDerWaalsContact CA-CD1 3.47Å; F956-T1082 WeakPolarHBondContact CE1-O 3.45Å
957	I	45.9	Very low	48.7	Very low	102.25 Å²	102.25	85.3 Å²	85.3	52%	0.524	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	124.3	168.1	-61.3	175.2	0	0	0	107.7	F913 L915 T990 I991 Q992 L996	F913-I957 PolarHBondContact O-N 2.61Å; L915-I957 CarbonylContact C-O 3.58Å; L915-I957 PolarHBondContact N-O 3.07Å; I957-T990 HydrophobicContact CG2-CG2 4.36Å; I957-I991 CarbonylContact C-O 3.55Å; I957-Q992 HydrophobicContact CG1-CB 4.28Å; I957-Q992 HydrophobicContact CG1-CG 3.8Å; I957-L996 HydrophobicContact CD1-CB 4.07Å; I957-L996 WeakPolarHBondContact CD1-O 3.46Å; I957-L996 HydrophobicContact CG1-CB 4.29Å
958	V	53.6	Low	47.5	Very low	46.5 Å²	46.5	88.3 Å²	88.3	28%	0.282	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	113.2	174.5	177.8	0	0	0	0	109.7	L915 I947 I949 F956 A960 T990 I991	L915-V958 VanDerWaalsContact O-CA 3.32Å; L915-V958 WeakPolarHBondContact O-CA 3.4Å; I947-V958 HydrophobicContact CB-CG1 4.12Å; I947-V958 HydrophobicContact CD1-CG1 3.9Å; I947-V958 HydrophobicContact CG1-CG1 4.35Å; I947-V958 HydrophobicContact CG2-CG1 4.04Å; I947-V958 HydrophobicContact CG2-CG2 4.26Å; I949-V958 HydrophobicContact CD1-CG2 3.55Å; I949-V958 HydrophobicContact CG1-CG2 4.08Å; F956-V958 HydrophobicContact CD2-CG2 3.83Å; F956-V958 HydrophobicContact CE2-CG2 4.04Å; V958-A960 HydrophobicContact CG1-CB 4.25Å; V958-A960 PolarHBondContact O-N 2.9Å; V958-A960 VanDerWaalsContact O-N 3.14Å; V958-T990 CarbonylContact O-C 3.55Å; V958-T990 VanDerWaalsContact O-CA 3.32Å; V958-T990 WeakPolarHBondContact O-CA 3.39Å; V958-I991 HydrophobicContact CB-CB 4.24Å; V958-I991 PolarHBondContact N-O 3.19Å; V958-I991 PolarHBondContact O-N 3.32Å
959	N	48.4	Very low	46.7	Very low	67.5 Å²	67.5	88.9 Å²	88.9	36%	0.361	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	110.5	167.4	-69.9	-37.6	0	0	0	109	L915 L916 A917 L961 T990 E998 F1008 N1086	L915-N959 PolarHBondContact O-N 2.67Å; L916-N959 CarbonylContact C-O 3.52Å; L916-N959 HydrophobicContact CB-CB 4.47Å; L916-N959 HydrophobicContact CD1-CB 3.83Å; A917-N959 PolarHBondContact N-O 3.36Å; N959-L961 HydrophobicContact CB-CD1 3.8Å; N959-L961 HydrophobicContact CB-CD2 4.38Å; N959-L961 HydrophobicContact CB-CG 4.27Å; N959-T990 WeakPolarHBondContact OD1-CG2 3.27Å; N959-T990 PolarHBondContact OD1-OG1 3.29Å; N959-E998 PolarHBondContact ND2-OE1 2.9Å; N959-F1008 HydrophobicContact CB-CD1 4.17Å; N959-F1008 HydrophobicContact CB-CE1 4.09Å; N959-F1008 WeakPolarHBondContact O-CE1 3.45Å; N959-N1086 PolarHBondContact ND2-ND2 3.26Å; N959-N1086 PolarHBondContact ND2-OD1 2.72Å
960	A	54.3	Low	45.8	Very low	35.25 Å²	35.25	91.7 Å²	91.7	29%	0.291	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	123.6	175.9	0	0	0	0	0	110.6	A917 I947 V958 R988 T989	A917-A960 WeakPolarHBondContact O-CA 3.33Å; I947-A960 HydrophobicContact CD1-CB 3.8Å; I947-A960 HydrophobicContact CG1-CB 4.23Å; V958-A960 HydrophobicContact CG1-CB 4.25Å; V958-A960 PolarHBondContact O-N 2.9Å; V958-A960 VanDerWaalsContact O-N 3.14Å; A960-R988 WeakPolarHBondContact O-CA 3.41Å; A960-R988 PolarHBondContact O-NH1 3.43Å; A960-T989 PolarHBondContact N-O 2.59Å; A960-T989 PolarHBondContact O-N 2.69Å
961	L	50.1	Low	45.2	Very low	63.5 Å²	63.5	97.3 Å²	97.3	33%	0.332	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	117.3	-177.1	-64	173.7	0	0	0	109.9	L916 A917 K918 V919 N959 F986 R988 I991 E1007 F1008 N1129 Y1130 S1131 N1283	L916-L961 HydrophobicContact CD1-CB 4.31Å; L916-L961 HydrophobicContact CD1-CD1 3.84Å; L916-L961 HydrophobicContact CD1-CG 3.79Å; A917-L961 PolarHBondContact O-N 3.44Å; K918-L961 WeakPolarHBondContact CA-O 3.29Å; V919-L961 PolarHBondContact N-O 3.01Å; N959-L961 HydrophobicContact CB-CD1 3.8Å; N959-L961 HydrophobicContact CB-CD2 4.38Å; N959-L961 HydrophobicContact CB-CG 4.27Å; L961-F986 HydrophobicContact CB-CB 4.32Å; L961-F986 HydrophobicContact CB-CG 4.4Å; L961-F986 HydrophobicContact CD2-CB 3.8Å; L961-F986 HydrophobicContact CD2-CG 4.34Å; L961-R988 HydrophobicContact CD2-CG 3.34Å; L961-I991 HydrophobicContact CD1-CD1 4.36Å; L961-E1007 WeakPolarHBondContact CD1-O 3.47Å; L961-F1008 HydrophobicContact CD1-CD1 3.82Å; L961-F1008 HydrophobicContact CD1-CD2 4.48Å; L961-F1008 HydrophobicContact CD1-CE1 3.64Å; L961-F1008 HydrophobicContact CD1-CE2 4.31Å; L961-F1008 HydrophobicContact CD1-CG 4.25Å; L961-F1008 HydrophobicContact CD1-CZ 3.9Å; L961-F1008 HydrophobicContact CG-CD1 4.39Å; L961-F1008 HydrophobicContact CG-CE1 3.94Å; L961-F1008 HydrophobicContact CG-CZ 4.41Å; L961-N1129 HydrophobicContact CB-CB 4.35Å; L961-N1129 WeakPolarHBondContact CB-ND2 2.97Å; L961-N1129 WeakPolarHBondContact CB-OD1 3.45Å; L961-N1129 HydrophobicContact CD1-CB 3.25Å; L961-N1129 VanDerWaalsContact CD1-ND2 3.33Å; L961-N1129 WeakPolarHBondContact CD1-ND2 3.37Å; L961-N1129 HydrophobicContact CG-CB 4.29Å; L961-Y1130 WeakPolarHBondContact CD2-O 3.18Å; L961-S1131 VanDerWaalsContact CD2-N 3.32Å; L961-N1283 WeakPolarHBondContact CB-ND2 3.23Å; L961-N1283 WeakPolarHBondContact CD1-ND2 3.15Å
962	H	53.3	Low	44	Very low	79 Å²	79	102.6 Å²	102.6	37%	0.366	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	126.4	176	-59.1	82.7	0	0	0	109.9	R943 A944 R964 F986 V987	R943-H962 WeakPolarHBondContact CA-NE2 3.45Å; A944-H962 PolarHBondContact N-NE2 2.8Å; A944-H962 PolarHBondContact O-CE1 3.11Å; A944-H962 PolarHBondContact O-NE2 2.92Å; A944-H962 VanDerWaalsContact O-NE2 3.16Å; H962-R964 PolarHBondContact O-N 3.14Å; H962-F986 CarbonylContact O-C 3.18Å; H962-F986 VanDerWaalsContact O-CA 3.22Å; H962-F986 WeakPolarHBondContact O-CA 3.42Å; H962-V987 PolarHBondContact N-O 2.94Å; H962-V987 PolarHBondContact O-N 2.74Å
963	E	49.6	Very low	43.1	Very low	96.25 Å²	96.25	99.5 Å²	99.5	45%	0.45	54%	0.543	S	S	.	.	P	Polyproline II helix	trans	-65.6	129.6	167.3	-74.5	-179.2	139.2	0	0	109.8	K918 V919 K920 I965 F986 Y1195 I1197 K1207	K918-E963 WeakPolarHBondContact CD-OE2 3.44Å; K918-E963 VanDerWaalsContact CE-CD 3.47Å; K918-E963 WeakPolarHBondContact CE-OE2 3.25Å; K918-E963 IonicContact NZ-OE1 3.49Å; K918-E963 PolarHBondContact NZ-OE1 2.89Å; K918-E963 IonicContact NZ-OE2 2.69Å; K918-E963 PolarHBondContact NZ-OE2 3.05Å; V919-E963 PolarHBondContact O-N 3.05Å; K920-E963 HydrophobicContact CB-CB 3.9Å; K920-E963 HydrophobicContact CB-CG 4.48Å; K920-E963 WeakPolarHBondContact CB-OE2 3.32Å; K920-E963 HydrophobicContact CD-CB 4.4Å; K920-E963 VanDerWaalsContact CD-OE2 3.32Å; K920-E963 WeakPolarHBondContact CD-OE2 3.42Å; K920-E963 HydrophobicContact CG-CB 3.78Å; K920-E963 HydrophobicContact CG-CG 4.49Å; K920-E963 WeakPolarHBondContact CG-OE2 3.25Å; E963-I965 PolarHBondContact O-N 3.03Å; E963-I965 VanDerWaalsContact O-N 3.16Å; E963-F986 HydrophobicContact CG-CD1 4.31Å; E963-F986 HydrophobicContact CG-CE1 3.93Å; E963-Y1195 HydrophobicContact CG-CE1 4Å; E963-Y1195 WeakPolarHBondContact CG-OH 3.26Å; E963-Y1195 WeakPolarHBondContact OE2-CE1 3.42Å; E963-I1197 WeakPolarHBondContact OE1-CD1 3.12Å; E963-K1207 WeakPolarHBondContact OE1-CE 3.49Å; E963-K1207 IonicContact OE1-NZ 3.53Å; E963-K1207 PolarHBondContact OE1-NZ 3.41Å; E963-K1207 IonicContact OE2-NZ 2.84Å; E963-K1207 PolarHBondContact OE2-NZ 3.35Å
964	R	41.5	Very low	42.3	Very low	178.75 Å²	178.75	102.8 Å²	102.8	68%	0.675	57%	0.568	S	S	*	*			trans	-71.7	118.8	170	-95	-175.9	-178.2	178.9	1.4	108.2	H962 P966 P985 V987 Y1136	H962-R964 PolarHBondContact O-N 3.14Å; R964-P966 HydrophobicContact CB-CG 4.44Å; R964-P966 VanDerWaalsContact O-CD 3.25Å; R964-P966 WeakPolarHBondContact O-CD 3.36Å; R964-P985 WeakPolarHBondContact CA-O 3.1Å; R964-P985 WeakPolarHBondContact CB-O 3.36Å; R964-P985 PolarHBondContact N-O 2.72Å; R964-V987 HydrophobicContact CB-CG2 4.44Å; R964-V987 HydrophobicContact CG-CG2 4.34Å; R964-Y1136 PolarHBondContact NH2-O 3.29Å; R964-Y1136 VanDerWaalsContact NH2-O 3.13Å
965	I	40.4	Very low	41.9	Very low	109.5 Å²	109.5	100.4 Å²	100.4	56%	0.562	56%	0.564	S	S	*	*			trans	-79.1	110.6	160.7	-54.3	173.3	0	0	0	106.2	D921 E963	D921-I965 WeakPolarHBondContact OD1-CG1 3.41Å; D921-I965 WeakPolarHBondContact OD1-CG2 3.45Å; E963-I965 PolarHBondContact O-N 3.03Å; E963-I965 VanDerWaalsContact O-N 3.16Å
966	P	35.8	Very low	41.6	Very low	78.25 Å²	78.25	103 Å²	103	51%	0.508	57%	0.57	S	S	.	*	P	Polyproline II helix	trans	-70.6	146.4	171.5	5.7	1.4	0	0	0	110	R964 T968 L1222 N1225	R964-P966 HydrophobicContact CB-CG 4.44Å; R964-P966 VanDerWaalsContact O-CD 3.25Å; R964-P966 WeakPolarHBondContact O-CD 3.36Å; P966-T968 PolarHBondContact O-N 2.89Å; P966-L1222 HydrophobicContact CG-CD1 4.28Å; P966-N1225 HydrophobicContact CB-CB 3.58Å; P966-N1225 WeakPolarHBondContact CD-O 3.26Å; P966-N1225 HydrophobicContact CG-CB 3.57Å; P966-N1225 VanDerWaalsContact CG-O 3.23Å; P966-N1225 WeakPolarHBondContact CG-O 3.46Å
967	P	33.5	Very low	40.7	Very low	105 Å²	105	105.3 Å²	105.3	68%	0.682	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-69.4	134.7	176.5	28.2	-32.7	0	0	0	110.9	P969 E1138 N1225	P967-P969 WeakPolarHBondContact O-CD 3.45Å; P967-P969 VanDerWaalsContact O-N 3.16Å; P967-E1138 WeakPolarHBondContact CG-OE1 3.32Å; P967-N1225 WeakPolarHBondContact O-CB 3.35Å; P967-N1225 PolarHBondContact O-ND2 2.86Å
968	T	34	Very low	40.6	Very low	117 Å²	117	109.2 Å²	109.2	72%	0.718	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-59.7	127.7	177.3	-41.5	0	0	0	0	110.6	P966 S970	P966-T968 PolarHBondContact O-N 2.89Å; T968-S970 PolarHBondContact O-N 2.91Å
969	P	33.2	Very low	39.8	Very low	100.25 Å²	100.25	115.9 Å²	115.9	65%	0.651	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-77.1	117	175.1	8.3	-0.8	0	0	0	110.3	P967 K993 N1224	P967-P969 WeakPolarHBondContact O-CD 3.45Å; P967-P969 VanDerWaalsContact O-N 3.16Å; P969-K993 CarbonylContact C-O 3.44Å; P969-K993 VanDerWaalsContact CA-O 3.23Å; P969-K993 WeakPolarHBondContact CA-O 2.94Å; P969-K993 HydrophobicContact CB-CB 4.18Å; P969-N1224 WeakPolarHBondContact CD-O 3.34Å; P969-N1224 HydrophobicContact CG-CB 4.04Å
970	S	35.3	Very low	39.2	Very low	96.25 Å²	96.25	122.5 Å²	122.5	67%	0.673	66%	0.656	S	S	*	*			trans	-114.1	108.8	170.1	-58.6	0	0	0	0	109.9	T968 K993 G994	T968-S970 PolarHBondContact O-N 2.91Å; S970-K993 PolarHBondContact N-O 3.49Å; S970-K993 CarbonylContact O-C 3.54Å; S970-K993 VanDerWaalsContact O-C 3.22Å; S970-K993 WeakPolarHBondContact O-CB 3.26Å; S970-G994 PolarHBondContact O-N 3.33Å
971	E	35.5	Very low	38.3	Very low	172.25 Å²	172.25	132.3 Å²	132.3	81%	0.805	69%	0.686	S	S	*	*			trans	93.4	119.4	161.5	-73.5	174.5	175	0	0	116.6	V973	E971-V973 PolarHBondContact O-N 2.78Å
972	L	32.4	Very low	37.6	Very low	175.25 Å²	175.25	141.2 Å²	141.2	92%	0.918	72%	0.715	S	S	*	*			trans	-69.6	107.3	172.2	-71.1	156.9	0	0	0	113.3	S974	L972-S974 PolarHBondContact O-N 2.87Å
973	V	35.2	Very low	36.9	Very low	132 Å²	132	143.2 Å²	143.2	80%	0.8	73%	0.733	S	S	*	*			trans	-129.3	138.2	150	-176.5	0	0	0	0	108.4	E971 V975	E971-V973 PolarHBondContact O-N 2.78Å; V973-V975 HydrophobicContact CG1-CG2 4.15Å; V973-V975 PolarHBondContact O-N 3.08Å
974	S	34.3	Very low	36.1	Very low	107.5 Å²	107.5	144.2 Å²	144.2	75%	0.752	74%	0.741	S	S	*	*			trans	-80.7	135.2	-170.7	72.2	0	0	0	0	114.3	L972	L972-S974 PolarHBondContact O-N 2.87Å
975	V	35.1	Very low	35.8	Very low	121.5 Å²	121.5	139.8 Å²	139.8	74%	0.736	74%	0.735	S	S	*	*			trans	115.6	118.4	137.7	172.6	0	0	0	0	114.2	V973 P977	V973-V975 HydrophobicContact CG1-CG2 4.15Å; V973-V975 PolarHBondContact O-N 3.08Å; V975-P977 HydrophobicContact CG1-CG 4.1Å
976	D	37.9	Very low	35.6	Very low	111.75 Å²	111.75	140 Å²	140	60%	0.598	73%	0.733	S	S	*	*			trans	-105.4	116.5	148.9	-176.5	-1.3	0	0	0	112.3	K978 K979	D976-K978 VanDerWaalsContact C-N 3.3Å; D976-K978 PolarHBondContact O-N 2.85Å; D976-K978 WeakPolarHBondContact OD1-CB 3.43Å; D976-K978 PolarHBondContact OD1-N 3.03Å; D976-K979 PolarHBondContact O-N 2.88Å; D976-K979 IonicContact OD2-NZ 2.76Å
977	P	35.6	Very low	35.7	Very low	115.75 Å²	115.75	140.4 Å²	140.4	75%	0.752	73%	0.733	S	S	*	*			trans	-83.5	15.2	-173.9	32	-32.9	0	0	0	115.2	V975 K979	V975-P977 HydrophobicContact CG1-CG 4.1Å; P977-K979 PolarHBondContact O-N 2.79Å
978	K	43.3	Very low	35.8	Very low	184.25 Å²	184.25	143.4 Å²	143.4	80%	0.801	73%	0.731	S	S	*	*	G	3₁₀ helix	trans	-98.8	6.9	-175	-75.1	-175.3	177.4	175.7	0	117.5	D976	D976-K978 VanDerWaalsContact C-N 3.3Å; D976-K978 PolarHBondContact O-N 2.85Å; D976-K978 WeakPolarHBondContact OD1-CB 3.43Å; D976-K978 PolarHBondContact OD1-N 3.03Å
979	K	37.9	Very low	36	Very low	187.5 Å²	187.5	140.8 Å²	140.8	82%	0.815	72%	0.715	S	S	*	*			trans	-130.5	81.1	176.1	-77.7	167.8	-177.4	168.9	0	114.1	D976 P977 R981	D976-K979 PolarHBondContact O-N 2.88Å; D976-K979 IonicContact OD2-NZ 2.76Å; P977-K979 PolarHBondContact O-N 2.79Å; K979-R981 VanDerWaalsContact C-N 3.34Å; K979-R981 PolarHBondContact O-N 3.02Å; K979-R981 VanDerWaalsContact O-N 3.08Å
980	K	35.8	Very low	36.3	Very low	206 Å²	206	140.2 Å²	140.2	90%	0.896	71%	0.71	S	S	*	*			trans	-86.4	109.5	165.2	-77.7	171.4	-177.3	174.2	0	111.8	R982	K980-R982 PolarHBondContact O-N 3.33Å
981	R	35.6	Very low	36.5	Very low	241.25 Å²	241.25	139.3 Å²	139.3	91%	0.91	70%	0.697	S	S	*	*			trans	-90.7	141.7	158.2	-84.4	179.2	177.5	-178.1	-0.6	109.7	K979 T983	K979-R981 VanDerWaalsContact C-N 3.34Å; K979-R981 PolarHBondContact O-N 3.02Å; K979-R981 VanDerWaalsContact O-N 3.08Å; R981-T983 PolarHBondContact O-N 3.04Å
982	R	35	Very low	36.8	Very low	249 Å²	249	136.7 Å²	136.7	94%	0.94	68%	0.684	S	S	*	*			trans	-75.3	128.5	-177.6	-75.9	175.3	165.5	164.8	-5.3	111.4	K980	K980-R982 PolarHBondContact O-N 3.33Å
983	T	37.4	Very low	37.1	Very low	122 Å²	122	133.9 Å²	133.9	75%	0.748	67%	0.665	S	S	*	*			trans	-110.5	138.7	169.8	-42	0	0	0	0	109.6	R981 P985	R981-T983 PolarHBondContact O-N 3.04Å; T983-P985 VanDerWaalsContact O-CD 3.27Å; T983-P985 WeakPolarHBondContact O-CD 3.36Å
984	D	33.7	Very low	37.5	Very low	117.75 Å²	117.75	129.1 Å²	129.1	63%	0.63	64%	0.642	S	S	*	*			trans	-74.6	125	179.7	-148	-32.5	0	0	0	110.5	F986 R988	D984-F986 VanDerWaalsContact C-N 3.31Å; D984-F986 PolarHBondContact O-N 3.26Å; D984-F986 PolarHBondContact OD1-N 2.82Å; D984-R988 IonicContact OD2-NE 3.45Å; D984-R988 IonicContact OD2-NH2 2.75Å
985	P	35.2	Very low	37.7	Very low	84.75 Å²	84.75	130.6 Å²	130.6	55%	0.55	64%	0.641	S	S	*	*			trans	-86.3	41.4	-167.6	34.9	-36.2	0	0	0	114.9	R964 T983	R964-P985 WeakPolarHBondContact CA-O 3.1Å; R964-P985 WeakPolarHBondContact CB-O 3.36Å; R964-P985 PolarHBondContact N-O 2.72Å; T983-P985 VanDerWaalsContact O-CD 3.27Å; T983-P985 WeakPolarHBondContact O-CD 3.36Å
986	F	36.4	Very low	38.1	Very low	115 Å²	115	128.1 Å²	128.1	50%	0.504	62%	0.623	S	S	.	*			trans	-131.2	100.7	176.7	-65.3	-69.7	0	0	0	114.5	L961 H962 E963 D984 K1022 K1031 E1135	L961-F986 HydrophobicContact CB-CB 4.32Å; L961-F986 HydrophobicContact CB-CG 4.4Å; L961-F986 HydrophobicContact CD2-CB 3.8Å; L961-F986 HydrophobicContact CD2-CG 4.34Å; H962-F986 CarbonylContact O-C 3.18Å; H962-F986 VanDerWaalsContact O-CA 3.22Å; H962-F986 WeakPolarHBondContact O-CA 3.42Å; E963-F986 HydrophobicContact CG-CD1 4.31Å; E963-F986 HydrophobicContact CG-CE1 3.93Å; D984-F986 VanDerWaalsContact C-N 3.31Å; D984-F986 PolarHBondContact O-N 3.26Å; D984-F986 PolarHBondContact OD1-N 2.82Å; F986-K1022 HydrophobicContact CD1-CD 3.98Å; F986-K1022 HydrophobicContact CE1-CD 3.42Å; F986-K1022 VanDerWaalsContact CE1-CD 3.42Å; F986-K1022 VanDerWaalsContact CE2-NZ 3.3Å; F986-K1022 HydrophobicContact CZ-CD 3.87Å; F986-K1031 VanDerWaalsContact CZ-NZ 3.31Å; F986-E1135 HydrophobicContact CB-CG 4.01Å; F986-E1135 HydrophobicContact CD1-CG 4.47Å; F986-E1135 HydrophobicContact CG-CG 4.4Å
987	V	36.4	Very low	38.1	Very low	86.5 Å²	86.5	128.5 Å²	128.5	52%	0.524	63%	0.63	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.1	124.1	168.3	-178.1	0	0	0	0	109.4	H962 R964 T989 Y1136 E1138	H962-V987 PolarHBondContact N-O 2.94Å; H962-V987 PolarHBondContact O-N 2.74Å; R964-V987 HydrophobicContact CB-CG2 4.44Å; R964-V987 HydrophobicContact CG-CG2 4.34Å; V987-T989 HydrophobicContact CG1-CG2 4.03Å; V987-T989 WeakPolarHBondContact CG1-OG1 3.2Å; V987-T989 PolarHBondContact O-N 3.04Å; V987-Y1136 PolarHBondContact N-O 2.84Å; V987-Y1136 PolarHBondContact O-N 3.48Å; V987-E1138 HydrophobicContact CG2-CG 4.09Å
988	R	36	Very low	38.1	Very low	168.5 Å²	168.5	129.7 Å²	129.7	64%	0.636	63%	0.625	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-97	113.5	172	-116.1	176.2	-170.5	-167.8	-0.2	112.5	A960 L961 D984	A960-R988 WeakPolarHBondContact O-CA 3.41Å; A960-R988 PolarHBondContact O-NH1 3.43Å; L961-R988 HydrophobicContact CD2-CG 3.34Å; D984-R988 IonicContact OD2-NE 3.45Å; D984-R988 IonicContact OD2-NH2 2.75Å
989	T	39.7	Very low	37.9	Very low	62 Å²	62	129 Å²	129	38%	0.38	62%	0.622	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.3	131.2	168.3	-40.3	0	0	0	0	113.3	A960 V987 I991 T1134	A960-T989 PolarHBondContact N-O 2.59Å; A960-T989 PolarHBondContact O-N 2.69Å; V987-T989 HydrophobicContact CG1-CG2 4.03Å; V987-T989 WeakPolarHBondContact CG1-OG1 3.2Å; V987-T989 PolarHBondContact O-N 3.04Å; T989-I991 HydrophobicContact CG2-CD1 3.81Å; T989-I991 HydrophobicContact CG2-CG1 4Å; T989-T1134 PolarHBondContact N-O 2.88Å; T989-T1134 PolarHBondContact O-N 2.94Å; T989-T1134 PolarHBondContact O-OG1 2.87Å; T989-T1134 VanDerWaalsContact O-OG1 3.09Å
990	T	38.5	Very low	37.7	Very low	87 Å²	87	128.8 Å²	128.8	53%	0.534	62%	0.624	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-2.9	115.1	166.2	-50.7	0	0	0	0	112.6	I957 V958 N959 Q992 D1133	I957-T990 HydrophobicContact CG2-CG2 4.36Å; V958-T990 CarbonylContact O-C 3.55Å; V958-T990 VanDerWaalsContact O-CA 3.32Å; V958-T990 WeakPolarHBondContact O-CA 3.39Å; N959-T990 WeakPolarHBondContact OD1-CG2 3.27Å; N959-T990 PolarHBondContact OD1-OG1 3.29Å; T990-Q992 HydrophobicContact CG2-CB 4Å; T990-Q992 VanDerWaalsContact CG2-CD 3.42Å; T990-Q992 HydrophobicContact CG2-CG 3.48Å; T990-Q992 VanDerWaalsContact CG2-CG 3.48Å; T990-D1133 VanDerWaalsContact CA-OD1 3.28Å; T990-D1133 WeakPolarHBondContact CA-OD1 3.32Å; T990-D1133 VanDerWaalsContact CB-OD1 3.22Å; T990-D1133 WeakPolarHBondContact CB-OD1 3.5Å; T990-D1133 WeakPolarHBondContact CG2-OD1 3.14Å; T990-D1133 PolarHBondContact OG1-OD1 3.17Å
991	I	39.4	Very low	37.6	Very low	78.75 Å²	78.75	122.3 Å²	122.3	40%	0.404	62%	0.616	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-130.2	117.6	150.1	-58.1	174.6	0	0	0	109.4	I947 F956 I957 V958 L961 T989 V1132	I947-I991 HydrophobicContact CB-CD1 3.99Å; I947-I991 WeakPolarHBondContact O-CD1 3.46Å; F956-I991 HydrophobicContact CE2-CG2 4.11Å; I957-I991 CarbonylContact C-O 3.55Å; V958-I991 HydrophobicContact CB-CB 4.24Å; V958-I991 PolarHBondContact N-O 3.19Å; V958-I991 PolarHBondContact O-N 3.32Å; L961-I991 HydrophobicContact CD1-CD1 4.36Å; T989-I991 HydrophobicContact CG2-CD1 3.81Å; T989-I991 HydrophobicContact CG2-CG1 4Å; I991-V1132 PolarHBondContact N-O 3.03Å
992	Q	41.2	Very low	37.5	Very low	116.5 Å²	116.5	115.5 Å²	115.5	54%	0.544	61%	0.611	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-38.4	144.7	167.3	-94.2	171.3	-6.7	0	0	115.9	F956 I957 T990 G994 F1008 S1131	F956-Q992 WeakPolarHBondContact O-CA 3.46Å; I957-Q992 HydrophobicContact CG1-CB 4.28Å; I957-Q992 HydrophobicContact CG1-CG 3.8Å; T990-Q992 HydrophobicContact CG2-CB 4Å; T990-Q992 VanDerWaalsContact CG2-CD 3.42Å; T990-Q992 HydrophobicContact CG2-CG 3.48Å; T990-Q992 VanDerWaalsContact CG2-CG 3.48Å; Q992-G994 PolarHBondContact NE2-O 3.21Å; Q992-G994 VanDerWaalsContact NE2-O 3.14Å; Q992-F1008 HydrophobicContact CB-CD1 4.36Å; Q992-F1008 HydrophobicContact CB-CE1 3.59Å; Q992-F1008 HydrophobicContact CB-CZ 4.24Å; Q992-S1131 VanDerWaalsContact O-CA 3.3Å; Q992-S1131 WeakPolarHBondContact O-CA 3.24Å; Q992-S1131 WeakPolarHBondContact O-CB 3.34Å
993	K	40.6	Very low	37.4	Very low	117.25 Å²	117.25	110.8 Å²	110.8	51%	0.51	61%	0.605	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-139	134.9	160.8	-128.7	-169.8	178.7	-159.7	0	108.2	A955 F956 P969 S970 N1129 Y1130	A955-K993 CarbonylContact C-O 3.58Å; A955-K993 WeakPolarHBondContact CA-O 3.29Å; A955-K993 VanDerWaalsContact CB-O 3.25Å; A955-K993 WeakPolarHBondContact CB-O 3.26Å; F956-K993 HydrophobicContact CD1-CB 3.71Å; F956-K993 HydrophobicContact CD1-CD 4.06Å; F956-K993 HydrophobicContact CD1-CG 4.49Å; F956-K993 HydrophobicContact CD2-CB 4.34Å; F956-K993 HydrophobicContact CE1-CB 3.35Å; F956-K993 HydrophobicContact CE1-CD 3.44Å; F956-K993 VanDerWaalsContact CE1-CD 3.44Å; F956-K993 HydrophobicContact CE1-CG 4.02Å; F956-K993 HydrophobicContact CE2-CB 4.01Å; F956-K993 HydrophobicContact CG-CB 4.22Å; F956-K993 HydrophobicContact CZ-CB 3.5Å; F956-K993 VanDerWaalsContact CZ-CB 3.5Å; F956-K993 HydrophobicContact CZ-CD 4.18Å; F956-K993 HydrophobicContact CZ-CG 4.46Å; F956-K993 PolarHBondContact N-O 3.13Å; F956-K993 PolarHBondContact O-N 3.35Å; P969-K993 CarbonylContact C-O 3.44Å; P969-K993 VanDerWaalsContact CA-O 3.23Å; P969-K993 WeakPolarHBondContact CA-O 2.94Å; P969-K993 HydrophobicContact CB-CB 4.18Å; S970-K993 PolarHBondContact N-O 3.49Å; S970-K993 CarbonylContact O-C 3.54Å; S970-K993 VanDerWaalsContact O-C 3.22Å; S970-K993 WeakPolarHBondContact O-CB 3.26Å; K993-N1129 WeakPolarHBondContact CE-OD1 3.45Å; K993-N1129 PolarHBondContact NZ-OD1 3.23Å; K993-Y1130 CarbonylContact C-O 3.44Å; K993-Y1130 VanDerWaalsContact CA-O 3.29Å; K993-Y1130 WeakPolarHBondContact CA-O 3.43Å; K993-Y1130 VanDerWaalsContact CG-O 3.3Å; K993-Y1130 WeakPolarHBondContact CG-O 3.48Å
994	G	42.4	Very low	37.3	Very low	31.25 Å²	31.25	114.2 Å²	114.2	32%	0.322	60%	0.604	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.5	165.2	-175.1	0	0	0	0	0	110.5	S970 Q992 N1129 Y1130	S970-G994 PolarHBondContact O-N 3.33Å; Q992-G994 PolarHBondContact NE2-O 3.21Å; Q992-G994 VanDerWaalsContact NE2-O 3.14Å; G994-N1129 WeakPolarHBondContact O-CA 3.36Å; G994-N1129 WeakPolarHBondContact O-CB 3.43Å; G994-Y1130 PolarHBondContact N-O 3.02Å; G994-Y1130 PolarHBondContact O-N 2.76Å; G994-Y1130 VanDerWaalsContact O-N 3.13Å
995	L	38.9	Very low	37.4	Very low	138.25 Å²	138.25	112.2 Å²	112.2	72%	0.724	60%	0.597	S	S	*	*			trans	-105.9	113.7	173.4	-168.9	77.8	0	0	0	106.7	T997 D1128	L995-T997 VanDerWaalsContact C-N 3.29Å; L995-T997 HydrophobicContact CD2-CG2 3.83Å; L995-T997 HydrophobicContact CG-CG2 4.08Å; L995-T997 PolarHBondContact O-N 3.12Å; L995-D1128 WeakPolarHBondContact CD1-O 3.23Å
996	L	42.9	Very low	37.3	Very low	69.25 Å²	69.25	113 Å²	113	36%	0.363	60%	0.602	S	S	.	*			trans	-90.2	97.7	162.6	-83.1	165.3	0	0	0	110.6	T912 A955 F956 I957 E998 P1006 V1123 V1127 Y1130	T912-L996 HydrophobicContact CG2-CD2 4.22Å; A955-L996 HydrophobicContact CB-CB 4.22Å; A955-L996 HydrophobicContact CB-CD1 3.42Å; A955-L996 VanDerWaalsContact CB-CD1 3.42Å; A955-L996 HydrophobicContact CB-CG 3.63Å; A955-L996 WeakPolarHBondContact O-CD1 3.37Å; F956-L996 VanDerWaalsContact CA-CD1 3.47Å; I957-L996 HydrophobicContact CD1-CB 4.07Å; I957-L996 WeakPolarHBondContact CD1-O 3.46Å; I957-L996 HydrophobicContact CG1-CB 4.29Å; L996-E998 PolarHBondContact O-N 2.96Å; L996-P1006 HydrophobicContact CD2-CG 3.61Å; L996-P1006 HydrophobicContact CG-CG 4.33Å; L996-V1123 HydrophobicContact CD1-CG1 4.42Å; L996-V1123 VanDerWaalsContact CD1-O 3.28Å; L996-V1123 WeakPolarHBondContact CD1-O 3.31Å; L996-V1127 HydrophobicContact CD1-CB 3.74Å; L996-V1127 HydrophobicContact CD1-CG1 3.86Å; L996-V1127 HydrophobicContact CD1-CG2 4.49Å; L996-Y1130 HydrophobicContact CD1-CD1 3.89Å; L996-Y1130 HydrophobicContact CD1-CE1 4.14Å; L996-Y1130 HydrophobicContact CD2-CE1 4.41Å; L996-Y1130 HydrophobicContact CG-CD1 4.38Å; L996-Y1130 HydrophobicContact CG-CE1 4.1Å
997	T	38.2	Very low	37.3	Very low	119.75 Å²	119.75	113.5 Å²	113.5	74%	0.735	61%	0.606	S	S	*	*			trans	-94.1	114.9	159.8	44.1	0	0	0	0	108.7	L995 K999	L995-T997 VanDerWaalsContact C-N 3.29Å; L995-T997 HydrophobicContact CD2-CG2 3.83Å; L995-T997 HydrophobicContact CG-CG2 4.08Å; L995-T997 PolarHBondContact O-N 3.12Å; T997-K999 PolarHBondContact O-N 2.86Å; T997-K999 VanDerWaalsContact O-N 3.1Å
998	E	36.3	Very low	37.2	Very low	141 Å²	141	114.1 Å²	114.1	66%	0.659	60%	0.602	S	S	*	*			trans	-47.1	103.7	157.3	-91.9	168.8	-179.6	0	0	111	N959 L996 E1000 R1004 K1031	N959-E998 PolarHBondContact ND2-OE1 2.9Å; L996-E998 PolarHBondContact O-N 2.96Å; E998-E1000 PolarHBondContact O-N 2.73Å; E998-R1004 IonicContact OE1-CZ 3.76Å; E998-R1004 IonicContact OE1-NE 2.67Å; E998-R1004 IonicContact OE1-NH2 3.11Å; E998-R1004 PolarHBondContact OE1-NH2 2.93Å; E998-R1004 IonicContact OE2-CZ 3.56Å; E998-R1004 IonicContact OE2-NH2 2.72Å; E998-R1004 PolarHBondContact OE2-NH2 2.81Å; E998-K1031 IonicContact OE1-NZ 2.67Å; E998-K1031 PolarHBondContact OE1-NZ 3.15Å; E998-K1031 IonicContact OE2-NZ 2.7Å; E998-K1031 PolarHBondContact OE2-NZ 3.49Å
999	K	37.5	Very low	37.2	Very low	169 Å²	169	109.8 Å²	109.8	74%	0.735	60%	0.598	S	S	*	*			trans	-135.1	117.6	148.8	-80.5	-168.1	175.9	-169.5	0	110	E910 T997 G1001	E910-K999 IonicContact OE2-NZ 3.22Å; E910-K999 PolarHBondContact OE2-NZ 3.2Å; T997-K999 PolarHBondContact O-N 2.86Å; T997-K999 VanDerWaalsContact O-N 3.1Å; K999-G1001 VanDerWaalsContact C-N 3.26Å; K999-G1001 PolarHBondContact O-N 3.38Å
1000	E	35.2	Very low	36.9	Very low	183.25 Å²	183.25	111.5 Å²	111.5	86%	0.856	60%	0.604	S	S	*	*			trans	-19	117.3	152.8	-63.4	176	139.8	0	0	114.2	E998	E998-E1000 PolarHBondContact O-N 2.73Å
1001	G	33.5	Very low	36.7	Very low	70 Å²	70	111.8 Å²	111.8	72%	0.722	60%	0.602	S	S	*	*			trans	161.9	120.3	174.4	0	0	0	0	0	112.6	K999 D1003 R1004	K999-G1001 VanDerWaalsContact C-N 3.26Å; K999-G1001 PolarHBondContact O-N 3.38Å; G1001-D1003 PolarHBondContact O-N 2.81Å; G1001-R1004 PolarHBondContact O-N 2.88Å; G1001-R1004 VanDerWaalsContact O-N 3.14Å
1002	A	32.9	Very low	36.2	Very low	97.8 Å²	97.8	112.6 Å²	112.6	81%	0.808	61%	0.612	S	S	*	*			trans	-61.2	117.9	177.3	0	0	0	0	0	114.3	R1004	A1002-R1004 VanDerWaalsContact C-N 3.32Å; A1002-R1004 PolarHBondContact O-N 3.14Å
1003	D	33	Very low	35.8	Very low	151.4 Å²	151.4	117.8 Å²	117.8	81%	0.81	63%	0.627	S	S	*	*	S	Bend	trans	76.8	89.1	155.5	-73	-25.1	0	0	0	118.2	G1001 P1005	G1001-D1003 PolarHBondContact O-N 2.81Å; D1003-P1005 WeakPolarHBondContact O-CD 3.45Å
1004	R	35.5	Very low	35.3	Very low	192.8 Å²	192.8	117.7 Å²	117.7	73%	0.728	64%	0.636	S	S	*	*			trans	52.8	119.1	169	-128.3	-178.6	-171	174.2	4.4	115.7	E998 G1001 A1002 E1007 F1008	E998-R1004 IonicContact OE1-CZ 3.76Å; E998-R1004 IonicContact OE1-NE 2.67Å; E998-R1004 IonicContact OE1-NH2 3.11Å; E998-R1004 PolarHBondContact OE1-NH2 2.93Å; E998-R1004 IonicContact OE2-CZ 3.56Å; E998-R1004 IonicContact OE2-NH2 2.72Å; E998-R1004 PolarHBondContact OE2-NH2 2.81Å; G1001-R1004 PolarHBondContact O-N 2.88Å; G1001-R1004 VanDerWaalsContact O-N 3.14Å; A1002-R1004 VanDerWaalsContact C-N 3.32Å; A1002-R1004 PolarHBondContact O-N 3.14Å; R1004-E1007 IonicContact CZ-OE2 3.64Å; R1004-E1007 IonicContact NH1-OE2 2.79Å; R1004-E1007 PolarHBondContact NH1-OE2 2.69Å; R1004-F1008 HydrophobicContact CG-CB 4.07Å; R1004-F1008 VanDerWaalsContact CZ-O 3.25Å; R1004-F1008 PolarHBondContact NE-O 2.83Å
1005	P	35	Very low	34.8	Very low	76 Å²	76	125.7 Å²	125.7	49%	0.494	67%	0.665	S	S	.	*			trans	-76	157.4	-179.6	24.8	-24.4	0	0	0	111.8	L916 D1003 E1007 F1008 S1009 E1122	L916-P1005 HydrophobicContact CD1-CG 3.94Å; L916-P1005 HydrophobicContact CD2-CB 4.45Å; L916-P1005 HydrophobicContact CD2-CG 3.38Å; L916-P1005 HydrophobicContact CG-CG 4.25Å; D1003-P1005 WeakPolarHBondContact O-CD 3.45Å; P1005-E1007 PolarHBondContact O-N 3.12Å; P1005-F1008 HydrophobicContact CB-CD2 4.07Å; P1005-F1008 HydrophobicContact CG-CD2 3.98Å; P1005-F1008 HydrophobicContact CG-CE2 4.47Å; P1005-F1008 PolarHBondContact O-N 3.36Å; P1005-S1009 PolarHBondContact O-N 2.86Å; P1005-E1122 HydrophobicContact CG-CG 4.46Å
1006	P	34.5	Very low	34.5	Very low	101.8 Å²	101.8	121.7 Å²	121.7	66%	0.661	66%	0.657	S	S	*	*			trans	-74	110.7	173.2	26.1	-31.5	0	0	0	112.5	L996 F1008 S1009 Y1130	L996-P1006 HydrophobicContact CD2-CG 3.61Å; L996-P1006 HydrophobicContact CG-CG 4.33Å; P1006-F1008 HydrophobicContact CB-CD2 3.99Å; P1006-F1008 HydrophobicContact CB-CE2 3.71Å; P1006-F1008 HydrophobicContact CG-CD2 4.02Å; P1006-F1008 HydrophobicContact CG-CE2 3.79Å; P1006-F1008 PolarHBondContact O-N 2.85Å; P1006-S1009 WeakPolarHBondContact O-CB 3.39Å; P1006-S1009 PolarHBondContact O-N 2.85Å; P1006-S1009 VanDerWaalsContact O-N 3.16Å; P1006-Y1130 HydrophobicContact CG-CE1 4.26Å; P1006-Y1130 WeakPolarHBondContact CG-OH 3.37Å; P1006-Y1130 PolarHBondContact O-OH 3.26Å; P1006-Y1130 VanDerWaalsContact O-OH 3.1Å
1007	E	35.5	Very low	34.1	Very low	124.6 Å²	124.6	124.3 Å²	124.3	58%	0.582	68%	0.676	S	S	*	*			trans	-72.2	115.1	174.2	-100.5	175.1	159.5	0	0	111.9	K918 L961 R1004 P1005 S1009 R1013 T1120	K918-E1007 IonicContact NZ-OE1 3.46Å; K918-E1007 PolarHBondContact NZ-OE1 3.38Å; K918-E1007 IonicContact NZ-OE2 3.99Å; L961-E1007 WeakPolarHBondContact CD1-O 3.47Å; R1004-E1007 IonicContact CZ-OE2 3.64Å; R1004-E1007 IonicContact NH1-OE2 2.79Å; R1004-E1007 PolarHBondContact NH1-OE2 2.69Å; P1005-E1007 PolarHBondContact O-N 3.12Å; E1007-S1009 VanDerWaalsContact C-N 3.27Å; E1007-S1009 PolarHBondContact O-N 3.01Å; E1007-S1009 VanDerWaalsContact O-N 3.08Å; E1007-S1009 PolarHBondContact O-OG 3.02Å; E1007-R1013 IonicContact OE1-CZ 3.75Å; E1007-R1013 IonicContact OE1-NH2 3.25Å; E1007-R1013 PolarHBondContact OE1-NH2 2.63Å; E1007-R1013 IonicContact OE2-CZ 2.69Å; E1007-R1013 VanDerWaalsContact OE2-CZ 3.29Å; E1007-R1013 IonicContact OE2-NH1 2.71Å; E1007-R1013 PolarHBondContact OE2-NH1 3.44Å; E1007-R1013 IonicContact OE2-NH2 2.66Å; E1007-R1013 PolarHBondContact OE2-NH2 3.47Å; E1007-T1120 HydrophobicContact CG-CG2 3.49Å; E1007-T1120 VanDerWaalsContact CG-CG2 3.49Å
1008	F	35.3	Very low	34.5	Very low	99.6 Å²	99.6	124.2 Å²	124.2	44%	0.437	67%	0.668	S	S	.	*			trans	-101.3	71.1	166.5	-76.4	-85.7	0	0	0	111	L916 N959 L961 Q992 R1004 P1005 P1006 L1010 T1120 I1121 Y1130 V1132	L916-F1008 HydrophobicContact CD1-CD2 4.36Å; L916-F1008 HydrophobicContact CD1-CE2 3.6Å; L916-F1008 HydrophobicContact CD1-CZ 4.26Å; N959-F1008 HydrophobicContact CB-CD1 4.17Å; N959-F1008 HydrophobicContact CB-CE1 4.09Å; N959-F1008 WeakPolarHBondContact O-CE1 3.45Å; L961-F1008 HydrophobicContact CD1-CD1 3.82Å; L961-F1008 HydrophobicContact CD1-CD2 4.48Å; L961-F1008 HydrophobicContact CD1-CE1 3.64Å; L961-F1008 HydrophobicContact CD1-CE2 4.31Å; L961-F1008 HydrophobicContact CD1-CG 4.25Å; L961-F1008 HydrophobicContact CD1-CZ 3.9Å; L961-F1008 HydrophobicContact CG-CD1 4.39Å; L961-F1008 HydrophobicContact CG-CE1 3.94Å; L961-F1008 HydrophobicContact CG-CZ 4.41Å; Q992-F1008 HydrophobicContact CB-CD1 4.36Å; Q992-F1008 HydrophobicContact CB-CE1 3.59Å; Q992-F1008 HydrophobicContact CB-CZ 4.24Å; R1004-F1008 HydrophobicContact CG-CB 4.07Å; R1004-F1008 VanDerWaalsContact CZ-O 3.25Å; R1004-F1008 PolarHBondContact NE-O 2.83Å; P1005-F1008 HydrophobicContact CB-CD2 4.07Å; P1005-F1008 HydrophobicContact CG-CD2 3.98Å; P1005-F1008 HydrophobicContact CG-CE2 4.47Å; P1005-F1008 PolarHBondContact O-N 3.36Å; P1006-F1008 HydrophobicContact CB-CD2 3.99Å; P1006-F1008 HydrophobicContact CB-CE2 3.71Å; P1006-F1008 HydrophobicContact CG-CD2 4.02Å; P1006-F1008 HydrophobicContact CG-CE2 3.79Å; P1006-F1008 PolarHBondContact O-N 2.85Å; F1008-L1010 PolarHBondContact O-N 3.25Å; F1008-T1120 CarbonylContact O-C 3.56Å; F1008-T1120 VanDerWaalsContact O-CA 3.24Å; F1008-T1120 WeakPolarHBondContact O-CA 3.13Å; F1008-T1120 WeakPolarHBondContact O-CG2 3.49Å; F1008-I1121 WeakPolarHBondContact CB-O 3.4Å; F1008-I1121 PolarHBondContact N-O 2.78Å; F1008-I1121 VanDerWaalsContact N-O 3.14Å; F1008-I1121 PolarHBondContact O-N 3.44Å; F1008-Y1130 HydrophobicContact CD1-CE2 4.4Å; F1008-Y1130 AromaticContact CD2-CE2 3.78Å; F1008-Y1130 HydrophobicContact CD2-CE2 3.78Å; F1008-Y1130 AromaticContact CD2-CZ 3.88Å; F1008-Y1130 VanDerWaalsContact CD2-OH 3.25Å; F1008-Y1130 WeakPolarHBondContact CD2-OH 3.28Å; F1008-Y1130 HydrophobicContact CE1-CE2 4.2Å; F1008-Y1130 AromaticContact CE2-CE2 3.58Å; F1008-Y1130 HydrophobicContact CE2-CE2 3.58Å; F1008-Y1130 AromaticContact CE2-CZ 3.51Å; F1008-Y1130 WeakPolarHBondContact CE2-OH 3.48Å; F1008-Y1130 HydrophobicContact CG-CE2 4.21Å; F1008-Y1130 AromaticContact CZ-CE2 3.81Å; F1008-Y1130 HydrophobicContact CZ-CE2 3.81Å; F1008-V1132 HydrophobicContact CD1-CB 4.23Å; F1008-V1132 HydrophobicContact CD1-CG2 3.96Å; F1008-V1132 HydrophobicContact CE1-CG2 4.49Å
1009	S	34.4	Very low	35.5	Very low	77.8 Å²	77.8	120.5 Å²	120.5	54%	0.544	65%	0.651	S	S	.	*			trans	-70.3	133.2	160.6	-15.1	0	0	0	0	111.2	P1005 P1006 E1007 L1011	P1005-S1009 PolarHBondContact O-N 2.86Å; P1006-S1009 WeakPolarHBondContact O-CB 3.39Å; P1006-S1009 PolarHBondContact O-N 2.85Å; P1006-S1009 VanDerWaalsContact O-N 3.16Å; E1007-S1009 VanDerWaalsContact C-N 3.27Å; E1007-S1009 PolarHBondContact O-N 3.01Å; E1007-S1009 VanDerWaalsContact O-N 3.08Å; E1007-S1009 PolarHBondContact O-OG 3.02Å; S1009-L1011 PolarHBondContact O-N 3.3Å
1010	L	34.6	Very low	37	Very low	98 Å²	98	114.4 Å²	114.4	51%	0.513	63%	0.627	S	S	.	*			trans	-109.2	97.9	157.5	-74.7	170.3	0	0	0	111.5	F1008 R1013 P1021 M1118 E1119 I1121 V1132 T1134 Y1136	F1008-L1010 PolarHBondContact O-N 3.25Å; L1010-R1013 HydrophobicContact CD1-CB 3.94Å; L1010-R1013 HydrophobicContact CD2-CB 3.45Å; L1010-R1013 VanDerWaalsContact CD2-CB 3.45Å; L1010-R1013 HydrophobicContact CD2-CG 3.37Å; L1010-R1013 HydrophobicContact CG-CB 4.35Å; L1010-P1021 HydrophobicContact CB-CG 4.24Å; L1010-P1021 HydrophobicContact CD1-CG 4.14Å; L1010-M1118 HydrophobicContact CD1-CB 3.95Å; L1010-E1119 WeakPolarHBondContact CB-O 3.45Å; L1010-E1119 PolarHBondContact N-O 3.15Å; L1010-I1121 HydrophobicContact CD1-CD1 4.04Å; L1010-I1121 HydrophobicContact CD1-CG1 4.07Å; L1010-I1121 HydrophobicContact CD2-CD1 4.45Å; L1010-V1132 HydrophobicContact CD2-CG1 4.08Å; L1010-T1134 HydrophobicContact CD2-CG2 4.01Å; L1010-Y1136 PolarHBondContact O-OH 2.83Å
1011	L	34.1	Very low	39	Very low	94 Å²	94	105.8 Å²	105.8	49%	0.492	59%	0.587	S	S	.	*	S	Bend	trans	-78.4	137.7	159.2	-75.6	172.1	0	0	0	108.7	S1009 R1013 M1118 E1119	S1009-L1011 PolarHBondContact O-N 3.3Å; L1011-R1013 PolarHBondContact O-N 3.03Å; L1011-M1118 WeakPolarHBondContact CD1-O 3.46Å; L1011-E1119 WeakPolarHBondContact CD1-O 3.49Å
1012	P	29.2	Very low	41.3	Very low	95.4 Å²	95.4	106.2 Å²	106.2	62%	0.619	57%	0.569	S	S	*	*			trans	-63.3	128.2	-169.5	15.2	-21.5	0	0	0	112	T1014	P1012-T1014 PolarHBondContact O-N 3.13Å; P1012-T1014 PolarHBondContact O-OG1 3.05Å
1013	R	31.4	Very low	43.7	Very low	225.8 Å²	225.8	102.6 Å²	102.6	85%	0.852	54%	0.537	S	S	*	.			trans	-69.1	83.3	174.7	-149.9	-177.8	-168.5	-177.7	4.5	109.8	E1007 L1010 L1011	E1007-R1013 IonicContact OE1-CZ 3.75Å; E1007-R1013 IonicContact OE1-NH2 3.25Å; E1007-R1013 PolarHBondContact OE1-NH2 2.63Å; E1007-R1013 IonicContact OE2-CZ 2.69Å; E1007-R1013 VanDerWaalsContact OE2-CZ 3.29Å; E1007-R1013 IonicContact OE2-NH1 2.71Å; E1007-R1013 PolarHBondContact OE2-NH1 3.44Å; E1007-R1013 IonicContact OE2-NH2 2.66Å; E1007-R1013 PolarHBondContact OE2-NH2 3.47Å; L1010-R1013 HydrophobicContact CD1-CB 3.94Å; L1010-R1013 HydrophobicContact CD2-CB 3.45Å; L1010-R1013 VanDerWaalsContact CD2-CB 3.45Å; L1010-R1013 HydrophobicContact CD2-CG 3.37Å; L1010-R1013 HydrophobicContact CG-CB 4.35Å; L1011-R1013 PolarHBondContact O-N 3.03Å
1014	T	31.5	Very low	46.2	Very low	114 Å²	114	95.4 Å²	95.4	70%	0.699	50%	0.498	S	S	*	.			trans	-113.1	127.7	166.2	23.4	0	0	0	0	107.1	P1012 G1016	P1012-T1014 PolarHBondContact O-N 3.13Å; P1012-T1014 PolarHBondContact O-OG1 3.05Å; T1014-G1016 PolarHBondContact O-N 3.03Å
1015	E	31.4	Very low	48.6	Very low	199.6 Å²	199.6	87.4 Å²	87.4	93%	0.933	47%	0.471	S	S	*	.	S	Bend	trans	-61.7	122.2	180	-63.9	171.8	146	0	0	111.5
1016	G	31.6	Very low	51	Low	54.6 Å²	54.6	83.8 Å²	83.8	56%	0.563	45%	0.447	S	S	*	.	S	Bend	trans	146.6	102.2	-179.3	0	0	0	0	0	113.6	T1014 Q1018 K1139	T1014-G1016 PolarHBondContact O-N 3.03Å; G1016-Q1018 PolarHBondContact O-N 3.15Å; G1016-K1139 PolarHBondContact O-NZ 2.94Å
1017	T	35.3	Very low	53.5	Low	123.4 Å²	123.4	80.4 Å²	80.4	76%	0.757	42%	0.424	S	S	*	.			trans	29.3	97.8	170.1	-24.8	0	0	0	0	114.6	I1019 K1139	T1017-I1019 WeakPolarHBondContact O-CG1 3.03Å; T1017-I1019 PolarHBondContact O-N 3.07Å; T1017-I1019 VanDerWaalsContact O-N 3.14Å; T1017-K1139 VanDerWaalsContact O-CE 3.23Å; T1017-K1139 WeakPolarHBondContact O-CE 3.42Å; T1017-K1139 PolarHBondContact O-NZ 3.26Å; T1017-K1139 PolarHBondContact OG1-NZ 3.46Å
1018	Q	46.8	Very low	55.9	Low	118.8 Å²	118.8	74.5 Å²	74.5	56%	0.555	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-62.7	124.5	171.8	-107.7	-176.3	15.9	0	0	110.1	G1016 L1020 Q1117	G1016-Q1018 PolarHBondContact O-N 3.15Å; Q1018-L1020 HydrophobicContact CB-CD2 4.47Å; Q1018-L1020 PolarHBondContact O-N 3.11Å; Q1018-Q1117 HydrophobicContact CB-CG 4.12Å; Q1018-Q1117 HydrophobicContact CG-CG 4.48Å; Q1018-Q1117 VanDerWaalsContact NE2-CD 3.31Å; Q1018-Q1117 VanDerWaalsContact OE1-CA 3.31Å; Q1018-Q1117 VanDerWaalsContact OE1-CB 3.27Å; Q1018-Q1117 VanDerWaalsContact OE1-CD 3.32Å
1019	I	56.3	Low	58.2	Low	61.8 Å²	61.8	70.1 Å²	70.1	32%	0.317	38%	0.378	S	S	.	.	P	Polyproline II helix	trans	-93.6	121.6	178.1	-55.9	177	0	0	0	107.9	T1017 Y1136 P1137 K1139	T1017-I1019 WeakPolarHBondContact O-CG1 3.03Å; T1017-I1019 PolarHBondContact O-N 3.07Å; T1017-I1019 VanDerWaalsContact O-N 3.14Å; I1019-Y1136 HydrophobicContact CB-CD1 3.97Å; I1019-Y1136 HydrophobicContact CG2-CD1 4.23Å; I1019-Y1136 HydrophobicContact CG2-CG 4.44Å; I1019-Y1136 VanDerWaalsContact O-CD1 3.27Å; I1019-Y1136 WeakPolarHBondContact O-CD1 3.29Å; I1019-Y1136 VanDerWaalsContact O-CE1 3.27Å; I1019-Y1136 WeakPolarHBondContact O-CE1 3.37Å; I1019-P1137 HydrophobicContact CG2-CG 3.67Å; I1019-P1137 VanDerWaalsContact CG2-CG 3.41Å; I1019-K1139 HydrophobicContact CD1-CB 4.33Å; I1019-K1139 HydrophobicContact CD1-CD 4.12Å; I1019-K1139 HydrophobicContact CD1-CG 3.76Å; I1019-K1139 VanDerWaalsContact CD1-CG 3.49Å; I1019-K1139 HydrophobicContact CG1-CD 3.83Å; I1019-K1139 HydrophobicContact CG1-CG 4.27Å
1020	L	69.5	Low	60.7	Low	41.8 Å²	41.8	67.2 Å²	67.2	22%	0.219	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-68.6	141.2	172.3	-71.7	168	0	0	0	110.5	Q1018 K1022 M1043 I1093 L1113 N1116 Q1117 M1118 P1137	Q1018-L1020 HydrophobicContact CB-CD2 4.47Å; Q1018-L1020 PolarHBondContact O-N 3.11Å; L1020-K1022 PolarHBondContact O-N 3.05Å; L1020-M1043 HydrophobicContact CD2-CE 3.72Å; L1020-I1093 HydrophobicContact CB-CG2 4.29Å; L1020-I1093 HydrophobicContact CD1-CG2 4.28Å; L1020-L1113 HydrophobicContact CD1-CD1 3.71Å; L1020-L1113 HydrophobicContact CD1-CD2 3.45Å; L1020-L1113 VanDerWaalsContact CD1-CD2 3.45Å; L1020-L1113 HydrophobicContact CD2-CD2 4.17Å; L1020-L1113 HydrophobicContact CG-CD2 4.43Å; L1020-N1116 WeakPolarHBondContact CD2-O 3.38Å; L1020-N1116 VanDerWaalsContact CG-O 3.25Å; L1020-N1116 WeakPolarHBondContact CG-O 3.33Å; L1020-Q1117 HydrophobicContact CD1-CB 3.49Å; L1020-Q1117 VanDerWaalsContact CD1-CB 3.49Å; L1020-Q1117 VanDerWaalsContact CD2-C 3.45Å; L1020-Q1117 HydrophobicContact CD2-CB 3.86Å; L1020-Q1117 HydrophobicContact CD2-CG 4.35Å; L1020-Q1117 HydrophobicContact CG-CB 4.18Å; L1020-M1118 HydrophobicContact CD2-CB 4.11Å; L1020-P1137 WeakPolarHBondContact O-CD 3.3Å
1021	P	77.7	Confident	63	Low	2 Å²	2	65.9 Å²	65.9	1%	0.013	35%	0.346	C	S	.	.	P	Polyproline II helix	trans	-65.8	138.5	173.8	28.1	-32.4	0	0	0	110.1	L1010 T1023 I1093 M1118 T1134 E1135 Y1136	L1010-P1021 HydrophobicContact CB-CG 4.24Å; L1010-P1021 HydrophobicContact CD1-CG 4.14Å; P1021-T1023 VanDerWaalsContact C-N 3.3Å; P1021-T1023 PolarHBondContact O-N 3.21Å; P1021-I1093 HydrophobicContact CG-CD1 4.38Å; P1021-I1093 VanDerWaalsContact O-CB 3.28Å; P1021-I1093 WeakPolarHBondContact O-CB 3.31Å; P1021-I1093 WeakPolarHBondContact O-CD1 3.17Å; P1021-M1118 HydrophobicContact CB-CE 4.4Å; P1021-M1118 HydrophobicContact CG-CB 4.25Å; P1021-M1118 HydrophobicContact CG-CE 3.96Å; P1021-M1118 HydrophobicContact CG-SD 3.64Å; P1021-M1118 VanDerWaalsContact CG-SD 3.6Å; P1021-M1118 WeakPolarHBondContact CG-SD 2.8Å; P1021-M1118 WeakPolarHBondContact O-CE 3.49Å; P1021-T1134 HydrophobicContact CB-CG2 4.22Å; P1021-T1134 HydrophobicContact CG-CG2 4.45Å; P1021-E1135 CarbonylContact C-O 3.51Å; P1021-E1135 VanDerWaalsContact C-O 3.27Å; P1021-E1135 WeakPolarHBondContact CA-O 3.43Å; P1021-E1135 WeakPolarHBondContact CB-O 3.37Å; P1021-Y1136 HydrophobicContact CB-CD1 4.06Å; P1021-Y1136 HydrophobicContact CB-CD2 4.36Å; P1021-Y1136 HydrophobicContact CB-CE1 3.93Å; P1021-Y1136 HydrophobicContact CB-CE2 4.35Å; P1021-Y1136 HydrophobicContact CB-CG 4.3Å; P1021-Y1136 HydrophobicContact CG-CE1 4.3Å
1022	K	81.4	Confident	65	Low	80.2 Å²	80.2	70.7 Å²	70.7	35%	0.349	36%	0.363	S	S	.	.	S	Bend	trans	-67.4	-38.2	174.5	176.8	-171.5	166.3	-160.3	0	111.2	F986 L1020 I1093 E1094 E1135 P1137 P1343 S1345	F986-K1022 HydrophobicContact CD1-CD 3.98Å; F986-K1022 HydrophobicContact CE1-CD 3.42Å; F986-K1022 VanDerWaalsContact CE1-CD 3.42Å; F986-K1022 VanDerWaalsContact CE2-NZ 3.3Å; F986-K1022 HydrophobicContact CZ-CD 3.87Å; L1020-K1022 PolarHBondContact O-N 3.05Å; K1022-I1093 WeakPolarHBondContact CG-O 3.12Å; K1022-I1093 PolarHBondContact O-N 3.02Å; K1022-E1094 IonicContact NZ-OE1 2.72Å; K1022-E1135 WeakPolarHBondContact CE-OE1 3.31Å; K1022-E1135 PolarHBondContact N-O 2.97Å; K1022-E1135 IonicContact NZ-OE1 3.02Å; K1022-E1135 PolarHBondContact NZ-OE1 3.12Å; K1022-E1135 IonicContact NZ-OE2 3.15Å; K1022-P1137 HydrophobicContact CB-CB 4.36Å; K1022-P1343 PolarHBondContact NZ-O 3.05Å; K1022-S1345 VanDerWaalsContact CD-OG 3.27Å; K1022-S1345 WeakPolarHBondContact CD-OG 3.08Å; K1022-S1345 WeakPolarHBondContact CE-OG 3.42Å
1023	T	83.9	Confident	67.5	Low	21.6 Å²	21.6	72.8 Å²	72.8	13%	0.133	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	143.5	170.3	67.3	0	0	0	0	110.8	P1021 T1090 F1091 T1092 T1134 E1135	P1021-T1023 VanDerWaalsContact C-N 3.3Å; P1021-T1023 PolarHBondContact O-N 3.21Å; T1023-T1090 HydrophobicContact CG2-CG2 4.39Å; T1023-F1091 WeakPolarHBondContact CA-O 3.39Å; T1023-T1092 HydrophobicContact CG2-CG2 4.27Å; T1023-T1134 CarbonylContact O-C 3.56Å; T1023-T1134 WeakPolarHBondContact O-CA 3.36Å; T1023-E1135 WeakPolarHBondContact CG2-OE2 3.3Å; T1023-E1135 PolarHBondContact N-O 3.33Å; T1023-E1135 PolarHBondContact O-N 3.05Å; T1023-E1135 VanDerWaalsContact OG1-CB 3.24Å; T1023-E1135 WeakPolarHBondContact OG1-CB 3.31Å; T1023-E1135 PolarHBondContact OG1-OE2 3.17Å
1024	A	85.1	Confident	69.9	Low	0.2 Å²	0.2	62.8 Å²	62.8	0%	0.002	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	120.2	166	0	0	0	0	0	108.9	T1090 F1091 M1118 I1121 D1133 T1134	A1024-T1090 CarbonylContact O-C 2.83Å; A1024-T1090 WeakPolarHBondContact O-CA 3.48Å; A1024-F1091 HydrophobicContact CB-CB 4.44Å; A1024-F1091 PolarHBondContact N-O 2.86Å; A1024-F1091 WeakPolarHBondContact O-CD2 3.22Å; A1024-F1091 PolarHBondContact O-N 3.06Å; A1024-M1118 HydrophobicContact CB-CE 3.76Å; A1024-M1118 HydrophobicContact CB-SD 4.09Å; A1024-I1121 HydrophobicContact CB-CD1 3.82Å; A1024-D1133 CarbonylContact C-O 3.53Å; A1024-D1133 WeakPolarHBondContact CA-O 3.33Å; A1024-T1134 HydrophobicContact CB-CG2 4.07Å
1025	T	86.5	Confident	72.5	Confident	25.4 Å²	25.4	62.8 Å²	62.8	16%	0.156	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	115.7	-177.9	-61.2	0	0	0	0	110.3	P1088 L1089 T1090 V1132 D1133 F1341	T1025-P1088 HydrophobicContact CG2-CB 4.19Å; T1025-L1089 CarbonylContact C-O 3.54Å; T1025-L1089 WeakPolarHBondContact CA-O 3.41Å; T1025-T1090 VanDerWaalsContact CG2-OG1 3.31Å; T1025-T1090 WeakPolarHBondContact CG2-OG1 3.42Å; T1025-T1090 WeakPolarHBondContact OG1-CB 3.19Å; T1025-T1090 WeakPolarHBondContact OG1-CG2 3.37Å; T1025-T1090 PolarHBondContact OG1-OG1 3.06Å; T1025-T1090 VanDerWaalsContact OG1-OG1 3.05Å; T1025-V1132 CarbonylContact O-C 3.58Å; T1025-V1132 WeakPolarHBondContact O-CA 3.32Å; T1025-D1133 WeakPolarHBondContact CB-O 3.41Å; T1025-D1133 PolarHBondContact N-O 3.18Å; T1025-D1133 PolarHBondContact O-N 2.85Å; T1025-F1341 HydrophobicContact CG2-CE1 3.46Å; T1025-F1341 VanDerWaalsContact CG2-CE1 3.46Å; T1025-F1341 HydrophobicContact CG2-CZ 3.68Å
1026	T	85.3	Confident	75.4	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	110.4	174.6	-52.7	0	0	0	0	109.3	V1028 P1088 L1089 I1121 V1123 Y1130 S1131 V1132	T1026-V1028 HydrophobicContact CG2-CG2 3.77Å; T1026-V1028 PolarHBondContact O-N 2.7Å; T1026-V1028 VanDerWaalsContact O-N 3.14Å; T1026-P1088 CarbonylContact O-C 3.49Å; T1026-L1089 PolarHBondContact N-O 3.12Å; T1026-L1089 WeakPolarHBondContact O-CB 3.31Å; T1026-L1089 PolarHBondContact O-N 2.89Å; T1026-I1121 HydrophobicContact CG2-CG2 4.48Å; T1026-V1123 HydrophobicContact CG2-CG2 3.61Å; T1026-Y1130 HydrophobicContact CG2-CD2 4.29Å; T1026-S1131 CarbonylContact C-O 3.49Å; T1026-S1131 VanDerWaalsContact CA-O 3.27Å; T1026-S1131 WeakPolarHBondContact CA-O 3.39Å; T1026-V1132 HydrophobicContact CG2-CG2 4.23Å
1027	N	85.9	Confident	78.3	Confident	30.6 Å²	30.6	54.2 Å²	54.2	16%	0.164	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	112	172.8	-65	-77.3	0	0	0	108.7	N1086 P1088 Y1130 S1131 D1133	N1027-N1086 WeakPolarHBondContact CA-OD1 3.26Å; N1027-N1086 VanDerWaalsContact CB-OD1 3.31Å; N1027-N1086 WeakPolarHBondContact CB-OD1 3.23Å; N1027-N1086 PolarHBondContact OD1-ND2 3Å; N1027-P1088 WeakPolarHBondContact OD1-CB 3.24Å; N1027-Y1130 CarbonylContact O-C 3.5Å; N1027-Y1130 WeakPolarHBondContact O-CA 3.39Å; N1027-Y1130 VanDerWaalsContact O-CB 3.3Å; N1027-Y1130 WeakPolarHBondContact O-CB 3.37Å; N1027-S1131 WeakPolarHBondContact CB-OG 3.26Å; N1027-S1131 PolarHBondContact N-O 3.2Å; N1027-S1131 PolarHBondContact ND2-OG 3.01Å; N1027-S1131 VanDerWaalsContact ND2-OG 3.09Å; N1027-S1131 PolarHBondContact O-N 2.91Å; N1027-S1131 VanDerWaalsContact O-N 3.09Å; N1027-D1133 PolarHBondContact ND2-OD2 2.93Å
1028	V	86	Confident	81	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	128.7	-177.5	-176.9	0	0	0	0	110.8	T1026 L1030 F1037 V1039 N1086 I1087 L1089 V1123 V1127	T1026-V1028 HydrophobicContact CG2-CG2 3.77Å; T1026-V1028 PolarHBondContact O-N 2.7Å; T1026-V1028 VanDerWaalsContact O-N 3.14Å; V1028-L1030 HydrophobicContact CG1-CD2 3.66Å; V1028-L1030 HydrophobicContact CG1-CG 4.47Å; V1028-F1037 HydrophobicContact CB-CE2 4.49Å; V1028-F1037 HydrophobicContact CG1-CD2 4.21Å; V1028-F1037 HydrophobicContact CG1-CE2 4.32Å; V1028-F1037 HydrophobicContact CG1-CG 4.4Å; V1028-F1037 HydrophobicContact CG1-CZ 4.31Å; V1028-F1037 HydrophobicContact CG2-CE2 4.36Å; V1028-V1039 HydrophobicContact CG2-CG2 4.34Å; V1028-N1086 CarbonylContact O-C 3.48Å; V1028-N1086 WeakPolarHBondContact O-CA 3.32Å; V1028-I1087 HydrophobicContact CB-CB 4.46Å; V1028-I1087 PolarHBondContact N-O 3.03Å; V1028-I1087 WeakPolarHBondContact O-CB 3.47Å; V1028-I1087 PolarHBondContact O-N 2.99Å; V1028-L1089 HydrophobicContact CB-CD1 4.45Å; V1028-L1089 HydrophobicContact CG2-CD1 3.71Å; V1028-L1089 HydrophobicContact CG2-CG 4.46Å; V1028-V1123 HydrophobicContact CG1-CG1 4.34Å; V1028-V1123 HydrophobicContact CG2-CG1 4.24Å; V1028-V1127 HydrophobicContact CG1-CB 4.38Å; V1028-V1127 HydrophobicContact CG1-CG1 3.91Å; V1028-V1127 HydrophobicContact CG1-CG2 3.79Å
1029	A	84.5	Confident	83.2	Confident	6.2 Å²	6.2	46.5 Å²	46.5	5%	0.051	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	136.7	167.7	0	0	0	0	0	109.4	L1084 K1085 V1127 D1128 N1129	A1029-L1084 CarbonylContact C-O 3.55Å; A1029-L1084 WeakPolarHBondContact CA-O 3.47Å; A1029-K1085 VanDerWaalsContact CB-O 3.27Å; A1029-K1085 WeakPolarHBondContact CB-O 3.29Å; A1029-V1127 CarbonylContact O-C 3.48Å; A1029-V1127 VanDerWaalsContact O-CA 3.28Å; A1029-V1127 WeakPolarHBondContact O-CA 3.46Å; A1029-V1127 WeakPolarHBondContact O-CG1 3.35Å; A1029-D1128 CarbonylContact C-O 3.51Å; A1029-D1128 WeakPolarHBondContact CB-O 3.03Å; A1029-D1128 CarbonylContact O-C 3.59Å; A1029-D1128 WeakPolarHBondContact O-CA 3.27Å; A1029-D1128 WeakPolarHBondContact O-CB 3.41Å; A1029-D1128 PolarHBondContact O-N 3Å; A1029-N1129 WeakPolarHBondContact CB-ND2 3.29Å; A1029-N1129 WeakPolarHBondContact CB-O 3.43Å; A1029-N1129 WeakPolarHBondContact CB-OD1 3.33Å; A1029-N1129 PolarHBondContact N-O 2.98Å; A1029-N1129 PolarHBondContact O-N 3.24Å; A1029-N1129 VanDerWaalsContact O-N 3.17Å
1030	L	86.4	Confident	84.8	Confident	16.8 Å²	16.8	44.2 Å²	44.2	9%	0.088	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	150.1	-173.2	-57.1	-177.1	0	0	0	112.6	V1028 A1034 F1037 L1055 L1084 I1087 D1126 V1127	V1028-L1030 HydrophobicContact CG1-CD2 3.66Å; V1028-L1030 HydrophobicContact CG1-CG 4.47Å; L1030-A1034 HydrophobicContact CB-CB 3.92Å; L1030-A1034 HydrophobicContact CD1-CB 4.4Å; L1030-F1037 HydrophobicContact CD1-CD1 3.83Å; L1030-F1037 HydrophobicContact CD1-CE1 4Å; L1030-F1037 HydrophobicContact CD2-CB 4Å; L1030-F1037 HydrophobicContact CD2-CD1 3.56Å; L1030-F1037 HydrophobicContact CD2-CE1 4.18Å; L1030-F1037 HydrophobicContact CD2-CG 3.88Å; L1030-F1037 HydrophobicContact CG-CD1 4.33Å; L1030-L1055 HydrophobicContact CD1-CD1 3.8Å; L1030-L1055 HydrophobicContact CD1-CD2 3.81Å; L1030-L1055 HydrophobicContact CD1-CG 4.34Å; L1030-L1084 HydrophobicContact CD1-CD2 4.21Å; L1030-L1084 PolarHBondContact N-O 2.94Å; L1030-L1084 VanDerWaalsContact N-O 3.11Å; L1030-I1087 HydrophobicContact CD1-CD1 3.72Å; L1030-I1087 HydrophobicContact CG-CD1 4.09Å; L1030-D1126 WeakPolarHBondContact CA-O 3.37Å; L1030-V1127 HydrophobicContact CD2-CB 4.46Å; L1030-V1127 HydrophobicContact CD2-CG2 3.89Å
1031	K	83.6	Confident	85.8	Confident	72.2 Å²	72.2	42.2 Å²	42.2	31%	0.314	21%	0.205	S	C	.	.	P	Polyproline II helix	trans	-63.2	154.1	174.2	-72.6	177.2	179.9	161.2	0	110.8	F986 E998 N1033 A1034 G1125 D1126 V1127 D1128	F986-K1031 VanDerWaalsContact CZ-NZ 3.31Å; E998-K1031 IonicContact OE1-NZ 2.67Å; E998-K1031 PolarHBondContact OE1-NZ 3.15Å; E998-K1031 IonicContact OE2-NZ 2.7Å; E998-K1031 PolarHBondContact OE2-NZ 3.49Å; K1031-N1033 PolarHBondContact O-N 3.05Å; K1031-A1034 HydrophobicContact CB-CB 4.44Å; K1031-A1034 VanDerWaalsContact O-CB 3.29Å; K1031-A1034 WeakPolarHBondContact O-CB 3.34Å; K1031-A1034 PolarHBondContact O-N 3.17Å; K1031-A1034 VanDerWaalsContact O-N 3.12Å; K1031-G1125 PolarHBondContact NZ-O 3.14Å; K1031-D1126 PolarHBondContact N-O 2.99Å; K1031-V1127 VanDerWaalsContact CE-O 3.24Å; K1031-V1127 WeakPolarHBondContact CE-O 3.2Å; K1031-D1128 HydrophobicContact CG-CB 4.16Å; K1031-D1128 WeakPolarHBondContact CG-OD1 3.26Å
1032	K	76.5	Confident	86.3	Confident	194.2 Å²	194.2	44.7 Å²	44.7	84%	0.844	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	128.3	167.8	-171.6	179	-179.4	-175.9	0	108.8	A1034	K1032-A1034 VanDerWaalsContact C-N 3.33Å
1033	N	80.2	Confident	86.3	Confident	139.6 Å²	139.6	41 Å²	41	75%	0.747	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.8	23.8	-175.7	-50.8	-17.1	0	0	0	115.8	K1031 Q1035	K1031-N1033 PolarHBondContact O-N 3.05Å; N1033-Q1035 PolarHBondContact O-NE2 2.91Å
1034	A	83.4	Confident	86	Confident	16.4 Å²	16.4	40.4 Å²	40.4	14%	0.136	20%	0.197	C	C	.	.			trans	-48.3	143	170.1	0	0	0	0	0	113	L1030 K1031 K1032 L1055 D1126	L1030-A1034 HydrophobicContact CB-CB 3.92Å; L1030-A1034 HydrophobicContact CD1-CB 4.4Å; K1031-A1034 HydrophobicContact CB-CB 4.44Å; K1031-A1034 VanDerWaalsContact O-CB 3.29Å; K1031-A1034 WeakPolarHBondContact O-CB 3.34Å; K1031-A1034 PolarHBondContact O-N 3.17Å; K1031-A1034 VanDerWaalsContact O-N 3.12Å; K1032-A1034 VanDerWaalsContact C-N 3.33Å; A1034-L1055 HydrophobicContact CB-CD1 3.9Å; A1034-L1055 VanDerWaalsContact O-CD1 3.27Å; A1034-L1055 WeakPolarHBondContact O-CD1 3.25Å; A1034-D1126 HydrophobicContact CB-CB 3.43Å; A1034-D1126 VanDerWaalsContact CB-CB 3.43Å
1035	Q	86.4	Confident	85.5	Confident	114.2 Å²	114.2	46.5 Å²	46.5	53%	0.534	24%	0.237	S	C	.	.			trans	-109.3	-36.1	176	-57.4	-128.9	5.1	0	0	112.1	N1033 L1055 R1056 D1126	N1033-Q1035 PolarHBondContact O-NE2 2.91Å; Q1035-L1055 PolarHBondContact O-N 2.98Å; Q1035-R1056 VanDerWaalsContact OE1-CZ 3.23Å; Q1035-R1056 VanDerWaalsContact OE1-NH1 3.14Å; Q1035-D1126 WeakPolarHBondContact CA-OD2 3.34Å; Q1035-D1126 PolarHBondContact N-OD2 3.08Å
1036	N	90.6	Very high	85.1	Confident	71.4 Å²	71.4	47.9 Å²	47.9	38%	0.382	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	161.1	-176.8	73.8	92.8	0	0	0	112.2	A1053 D1126	N1036-A1053 CarbonylContact C-O 3.53Å; N1036-A1053 WeakPolarHBondContact CA-O 3.24Å; N1036-D1126 PolarHBondContact N-OD2 2.83Å; N1036-D1126 PolarHBondContact ND2-OD2 3.1Å; N1036-D1126 WeakPolarHBondContact O-CA 3.28Å; N1036-D1126 VanDerWaalsContact O-CB 3.27Å; N1036-D1126 WeakPolarHBondContact O-CB 3.31Å; N1036-D1126 PolarHBondContact O-N 3.05Å; N1036-D1126 VanDerWaalsContact O-OD2 3.07Å
1037	F	92.2	Very high	85.1	Confident	0.6 Å²	0.6	48.2 Å²	48.2	0%	0.003	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	169.6	157.6	68.9	-86.4	0	0	0	110.5	V1028 L1030 V1039 A1053 L1055 W1059 I1087 L1089 S1124 V1127	V1028-F1037 HydrophobicContact CB-CE2 4.49Å; V1028-F1037 HydrophobicContact CG1-CD2 4.21Å; V1028-F1037 HydrophobicContact CG1-CE2 4.32Å; V1028-F1037 HydrophobicContact CG1-CG 4.4Å; V1028-F1037 HydrophobicContact CG1-CZ 4.31Å; V1028-F1037 HydrophobicContact CG2-CE2 4.36Å; L1030-F1037 HydrophobicContact CD1-CD1 3.83Å; L1030-F1037 HydrophobicContact CD1-CE1 4Å; L1030-F1037 HydrophobicContact CD2-CB 4Å; L1030-F1037 HydrophobicContact CD2-CD1 3.56Å; L1030-F1037 HydrophobicContact CD2-CE1 4.18Å; L1030-F1037 HydrophobicContact CD2-CG 3.88Å; L1030-F1037 HydrophobicContact CG-CD1 4.33Å; F1037-V1039 HydrophobicContact CD2-CG2 4.12Å; F1037-V1039 HydrophobicContact CE2-CG2 4.01Å; F1037-A1053 HydrophobicContact CD1-CB 3.69Å; F1037-A1053 HydrophobicContact CD2-CB 3.9Å; F1037-A1053 HydrophobicContact CE1-CB 3.45Å; F1037-A1053 VanDerWaalsContact CE1-CB 3.46Å; F1037-A1053 HydrophobicContact CE2-CB 3.64Å; F1037-A1053 HydrophobicContact CG-CB 3.92Å; F1037-A1053 HydrophobicContact CZ-CB 3.43Å; F1037-A1053 VanDerWaalsContact CZ-CB 3.43Å; F1037-A1053 PolarHBondContact N-O 2.95Å; F1037-A1053 VanDerWaalsContact N-O 3.12Å; F1037-A1053 CarbonylContact O-C 3.52Å; F1037-A1053 VanDerWaalsContact O-CA 3.32Å; F1037-A1053 WeakPolarHBondContact O-CA 3.37Å; F1037-A1053 WeakPolarHBondContact O-CB 3.36Å; F1037-A1053 PolarHBondContact O-N 2.81Å; F1037-L1055 HydrophobicContact CD1-CD2 4.29Å; F1037-L1055 HydrophobicContact CE1-CD2 4.19Å; F1037-W1059 AromaticContact CE1-CH2 3.65Å; F1037-W1059 HydrophobicContact CE1-CH2 3.65Å; F1037-W1059 AromaticContact CE1-CZ2 3.64Å; F1037-W1059 HydrophobicContact CE1-CZ2 3.64Å; F1037-W1059 HydrophobicContact CE1-CZ3 4.45Å; F1037-W1059 AromaticContact CZ-CH2 3.39Å; F1037-W1059 HydrophobicContact CZ-CH2 3.39Å; F1037-W1059 VanDerWaalsContact CZ-CH2 3.42Å; F1037-W1059 AromaticContact CZ-CZ2 3.87Å; F1037-W1059 HydrophobicContact CZ-CZ2 3.87Å; F1037-W1059 AromaticContact CZ-CZ3 3.83Å; F1037-W1059 HydrophobicContact CZ-CZ3 3.83Å; F1037-I1087 HydrophobicContact CE1-CD1 4.05Å; F1037-I1087 HydrophobicContact CZ-CD1 4.26Å; F1037-L1089 HydrophobicContact CE2-CD1 3.77Å; F1037-L1089 HydrophobicContact CZ-CD1 4.2Å; F1037-S1124 CarbonylContact C-O 3.52Å; F1037-S1124 VanDerWaalsContact CA-O 3.24Å; F1037-S1124 WeakPolarHBondContact CA-O 3.33Å; F1037-S1124 WeakPolarHBondContact CB-O 3.38Å; F1037-V1127 HydrophobicContact CB-CG2 3.5Å; F1037-V1127 VanDerWaalsContact CB-CG2 3.47Å; F1037-V1127 HydrophobicContact CD2-CG2 3.98Å; F1037-V1127 HydrophobicContact CG-CG2 4.25Å
1038	R	92.7	Very high	85.2	Confident	81.8 Å²	81.8	47.6 Å²	47.6	31%	0.309	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	145.1	175.8	174.9	178	-59.9	-174.3	-4.5	110.7	D1040 R1050 L1051 D1052 V1123 S1124	R1038-D1040 WeakPolarHBondContact CD-OD1 3.33Å; R1038-D1040 WeakPolarHBondContact CG-OD1 3.4Å; R1038-D1040 IonicContact CZ-OD2 3.03Å; R1038-D1040 IonicContact NE-OD1 3.19Å; R1038-D1040 IonicContact NE-OD2 2.79Å; R1038-D1040 PolarHBondContact NE-OD2 2.96Å; R1038-D1040 IonicContact NH2-OD2 3.41Å; R1038-R1050 HydrophobicContact CG-CG 4.35Å; R1038-L1051 CarbonylContact C-O 3.47Å; R1038-L1051 VanDerWaalsContact CA-O 3.28Å; R1038-L1051 WeakPolarHBondContact CA-O 3.25Å; R1038-D1052 WeakPolarHBondContact CD-OD1 3.34Å; R1038-D1052 VanDerWaalsContact CG-OD1 3.27Å; R1038-D1052 WeakPolarHBondContact CG-OD1 3.45Å; R1038-D1052 IonicContact CZ-OD1 3.48Å; R1038-D1052 VanDerWaalsContact CZ-OD1 3.32Å; R1038-D1052 IonicContact CZ-OD2 3.12Å; R1038-D1052 IonicContact NE-OD1 3.03Å; R1038-D1052 PolarHBondContact NE-OD1 2.81Å; R1038-D1052 IonicContact NE-OD2 3.26Å; R1038-D1052 VanDerWaalsContact NH2-CG 3.3Å; R1038-D1052 IonicContact NH2-OD1 3.58Å; R1038-D1052 PolarHBondContact NH2-OD1 2.85Å; R1038-D1052 IonicContact NH2-OD2 2.98Å; R1038-D1052 PolarHBondContact NH2-OD2 3.43Å; R1038-V1123 CarbonylContact O-C 3.52Å; R1038-V1123 WeakPolarHBondContact O-CA 3.4Å; R1038-S1124 PolarHBondContact N-O 3.03Å; R1038-S1124 PolarHBondContact O-N 3.1Å
1039	V	92.6	Very high	85.4	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	115.7	168.1	-176.3	0	0	0	0	109	V1028 F1037 V1041 R1050 L1051 L1089 F1091 I1121 E1122 V1123	V1028-V1039 HydrophobicContact CG2-CG2 4.34Å; F1037-V1039 HydrophobicContact CD2-CG2 4.12Å; F1037-V1039 HydrophobicContact CE2-CG2 4.01Å; V1039-V1041 HydrophobicContact CG1-CG2 4.41Å; V1039-R1050 CarbonylContact O-C 3.51Å; V1039-R1050 WeakPolarHBondContact O-CA 2.92Å; V1039-L1051 HydrophobicContact CB-CB 4.34Å; V1039-L1051 HydrophobicContact CG2-CD2 4.44Å; V1039-L1051 PolarHBondContact N-O 2.99Å; V1039-L1051 PolarHBondContact O-N 3.1Å; V1039-L1089 HydrophobicContact CG2-CD1 3.78Å; V1039-F1091 HydrophobicContact CB-CZ 4.34Å; V1039-F1091 HydrophobicContact CG1-CE2 4.12Å; V1039-F1091 HydrophobicContact CG1-CZ 4.09Å; V1039-I1121 HydrophobicContact CG1-CG2 3.8Å; V1039-E1122 CarbonylContact C-O 3.48Å; V1039-E1122 WeakPolarHBondContact CA-O 3.31Å; V1039-V1123 HydrophobicContact CG1-CG2 4.24Å; V1039-V1123 HydrophobicContact CG2-CG1 4.35Å; V1039-V1123 HydrophobicContact CG2-CG2 4.17Å
1040	D	91	Very high	85.8	Confident	12.8 Å²	12.8	49.9 Å²	49.9	7%	0.068	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	116.5	176.3	-78.7	-7.2	0	0	0	109	R1038 K1042 T1048 R1050 I1121 E1122	R1038-D1040 WeakPolarHBondContact CD-OD1 3.33Å; R1038-D1040 WeakPolarHBondContact CG-OD1 3.4Å; R1038-D1040 IonicContact CZ-OD2 3.03Å; R1038-D1040 IonicContact NE-OD1 3.19Å; R1038-D1040 IonicContact NE-OD2 2.79Å; R1038-D1040 PolarHBondContact NE-OD2 2.96Å; R1038-D1040 IonicContact NH2-OD2 3.41Å; D1040-K1042 IonicContact OD2-NZ 2.77Å; D1040-T1048 HydrophobicContact CB-CG2 3.95Å; D1040-R1050 WeakPolarHBondContact OD1-CA 3.39Å; D1040-R1050 VanDerWaalsContact OD1-CB 3.29Å; D1040-R1050 WeakPolarHBondContact OD1-CB 3.35Å; D1040-R1050 VanDerWaalsContact OD1-CG 3.29Å; D1040-R1050 WeakPolarHBondContact OD1-CG 3.35Å; D1040-R1050 IonicContact OD1-CZ 3.04Å; D1040-R1050 IonicContact OD1-NE 3.15Å; D1040-R1050 PolarHBondContact OD1-NE 2.99Å; D1040-R1050 IonicContact OD1-NH2 2.97Å; D1040-R1050 PolarHBondContact OD1-NH2 3.42Å; D1040-R1050 IonicContact OD2-CZ 2.8Å; D1040-R1050 IonicContact OD2-NE 3.13Å; D1040-R1050 PolarHBondContact OD2-NE 2.85Å; D1040-R1050 IonicContact OD2-NH2 3.07Å; D1040-R1050 PolarHBondContact OD2-NH2 2.99Å; D1040-I1121 WeakPolarHBondContact O-CA 3.38Å; D1040-E1122 HydrophobicContact CB-CB 4.32Å; D1040-E1122 PolarHBondContact N-O 2.96Å; D1040-E1122 PolarHBondContact O-N 3.07Å
1041	V	90	Very high	86.1	Confident	0.8 Å²	0.8	49.1 Å²	49.1	1%	0.005	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	105.5	173.5	-177.5	0	0	0	0	108	V1039 M1043 T1048 L1049 F1091 M1118 T1120 I1121	V1039-V1041 HydrophobicContact CG1-CG2 4.41Å; V1041-M1043 HydrophobicContact CB-CE 4.25Å; V1041-M1043 HydrophobicContact CG1-CE 3.56Å; V1041-M1043 VanDerWaalsContact CG1-CE 3.49Å; V1041-M1043 HydrophobicContact CG1-CG 4.1Å; V1041-M1043 HydrophobicContact CG1-SD 4.02Å; V1041-M1043 VanDerWaalsContact CG1-SD 3.57Å; V1041-M1043 PolarHBondContact O-N 3.21Å; V1041-T1048 CarbonylContact O-C 3.57Å; V1041-T1048 WeakPolarHBondContact O-CA 3.17Å; V1041-L1049 HydrophobicContact CB-CB 4.25Å; V1041-L1049 PolarHBondContact N-O 3.04Å; V1041-L1049 PolarHBondContact O-N 3.16Å; V1041-F1091 HydrophobicContact CG2-CD1 4.27Å; V1041-F1091 HydrophobicContact CG2-CD2 4.16Å; V1041-F1091 HydrophobicContact CG2-CE1 4.05Å; V1041-F1091 HydrophobicContact CG2-CE2 3.81Å; V1041-F1091 HydrophobicContact CG2-CG 4.26Å; V1041-F1091 HydrophobicContact CG2-CZ 3.74Å; V1041-M1118 HydrophobicContact CG1-CE 3.78Å; V1041-M1118 HydrophobicContact CG1-CG 4.08Å; V1041-M1118 HydrophobicContact CG1-SD 4.05Å; V1041-T1120 CarbonylContact C-O 3.54Å; V1041-T1120 WeakPolarHBondContact CA-O 3.37Å; V1041-I1121 HydrophobicContact CB-CG1 4.43Å; V1041-I1121 HydrophobicContact CG1-CD1 4.46Å; V1041-I1121 HydrophobicContact CG1-CG1 4.1Å; V1041-I1121 HydrophobicContact CG2-CD1 4.21Å; V1041-I1121 HydrophobicContact CG2-CG1 4.07Å; V1041-I1121 HydrophobicContact CG2-CG2 4.18Å
1042	K	87.9	Confident	86.6	Confident	54.2 Å²	54.2	47.5 Å²	47.5	24%	0.236	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	126.5	177.2	-60.5	-133.5	-177.2	165.6	0	109.4	D1040 T1048 M1118 E1119 T1120 E1122	D1040-K1042 IonicContact OD2-NZ 2.77Å; K1042-T1048 HydrophobicContact CD-CG2 4.12Å; K1042-T1048 VanDerWaalsContact CD-OG1 3.26Å; K1042-T1048 WeakPolarHBondContact CD-OG1 3.08Å; K1042-T1048 PolarHBondContact NZ-OG1 3.22Å; K1042-T1048 VanDerWaalsContact NZ-OG1 3.1Å; K1042-M1118 CarbonylContact O-C 3.56Å; K1042-M1118 WeakPolarHBondContact O-CA 3.41Å; K1042-E1119 HydrophobicContact CB-CB 4.23Å; K1042-E1119 PolarHBondContact O-N 3.03Å; K1042-T1120 WeakPolarHBondContact CB-OG1 3.49Å; K1042-T1120 WeakPolarHBondContact CD-OG1 3.29Å; K1042-T1120 HydrophobicContact CG-CG2 4.08Å; K1042-T1120 WeakPolarHBondContact CG-OG1 3.46Å; K1042-T1120 PolarHBondContact N-O 3.09Å; K1042-E1122 VanDerWaalsContact CE-OE1 3.29Å; K1042-E1122 WeakPolarHBondContact CE-OE1 3.36Å; K1042-E1122 WeakPolarHBondContact CE-OE2 3.36Å; K1042-E1122 IonicContact NZ-OE1 2.74Å; K1042-E1122 PolarHBondContact NZ-OE1 3.01Å; K1042-E1122 IonicContact NZ-OE2 3.34Å; K1042-E1122 PolarHBondContact NZ-OE2 2.95Å
1043	M	82.8	Confident	87.3	Confident	2.4 Å²	2.4	38.3 Å²	38.3	1%	0.012	21%	0.206	C	C	.	.			trans	-120.1	26.9	-172.5	-66	-143.5	173.9	0	0	113.4	L1020 V1041 A1047 L1049 I1093 V1098 L1113 P1114 G1115 N1116 Q1117 M1118	L1020-M1043 HydrophobicContact CD2-CE 3.72Å; V1041-M1043 HydrophobicContact CB-CE 4.25Å; V1041-M1043 HydrophobicContact CG1-CE 3.56Å; V1041-M1043 VanDerWaalsContact CG1-CE 3.49Å; V1041-M1043 HydrophobicContact CG1-CG 4.1Å; V1041-M1043 HydrophobicContact CG1-SD 4.02Å; V1041-M1043 VanDerWaalsContact CG1-SD 3.57Å; V1041-M1043 PolarHBondContact O-N 3.21Å; M1043-A1047 WeakPolarHBondContact CA-O 3.28Å; M1043-A1047 HydrophobicContact CB-CB 4.19Å; M1043-A1047 PolarHBondContact N-O 2.95Å; M1043-A1047 WeakPolarHBondContact O-CB 3.06Å; M1043-L1049 HydrophobicContact CE-CB 3.85Å; M1043-L1049 HydrophobicContact CE-CD2 4.22Å; M1043-L1049 HydrophobicContact SD-CB 4.48Å; M1043-I1093 HydrophobicContact CE-CD1 4.31Å; M1043-V1098 HydrophobicContact CE-CG2 4.24Å; M1043-L1113 HydrophobicContact CE-CD1 4.38Å; M1043-L1113 HydrophobicContact CE-CD2 3.72Å; M1043-L1113 HydrophobicContact CE-CG 4.25Å; M1043-L1113 HydrophobicContact SD-CB 4.32Å; M1043-L1113 HydrophobicContact SD-CD1 4.46Å; M1043-L1113 HydrophobicContact SD-CD2 3.69Å; M1043-L1113 HydrophobicContact SD-CG 4.35Å; M1043-P1114 HydrophobicContact CB-CG 4.18Å; M1043-P1114 HydrophobicContact CG-CG 4.18Å; M1043-P1114 VanDerWaalsContact SD-CD 3.53Å; M1043-P1114 HydrophobicContact SD-CG 3.9Å; M1043-P1114 VanDerWaalsContact SD-CG 3.59Å; M1043-G1115 WeakPolarHBondContact CE-O 3.42Å; M1043-G1115 CarbonylContact O-C 3.54Å; M1043-G1115 VanDerWaalsContact O-C 3.31Å; M1043-G1115 VanDerWaalsContact O-CA 3.3Å; M1043-G1115 WeakPolarHBondContact O-CA 3.35Å; M1043-N1116 PolarHBondContact O-N 3Å; M1043-Q1117 CarbonylContact C-O 3.56Å; M1043-Q1117 WeakPolarHBondContact CA-O 3.42Å; M1043-Q1117 WeakPolarHBondContact CB-O 3.39Å; M1043-Q1117 WeakPolarHBondContact CG-O 3.46Å; M1043-Q1117 PolarHBondContact O-N 3.3Å; M1043-Q1117 VanDerWaalsContact O-O 3.12Å; M1043-M1118 HydrophobicContact CE-CE 4.19Å; M1043-M1118 HydrophobicContact CE-CG 3.9Å; M1043-M1118 HydrophobicContact CE-SD 4.4Å; M1043-M1118 HydrophobicContact CG-CG 4.43Å; M1043-M1118 HydrophobicContact SD-CB 3.97Å; M1043-M1118 HydrophobicContact SD-CE 3.92Å; M1043-M1118 HydrophobicContact SD-CG 4.08Å
1044	G	76	Confident	87.8	Confident	8.4 Å²	8.4	33.3 Å²	33.3	9%	0.087	18%	0.181	C	C	.	.	S	Bend	trans	133.1	174	-173.3	0	0	0	0	0	110.9	S1046 A1047 Q1117 E1119	G1044-S1046 VanDerWaalsContact C-N 3.3Å; G1044-S1046 PolarHBondContact O-N 3.12Å; G1044-S1046 VanDerWaalsContact O-N 3.09Å; G1044-A1047 PolarHBondContact O-N 3.13Å; G1044-A1047 VanDerWaalsContact O-N 3.11Å; G1044-Q1117 PolarHBondContact N-O 3.12Å; G1044-E1119 VanDerWaalsContact CA-CD 3.45Å; G1044-E1119 WeakPolarHBondContact CA-OE1 3.28Å; G1044-E1119 WeakPolarHBondContact CA-OE2 3.33Å; G1044-E1119 PolarHBondContact N-OE2 2.94Å; G1044-E1119 VanDerWaalsContact N-OE2 3.16Å
1045	P	74.8	Confident	87.9	Confident	128.4 Å²	128.4	34.9 Å²	34.9	83%	0.834	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-30.5	-171.9	-9.4	9.5	0	0	0	115.1	E1119	P1045-E1119 WeakPolarHBondContact CD-OE1 3.32Å
1046	S	78.8	Confident	87.7	Confident	54.6 Å²	54.6	39.7 Å²	39.7	38%	0.382	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.7	5.7	-179.2	51.2	0	0	0	0	114.3	G1044 V1065 D1066	G1044-S1046 VanDerWaalsContact C-N 3.3Å; G1044-S1046 PolarHBondContact O-N 3.12Å; G1044-S1046 VanDerWaalsContact O-N 3.09Å; S1046-V1065 CarbonylContact O-C 3.56Å; S1046-V1065 WeakPolarHBondContact O-CA 3.36Å; S1046-D1066 WeakPolarHBondContact CB-OD1 3.4Å; S1046-D1066 PolarHBondContact O-N 2.96Å; S1046-D1066 PolarHBondContact OG-OD1 2.97Å
1047	A	84.2	Confident	87.5	Confident	7 Å²	7	45.3 Å²	45.3	6%	0.058	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	126.2	-173.3	0	0	0	0	0	110.9	M1043 G1044 I1064 P1114	M1043-A1047 WeakPolarHBondContact CA-O 3.28Å; M1043-A1047 HydrophobicContact CB-CB 4.19Å; M1043-A1047 PolarHBondContact N-O 2.95Å; M1043-A1047 WeakPolarHBondContact O-CB 3.06Å; G1044-A1047 PolarHBondContact O-N 3.13Å; G1044-A1047 VanDerWaalsContact O-N 3.11Å; A1047-I1064 CarbonylContact C-O 3.53Å; A1047-I1064 WeakPolarHBondContact CA-O 3.31Å; A1047-P1114 HydrophobicContact CB-CB 4.17Å; A1047-P1114 WeakPolarHBondContact CB-O 3.14Å
1048	T	88.4	Confident	87.2	Confident	18.2 Å²	18.2	48.2 Å²	48.2	11%	0.112	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	134.4	176.1	-64.3	0	0	0	0	111	D1040 V1041 K1042 I1064 P1114	D1040-T1048 HydrophobicContact CB-CG2 3.95Å; V1041-T1048 CarbonylContact O-C 3.57Å; V1041-T1048 WeakPolarHBondContact O-CA 3.17Å; K1042-T1048 HydrophobicContact CD-CG2 4.12Å; K1042-T1048 VanDerWaalsContact CD-OG1 3.26Å; K1042-T1048 WeakPolarHBondContact CD-OG1 3.08Å; K1042-T1048 PolarHBondContact NZ-OG1 3.22Å; K1042-T1048 VanDerWaalsContact NZ-OG1 3.1Å; T1048-I1064 HydrophobicContact CG2-CD1 4.47Å; T1048-I1064 PolarHBondContact N-O 3.11Å; T1048-I1064 WeakPolarHBondContact O-CA 3.12Å; T1048-I1064 WeakPolarHBondContact O-CB 2.98Å; T1048-I1064 PolarHBondContact O-N 3.06Å; T1048-P1114 VanDerWaalsContact C-CG 3.45Å
1049	L	90.9	Very high	87.2	Confident	1.2 Å²	1.2	44.4 Å²	44.4	1%	0.006	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	108.5	167.1	177.7	68.3	0	0	0	108.3	V1041 M1043 L1061 I1072 F1091 V1098 F1111 L1113 P1114	V1041-L1049 HydrophobicContact CB-CB 4.25Å; V1041-L1049 PolarHBondContact N-O 3.04Å; V1041-L1049 PolarHBondContact O-N 3.16Å; M1043-L1049 HydrophobicContact CE-CB 3.85Å; M1043-L1049 HydrophobicContact CE-CD2 4.22Å; M1043-L1049 HydrophobicContact SD-CB 4.48Å; L1049-L1061 HydrophobicContact CD1-CD1 3.72Å; L1049-L1061 HydrophobicContact CD1-CD2 4.44Å; L1049-L1061 HydrophobicContact CD1-CG 3.96Å; L1049-L1061 HydrophobicContact CD2-CD1 4.35Å; L1049-L1061 HydrophobicContact CG-CD1 3.97Å; L1049-I1072 HydrophobicContact CD1-CD1 3.58Å; L1049-F1091 HydrophobicContact CD2-CD1 3.71Å; L1049-F1091 HydrophobicContact CD2-CE1 3.82Å; L1049-F1091 HydrophobicContact CG-CE1 4.26Å; L1049-V1098 HydrophobicContact CD1-CG1 4.02Å; L1049-V1098 HydrophobicContact CD2-CB 4.3Å; L1049-V1098 HydrophobicContact CD2-CG1 4.06Å; L1049-V1098 HydrophobicContact CD2-CG2 4.02Å; L1049-V1098 HydrophobicContact CG-CG1 4.48Å; L1049-F1111 HydrophobicContact CD1-CD1 3.7Å; L1049-F1111 HydrophobicContact CD1-CE1 3.64Å; L1049-F1111 HydrophobicContact CD1-CE2 3.66Å; L1049-F1111 HydrophobicContact CD1-CZ 3.62Å; L1049-F1111 HydrophobicContact CD2-CE2 4.17Å; L1049-F1111 HydrophobicContact CD2-CZ 3.78Å; L1049-F1111 HydrophobicContact CG-CZ 4.36Å; L1049-L1113 HydrophobicContact CD2-CD2 4.32Å; L1049-P1114 HydrophobicContact CB-CG 4.09Å
1050	R	92.6	Very high	87.1	Confident	52.8 Å²	52.8	45.4 Å²	45.4	20%	0.199	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	129.3	-176.6	170.5	165.9	-66.1	155.9	2.5	111	R1038 V1039 D1040 D1052 L1061 S1062 I1064 E1069	R1038-R1050 HydrophobicContact CG-CG 4.35Å; V1039-R1050 CarbonylContact O-C 3.51Å; V1039-R1050 WeakPolarHBondContact O-CA 2.92Å; D1040-R1050 WeakPolarHBondContact OD1-CA 3.39Å; D1040-R1050 VanDerWaalsContact OD1-CB 3.29Å; D1040-R1050 WeakPolarHBondContact OD1-CB 3.35Å; D1040-R1050 VanDerWaalsContact OD1-CG 3.29Å; D1040-R1050 WeakPolarHBondContact OD1-CG 3.35Å; D1040-R1050 IonicContact OD1-CZ 3.04Å; D1040-R1050 IonicContact OD1-NE 3.15Å; D1040-R1050 PolarHBondContact OD1-NE 2.99Å; D1040-R1050 IonicContact OD1-NH2 2.97Å; D1040-R1050 PolarHBondContact OD1-NH2 3.42Å; D1040-R1050 IonicContact OD2-CZ 2.8Å; D1040-R1050 IonicContact OD2-NE 3.13Å; D1040-R1050 PolarHBondContact OD2-NE 2.85Å; D1040-R1050 IonicContact OD2-NH2 3.07Å; D1040-R1050 PolarHBondContact OD2-NH2 2.99Å; R1050-D1052 VanDerWaalsContact CD-OD2 3.25Å; R1050-D1052 WeakPolarHBondContact CD-OD2 3.37Å; R1050-D1052 WeakPolarHBondContact CG-OD2 3.32Å; R1050-L1061 CarbonylContact O-C 3.52Å; R1050-L1061 WeakPolarHBondContact O-CA 3.39Å; R1050-S1062 PolarHBondContact N-O 2.93Å; R1050-S1062 PolarHBondContact O-N 3.15Å; R1050-I1064 HydrophobicContact CB-CD1 3.95Å; R1050-I1064 HydrophobicContact CG-CD1 4.46Å; R1050-I1064 VanDerWaalsContact CZ-CD1 3.45Å; R1050-I1064 VanDerWaalsContact NH1-CD1 3.26Å; R1050-E1069 IonicContact NH1-OE2 2.99Å
1051	L	93.4	Very high	87.2	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	108.9	165.5	176.5	66.2	0	0	0	109.1	R1038 V1039 A1053 W1059 T1060 L1061 F1075 L1089 L1100	R1038-L1051 CarbonylContact C-O 3.47Å; R1038-L1051 VanDerWaalsContact CA-O 3.28Å; R1038-L1051 WeakPolarHBondContact CA-O 3.25Å; V1039-L1051 HydrophobicContact CB-CB 4.34Å; V1039-L1051 HydrophobicContact CG2-CD2 4.44Å; V1039-L1051 PolarHBondContact N-O 2.99Å; V1039-L1051 PolarHBondContact O-N 3.1Å; L1051-A1053 HydrophobicContact CG-CB 4.5Å; L1051-W1059 HydrophobicContact CD1-CB 4.33Å; L1051-W1059 HydrophobicContact CD1-CE3 4.22Å; L1051-W1059 HydrophobicContact CD2-CE3 4.22Å; L1051-W1059 HydrophobicContact CD2-CZ3 4.35Å; L1051-W1059 HydrophobicContact CG-CE3 4.45Å; L1051-T1060 CarbonylContact C-O 3.48Å; L1051-T1060 WeakPolarHBondContact CA-O 3.32Å; L1051-L1061 HydrophobicContact CB-CD1 4.12Å; L1051-L1061 HydrophobicContact CD1-CB 4.39Å; L1051-L1061 HydrophobicContact CD1-CD1 4.35Å; L1051-F1075 HydrophobicContact CD1-CE1 4.11Å; L1051-F1075 HydrophobicContact CD1-CE2 4.18Å; L1051-F1075 HydrophobicContact CD1-CZ 3.66Å; L1051-L1089 HydrophobicContact CD2-CD1 4.11Å; L1051-L1089 HydrophobicContact CD2-CD2 4.26Å; L1051-L1100 HydrophobicContact CD1-CD2 3.89Å; L1051-L1100 HydrophobicContact CD2-CD2 3.9Å; L1051-L1100 HydrophobicContact CG-CD2 4.44Å
1052	D	92.7	Very high	87.2	Confident	38.6 Å²	38.6	44.8 Å²	44.8	21%	0.206	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	121.5	167.7	-79.3	-59.1	0	0	0	109.9	R1038 R1050 P1054 W1059 T1060	R1038-D1052 WeakPolarHBondContact CD-OD1 3.34Å; R1038-D1052 VanDerWaalsContact CG-OD1 3.27Å; R1038-D1052 WeakPolarHBondContact CG-OD1 3.45Å; R1038-D1052 IonicContact CZ-OD1 3.48Å; R1038-D1052 VanDerWaalsContact CZ-OD1 3.32Å; R1038-D1052 IonicContact CZ-OD2 3.12Å; R1038-D1052 IonicContact NE-OD1 3.03Å; R1038-D1052 PolarHBondContact NE-OD1 2.81Å; R1038-D1052 IonicContact NE-OD2 3.26Å; R1038-D1052 VanDerWaalsContact NH2-CG 3.3Å; R1038-D1052 IonicContact NH2-OD1 3.58Å; R1038-D1052 PolarHBondContact NH2-OD1 2.85Å; R1038-D1052 IonicContact NH2-OD2 2.98Å; R1038-D1052 PolarHBondContact NH2-OD2 3.43Å; R1050-D1052 VanDerWaalsContact CD-OD2 3.25Å; R1050-D1052 WeakPolarHBondContact CD-OD2 3.37Å; R1050-D1052 WeakPolarHBondContact CG-OD2 3.32Å; D1052-P1054 VanDerWaalsContact C-CD 3.42Å; D1052-P1054 VanDerWaalsContact O-CD 3.27Å; D1052-P1054 WeakPolarHBondContact O-CD 3.29Å; D1052-W1059 CarbonylContact O-C 3.55Å; D1052-W1059 VanDerWaalsContact O-CA 3.29Å; D1052-W1059 WeakPolarHBondContact O-CA 3.36Å; D1052-W1059 WeakPolarHBondContact O-CB 3.37Å; D1052-T1060 WeakPolarHBondContact CB-OG1 3.42Å; D1052-T1060 PolarHBondContact N-O 3.07Å; D1052-T1060 PolarHBondContact O-N 3.09Å
1053	A	91.9	Very high	87.2	Confident	0.4 Å²	0.4	45.2 Å²	45.2	0%	0.003	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	66.9	-169.5	0	0	0	0	0	113.2	N1036 F1037 L1051 L1055 W1059	N1036-A1053 CarbonylContact C-O 3.53Å; N1036-A1053 WeakPolarHBondContact CA-O 3.24Å; F1037-A1053 HydrophobicContact CD1-CB 3.69Å; F1037-A1053 HydrophobicContact CD2-CB 3.9Å; F1037-A1053 HydrophobicContact CE1-CB 3.45Å; F1037-A1053 VanDerWaalsContact CE1-CB 3.46Å; F1037-A1053 HydrophobicContact CE2-CB 3.64Å; F1037-A1053 HydrophobicContact CG-CB 3.92Å; F1037-A1053 HydrophobicContact CZ-CB 3.43Å; F1037-A1053 VanDerWaalsContact CZ-CB 3.43Å; F1037-A1053 PolarHBondContact N-O 2.95Å; F1037-A1053 VanDerWaalsContact N-O 3.12Å; F1037-A1053 CarbonylContact O-C 3.52Å; F1037-A1053 VanDerWaalsContact O-CA 3.32Å; F1037-A1053 WeakPolarHBondContact O-CA 3.37Å; F1037-A1053 WeakPolarHBondContact O-CB 3.36Å; F1037-A1053 PolarHBondContact O-N 2.81Å; L1051-A1053 HydrophobicContact CG-CB 4.5Å; A1053-L1055 PolarHBondContact O-N 2.93Å; A1053-W1059 HydrophobicContact CB-CD2 3.47Å; A1053-W1059 VanDerWaalsContact CB-CD2 3.46Å; A1053-W1059 VanDerWaalsContact CB-CE2 3.49Å; A1053-W1059 HydrophobicContact CB-CE3 3.77Å; A1053-W1059 HydrophobicContact CB-CG 3.91Å; A1053-W1059 HydrophobicContact CB-CH2 4.19Å; A1053-W1059 HydrophobicContact CB-CZ2 3.88Å; A1053-W1059 HydrophobicContact CB-CZ3 4.13Å
1054	P	91.3	Very high	87.5	Confident	35.4 Å²	35.4	46 Å²	46	23%	0.23	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	125.8	170.6	29.3	-34.7	0	0	0	110.5	D1052 R1056 R1057 P1058 W1059	D1052-P1054 VanDerWaalsContact C-CD 3.42Å; D1052-P1054 VanDerWaalsContact O-CD 3.27Å; D1052-P1054 WeakPolarHBondContact O-CD 3.29Å; P1054-R1056 VanDerWaalsContact C-N 3.26Å; P1054-R1056 PolarHBondContact O-N 3.02Å; P1054-R1056 VanDerWaalsContact O-N 3.14Å; P1054-R1057 HydrophobicContact CB-CB 4.13Å; P1054-R1057 HydrophobicContact CG-CB 3.82Å; P1054-R1057 PolarHBondContact O-N 3.06Å; P1054-P1058 WeakPolarHBondContact CG-O 3.36Å; P1054-W1059 VanDerWaalsContact O-CD1 3.25Å; P1054-W1059 PolarHBondContact O-NE1 3.01Å; P1054-W1059 VanDerWaalsContact O-NE1 3.11Å
1055	L	84.3	Confident	87.9	Confident	50 Å²	50	47.2 Å²	47.2	26%	0.262	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-18.7	-173.4	-59.7	-170.4	0	0	0	114.1	L1030 A1034 Q1035 F1037 A1053 W1059 L1084	L1030-L1055 HydrophobicContact CD1-CD1 3.8Å; L1030-L1055 HydrophobicContact CD1-CD2 3.81Å; L1030-L1055 HydrophobicContact CD1-CG 4.34Å; A1034-L1055 HydrophobicContact CB-CD1 3.9Å; A1034-L1055 VanDerWaalsContact O-CD1 3.27Å; A1034-L1055 WeakPolarHBondContact O-CD1 3.25Å; Q1035-L1055 PolarHBondContact O-N 2.98Å; F1037-L1055 HydrophobicContact CD1-CD2 4.29Å; F1037-L1055 HydrophobicContact CE1-CD2 4.19Å; A1053-L1055 PolarHBondContact O-N 2.93Å; L1055-W1059 HydrophobicContact CD2-CZ2 4.2Å; L1055-L1084 HydrophobicContact CD1-CD1 4.39Å; L1055-L1084 HydrophobicContact CD1-CD2 4.31Å; L1055-L1084 HydrophobicContact CD2-CD2 4.45Å
1056	R	82.7	Confident	88.2	Confident	213.8 Å²	213.8	46.4 Å²	46.4	81%	0.807	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-102.5	-6.7	-179.7	-62.2	-175.2	-178.3	-174.1	-1.1	114.2	Q1035 P1054	Q1035-R1056 VanDerWaalsContact OE1-CZ 3.23Å; Q1035-R1056 VanDerWaalsContact OE1-NH1 3.14Å; P1054-R1056 VanDerWaalsContact C-N 3.26Å; P1054-R1056 PolarHBondContact O-N 3.02Å; P1054-R1056 VanDerWaalsContact O-N 3.14Å
1057	R	85.5	Confident	88.1	Confident	189 Å²	189	46.9 Å²	46.9	71%	0.713	24%	0.235	S	C	*	.	S	Bend	trans	-127.4	168.4	-176.7	-69.3	-177.1	178.5	179.5	-0.6	110	P1054 W1059	P1054-R1057 HydrophobicContact CB-CB 4.13Å; P1054-R1057 HydrophobicContact CG-CB 3.82Å; P1054-R1057 PolarHBondContact O-N 3.06Å; R1057-W1059 PolarHBondContact O-N 3.15Å
1058	P	87.5	Confident	87.9	Confident	61.4 Å²	61.4	52.2 Å²	52.2	40%	0.399	26%	0.263	S	S	.	.			trans	-56.8	139.9	167.6	-22.9	34.6	0	0	0	110.8	P1054 Q1074 F1075	P1054-P1058 WeakPolarHBondContact CG-O 3.36Å; P1058-Q1074 HydrophobicContact CB-CB 4.32Å; P1058-F1075 CarbonylContact C-O 3.55Å; P1058-F1075 WeakPolarHBondContact CA-O 3.5Å
1059	W	92	Very high	87.7	Confident	3.8 Å²	3.8	55.7 Å²	55.7	1%	0.014	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	147.1	170.4	-63.8	8.7	0	0	0	109.3	F1037 L1051 D1052 A1053 P1054 L1055 R1057 Q1074 F1075 P1077 L1079 I1087 L1089 V1102	F1037-W1059 AromaticContact CE1-CH2 3.65Å; F1037-W1059 HydrophobicContact CE1-CH2 3.65Å; F1037-W1059 AromaticContact CE1-CZ2 3.64Å; F1037-W1059 HydrophobicContact CE1-CZ2 3.64Å; F1037-W1059 HydrophobicContact CE1-CZ3 4.45Å; F1037-W1059 AromaticContact CZ-CH2 3.39Å; F1037-W1059 HydrophobicContact CZ-CH2 3.39Å; F1037-W1059 VanDerWaalsContact CZ-CH2 3.42Å; F1037-W1059 AromaticContact CZ-CZ2 3.87Å; F1037-W1059 HydrophobicContact CZ-CZ2 3.87Å; F1037-W1059 AromaticContact CZ-CZ3 3.83Å; F1037-W1059 HydrophobicContact CZ-CZ3 3.83Å; L1051-W1059 HydrophobicContact CD1-CB 4.33Å; L1051-W1059 HydrophobicContact CD1-CE3 4.22Å; L1051-W1059 HydrophobicContact CD2-CE3 4.22Å; L1051-W1059 HydrophobicContact CD2-CZ3 4.35Å; L1051-W1059 HydrophobicContact CG-CE3 4.45Å; D1052-W1059 CarbonylContact O-C 3.55Å; D1052-W1059 VanDerWaalsContact O-CA 3.29Å; D1052-W1059 WeakPolarHBondContact O-CA 3.36Å; D1052-W1059 WeakPolarHBondContact O-CB 3.37Å; A1053-W1059 HydrophobicContact CB-CD2 3.47Å; A1053-W1059 VanDerWaalsContact CB-CD2 3.46Å; A1053-W1059 VanDerWaalsContact CB-CE2 3.49Å; A1053-W1059 HydrophobicContact CB-CE3 3.77Å; A1053-W1059 HydrophobicContact CB-CG 3.91Å; A1053-W1059 HydrophobicContact CB-CH2 4.19Å; A1053-W1059 HydrophobicContact CB-CZ2 3.88Å; A1053-W1059 HydrophobicContact CB-CZ3 4.13Å; P1054-W1059 VanDerWaalsContact O-CD1 3.25Å; P1054-W1059 PolarHBondContact O-NE1 3.01Å; P1054-W1059 VanDerWaalsContact O-NE1 3.11Å; L1055-W1059 HydrophobicContact CD2-CZ2 4.2Å; R1057-W1059 PolarHBondContact O-N 3.15Å; W1059-Q1074 CarbonylContact O-C 3.56Å; W1059-Q1074 VanDerWaalsContact O-CA 3.25Å; W1059-Q1074 WeakPolarHBondContact O-CA 3.25Å; W1059-F1075 WeakPolarHBondContact CA-O 3.12Å; W1059-F1075 HydrophobicContact CB-CD2 4.12Å; W1059-F1075 HydrophobicContact CB-CE1 4.42Å; W1059-F1075 HydrophobicContact CB-CE2 3.8Å; W1059-F1075 HydrophobicContact CB-CZ 4.16Å; W1059-F1075 WeakPolarHBondContact CB-O 3.5Å; W1059-F1075 HydrophobicContact CD2-CE2 4.15Å; W1059-F1075 AromaticContact CE3-CE2 3.61Å; W1059-F1075 HydrophobicContact CE3-CE2 3.8Å; W1059-F1075 AromaticContact CE3-CZ 3.95Å; W1059-F1075 HydrophobicContact CE3-CZ 4.03Å; W1059-F1075 HydrophobicContact CG-CE2 4.34Å; W1059-F1075 HydrophobicContact CZ3-CE2 4.44Å; W1059-F1075 PolarHBondContact N-O 2.97Å; W1059-F1075 PolarHBondContact O-N 2.86Å; W1059-P1077 HydrophobicContact CD2-CG 3.52Å; W1059-P1077 VanDerWaalsContact CD2-CG 3.47Å; W1059-P1077 VanDerWaalsContact CE2-CG 3.45Å; W1059-P1077 HydrophobicContact CE3-CG 3.79Å; W1059-P1077 HydrophobicContact CG-CG 4.1Å; W1059-P1077 HydrophobicContact CH2-CG 3.87Å; W1059-P1077 HydrophobicContact CZ2-CG 3.64Å; W1059-P1077 VanDerWaalsContact CZ2-CG 3.49Å; W1059-P1077 HydrophobicContact CZ3-CB 4.48Å; W1059-P1077 HydrophobicContact CZ3-CG 3.95Å; W1059-L1079 HydrophobicContact CH2-CD1 3.74Å; W1059-L1079 HydrophobicContact CZ2-CD1 3.5Å; W1059-L1079 VanDerWaalsContact CZ2-CD1 3.47Å; W1059-L1079 HydrophobicContact CZ2-CG 4.46Å; W1059-I1087 HydrophobicContact CH2-CD1 4.44Å; W1059-I1087 HydrophobicContact CH2-CG2 4.36Å; W1059-L1089 HydrophobicContact CH2-CD2 4.42Å; W1059-L1089 HydrophobicContact CZ3-CD2 4.06Å; W1059-V1102 HydrophobicContact CH2-CG1 4.35Å; W1059-V1102 HydrophobicContact CZ3-CG1 4.15Å; W1059-V1102 HydrophobicContact CZ3-CG2 4.27Å
1060	T	90.4	Very high	87.2	Confident	21 Å²	21	60.4 Å²	60.4	13%	0.129	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	125.9	-178.5	-40	0	0	0	0	109	L1051 D1052 K1071 I1072 T1073 Q1074	L1051-T1060 CarbonylContact C-O 3.48Å; L1051-T1060 WeakPolarHBondContact CA-O 3.32Å; D1052-T1060 WeakPolarHBondContact CB-OG1 3.42Å; D1052-T1060 PolarHBondContact N-O 3.07Å; D1052-T1060 PolarHBondContact O-N 3.09Å; T1060-K1071 HydrophobicContact CG2-CB 4.32Å; T1060-K1071 HydrophobicContact CG2-CD 4.22Å; T1060-K1071 HydrophobicContact CG2-CG 3.86Å; T1060-I1072 HydrophobicContact CG2-CB 4.49Å; T1060-I1072 HydrophobicContact CG2-CG1 4.3Å; T1060-I1072 HydrophobicContact CG2-CG2 3.7Å; T1060-T1073 WeakPolarHBondContact CA-O 3.2Å; T1060-Q1074 HydrophobicContact CG2-CG 4.01Å; T1060-Q1074 PolarHBondContact OG1-NE2 3.12Å
1061	L	92.2	Very high	86.6	Confident	0 Å²	0	64 Å²	64	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	118.4	169.3	-174.6	67.9	0	0	0	108.2	L1049 R1050 L1051 I1072 T1073 F1075 F1091 V1098 L1100 F1111	L1049-L1061 HydrophobicContact CD1-CD1 3.72Å; L1049-L1061 HydrophobicContact CD1-CD2 4.44Å; L1049-L1061 HydrophobicContact CD1-CG 3.96Å; L1049-L1061 HydrophobicContact CD2-CD1 4.35Å; L1049-L1061 HydrophobicContact CG-CD1 3.97Å; R1050-L1061 CarbonylContact O-C 3.52Å; R1050-L1061 WeakPolarHBondContact O-CA 3.39Å; L1051-L1061 HydrophobicContact CB-CD1 4.12Å; L1051-L1061 HydrophobicContact CD1-CB 4.39Å; L1051-L1061 HydrophobicContact CD1-CD1 4.35Å; L1061-I1072 HydrophobicContact CD2-CD1 4.4Å; L1061-I1072 HydrophobicContact CG-CD1 4.02Å; L1061-I1072 CarbonylContact O-C 3.54Å; L1061-I1072 WeakPolarHBondContact O-CA 3.37Å; L1061-I1072 WeakPolarHBondContact O-CB 3.29Å; L1061-I1072 PolarHBondContact O-N 2.95Å; L1061-T1073 HydrophobicContact CB-CG2 3.87Å; L1061-T1073 HydrophobicContact CD2-CG2 4.09Å; L1061-T1073 PolarHBondContact N-O 3.02Å; L1061-T1073 PolarHBondContact O-N 3.02Å; L1061-F1075 HydrophobicContact CB-CE1 4.04Å; L1061-F1075 HydrophobicContact CB-CZ 4.1Å; L1061-F1091 HydrophobicContact CD1-CE1 4.37Å; L1061-V1098 HydrophobicContact CD2-CG1 4.5Å; L1061-L1100 HydrophobicContact CD1-CD2 3.96Å; L1061-L1100 HydrophobicContact CD2-CB 4.06Å; L1061-L1100 HydrophobicContact CD2-CD2 4.03Å; L1061-L1100 HydrophobicContact CG-CD2 4.35Å; L1061-F1111 HydrophobicContact CD2-CB 4.08Å; L1061-F1111 HydrophobicContact CD2-CD1 3.98Å; L1061-F1111 HydrophobicContact CD2-CD2 4.41Å; L1061-F1111 HydrophobicContact CD2-CE1 3.62Å; L1061-F1111 HydrophobicContact CD2-CG 3.96Å; L1061-F1111 HydrophobicContact CD2-CZ 3.77Å; L1061-F1111 HydrophobicContact CG-CD1 4.26Å; L1061-F1111 HydrophobicContact CG-CE1 4.33Å; L1061-F1111 HydrophobicContact CG-CZ 4.37Å; L1061-F1111 WeakPolarHBondContact O-CZ 3.26Å
1062	S	90.3	Very high	85.9	Confident	0 Å²	0	67 Å²	67	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	138.2	-172.8	-62.4	0	0	0	0	112	R1050 E1069 E1070 K1071	R1050-S1062 PolarHBondContact N-O 2.93Å; R1050-S1062 PolarHBondContact O-N 3.15Å; S1062-E1069 VanDerWaalsContact CB-CG 3.49Å; S1062-E1069 VanDerWaalsContact CB-OE1 3.27Å; S1062-E1069 WeakPolarHBondContact CB-OE1 3.27Å; S1062-E1069 PolarHBondContact OG-OE1 2.97Å; S1062-E1070 CarbonylContact C-O 3.49Å; S1062-E1070 VanDerWaalsContact CA-O 3.27Å; S1062-E1070 WeakPolarHBondContact CA-O 3.35Å; S1062-K1071 CarbonylContact C-O 3.56Å; S1062-K1071 VanDerWaalsContact CA-O 3.27Å; S1062-K1071 WeakPolarHBondContact CA-O 3.32Å; S1062-K1071 WeakPolarHBondContact OG-CG 3.42Å
1063	R	89.4	Confident	85.5	Confident	63 Å²	63	67 Å²	67	24%	0.238	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	119.4	168.3	-179.6	173.7	103.1	160.9	-3.1	107.6	V1065 E1069 E1070 K1071 I1072 F1111 L1113 P1114 D1164	R1063-V1065 HydrophobicContact CG-CG2 3.99Å; R1063-E1069 CarbonylContact O-C 3.47Å; R1063-E1069 WeakPolarHBondContact O-CA 3.39Å; R1063-E1070 HydrophobicContact CB-CB 4.38Å; R1063-E1070 IonicContact CZ-OE2 3.2Å; R1063-E1070 PolarHBondContact N-O 3Å; R1063-E1070 IonicContact NE-OE2 3.36Å; R1063-E1070 PolarHBondContact NE-OE2 3.16Å; R1063-E1070 IonicContact NH1-OE2 2.84Å; R1063-E1070 PolarHBondContact NH1-OE2 3.43Å; R1063-E1070 IonicContact NH2-OE1 3.13Å; R1063-E1070 PolarHBondContact NH2-OE1 2.69Å; R1063-E1070 IonicContact NH2-OE2 3.12Å; R1063-E1070 PolarHBondContact NH2-OE2 2.89Å; R1063-E1070 PolarHBondContact O-N 3.07Å; R1063-K1071 HydrophobicContact CB-CB 4.19Å; R1063-K1071 PolarHBondContact N-O 3.15Å; R1063-I1072 HydrophobicContact CB-CD1 3.84Å; R1063-I1072 HydrophobicContact CB-CG1 3.91Å; R1063-F1111 HydrophobicContact CB-CE1 3.79Å; R1063-F1111 HydrophobicContact CB-CZ 3.94Å; R1063-L1113 PolarHBondContact NH1-O 3.46Å; R1063-P1114 HydrophobicContact CG-CB 3.71Å; R1063-P1114 HydrophobicContact CG-CG 4.25Å; R1063-D1164 IonicContact CZ-OD1 2.69Å; R1063-D1164 VanDerWaalsContact CZ-OD1 3.27Å; R1063-D1164 IonicContact NH1-OD1 2.67Å; R1063-D1164 PolarHBondContact NH1-OD1 3.26Å; R1063-D1164 IonicContact NH2-OD1 3.99Å; R1063-D1164 PolarHBondContact NH2-OD1 3.1Å
1064	I	88.1	Confident	85.2	Confident	19.6 Å²	19.6	72.8 Å²	72.8	10%	0.101	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	122.3	172.9	-56.4	169.2	0	0	0	107.4	A1047 T1048 R1050 N1068 E1069	A1047-I1064 CarbonylContact C-O 3.53Å; A1047-I1064 WeakPolarHBondContact CA-O 3.31Å; T1048-I1064 HydrophobicContact CG2-CD1 4.47Å; T1048-I1064 PolarHBondContact N-O 3.11Å; T1048-I1064 WeakPolarHBondContact O-CA 3.12Å; T1048-I1064 WeakPolarHBondContact O-CB 2.98Å; T1048-I1064 PolarHBondContact O-N 3.06Å; R1050-I1064 HydrophobicContact CB-CD1 3.95Å; R1050-I1064 HydrophobicContact CG-CD1 4.46Å; R1050-I1064 VanDerWaalsContact CZ-CD1 3.45Å; R1050-I1064 VanDerWaalsContact NH1-CD1 3.26Å; I1064-N1068 CarbonylContact C-O 3.5Å; I1064-N1068 VanDerWaalsContact CA-O 3.28Å; I1064-N1068 WeakPolarHBondContact CA-O 3.41Å; I1064-E1069 HydrophobicContact CG1-CB 4.23Å; I1064-E1069 HydrophobicContact CG1-CG 4.07Å
1065	V	84.4	Confident	84.9	Confident	32 Å²	32	72 Å²	72	19%	0.194	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	125.6	175.9	179.8	0	0	0	0	108	S1046 R1063 G1067 N1068 E1070 P1114	S1046-V1065 CarbonylContact O-C 3.56Å; S1046-V1065 WeakPolarHBondContact O-CA 3.36Å; R1063-V1065 HydrophobicContact CG-CG2 3.99Å; V1065-G1067 PolarHBondContact O-N 3.15Å; V1065-G1067 VanDerWaalsContact O-N 3.14Å; V1065-N1068 PolarHBondContact N-O 3.17Å; V1065-N1068 VanDerWaalsContact N-O 3.07Å; V1065-N1068 WeakPolarHBondContact O-CB 3.32Å; V1065-N1068 PolarHBondContact O-N 3.13Å; V1065-E1070 HydrophobicContact CB-CG 4.48Å; V1065-P1114 HydrophobicContact CG2-CB 3.9Å; V1065-P1114 WeakPolarHBondContact CG2-O 3.43Å
1066	D	81.4	Confident	84.7	Confident	112.6 Å²	112.6	77.4 Å²	77.4	60%	0.602	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	35.3	-178.3	-56.3	-46.8	0	0	0	113.2	S1046 N1068	S1046-D1066 WeakPolarHBondContact CB-OD1 3.4Å; S1046-D1066 PolarHBondContact O-N 2.96Å; S1046-D1066 PolarHBondContact OG-OD1 2.97Å; D1066-N1068 VanDerWaalsContact C-N 3.29Å; D1066-N1068 PolarHBondContact O-N 2.98Å; D1066-N1068 PolarHBondContact O-ND2 3.1Å
1067	G	77.3	Confident	84.4	Confident	65 Å²	65	68.1 Å²	68.1	67%	0.67	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.3	-15.9	-177.2	0	0	0	0	0	115.3	V1065 E1069	V1065-G1067 PolarHBondContact O-N 3.15Å; V1065-G1067 VanDerWaalsContact O-N 3.14Å; G1067-E1069 PolarHBondContact O-N 2.98Å
1068	N	79.1	Confident	83.8	Confident	118.4 Å²	118.4	64.8 Å²	64.8	63%	0.633	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.6	125.6	179.1	-63.2	-57	0	0	0	111.1	I1064 V1065 D1066 E1070	I1064-N1068 CarbonylContact C-O 3.5Å; I1064-N1068 VanDerWaalsContact CA-O 3.28Å; I1064-N1068 WeakPolarHBondContact CA-O 3.41Å; V1065-N1068 PolarHBondContact N-O 3.17Å; V1065-N1068 VanDerWaalsContact N-O 3.07Å; V1065-N1068 WeakPolarHBondContact O-CB 3.32Å; V1065-N1068 PolarHBondContact O-N 3.13Å; D1066-N1068 VanDerWaalsContact C-N 3.29Å; D1066-N1068 PolarHBondContact O-N 2.98Å; D1066-N1068 PolarHBondContact O-ND2 3.1Å; N1068-E1070 HydrophobicContact CB-CG 4.22Å; N1068-E1070 PolarHBondContact O-N 2.87Å
1069	E	85	Confident	83.1	Confident	91 Å²	91	63.7 Å²	63.7	43%	0.425	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	105.9	178.1	-167.4	179.5	155.7	0	0	111.4	R1050 S1062 R1063 I1064 G1067 K1071 I1072	R1050-E1069 IonicContact NH1-OE2 2.99Å; S1062-E1069 VanDerWaalsContact CB-CG 3.49Å; S1062-E1069 VanDerWaalsContact CB-OE1 3.27Å; S1062-E1069 WeakPolarHBondContact CB-OE1 3.27Å; S1062-E1069 PolarHBondContact OG-OE1 2.97Å; R1063-E1069 CarbonylContact O-C 3.47Å; R1063-E1069 WeakPolarHBondContact O-CA 3.39Å; I1064-E1069 HydrophobicContact CG1-CB 4.23Å; I1064-E1069 HydrophobicContact CG1-CG 4.07Å; G1067-E1069 PolarHBondContact O-N 2.98Å; E1069-K1071 WeakPolarHBondContact OE1-CE 3.21Å; E1069-I1072 HydrophobicContact CG-CD1 3.91Å; E1069-I1072 HydrophobicContact CG-CG1 3.83Å; E1069-I1072 WeakPolarHBondContact OE1-CD1 3.38Å
1070	E	80.3	Confident	82.1	Confident	100.6 Å²	100.6	68.9 Å²	68.9	47%	0.47	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	86.7	-178.4	-138.2	-165.7	166.4	0	0	112.3	S1062 R1063 V1065 N1068 I1072	S1062-E1070 CarbonylContact C-O 3.49Å; S1062-E1070 VanDerWaalsContact CA-O 3.27Å; S1062-E1070 WeakPolarHBondContact CA-O 3.35Å; R1063-E1070 HydrophobicContact CB-CB 4.38Å; R1063-E1070 IonicContact CZ-OE2 3.2Å; R1063-E1070 PolarHBondContact N-O 3Å; R1063-E1070 IonicContact NE-OE2 3.36Å; R1063-E1070 PolarHBondContact NE-OE2 3.16Å; R1063-E1070 IonicContact NH1-OE2 2.84Å; R1063-E1070 PolarHBondContact NH1-OE2 3.43Å; R1063-E1070 IonicContact NH2-OE1 3.13Å; R1063-E1070 PolarHBondContact NH2-OE1 2.69Å; R1063-E1070 IonicContact NH2-OE2 3.12Å; R1063-E1070 PolarHBondContact NH2-OE2 2.89Å; R1063-E1070 PolarHBondContact O-N 3.07Å; V1065-E1070 HydrophobicContact CB-CG 4.48Å; N1068-E1070 HydrophobicContact CB-CG 4.22Å; N1068-E1070 PolarHBondContact O-N 2.87Å; E1070-I1072 PolarHBondContact O-N 2.91Å; E1070-I1072 VanDerWaalsContact O-N 3.12Å
1071	K	79.5	Confident	80.8	Confident	127.6 Å²	127.6	75.5 Å²	75.5	56%	0.555	38%	0.38	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.5	112.8	-179.6	-103.2	169.1	-175.4	163.5	0	110.7	T1060 S1062 R1063 E1069 T1073 F1111 P1112	T1060-K1071 HydrophobicContact CG2-CB 4.32Å; T1060-K1071 HydrophobicContact CG2-CD 4.22Å; T1060-K1071 HydrophobicContact CG2-CG 3.86Å; S1062-K1071 CarbonylContact C-O 3.56Å; S1062-K1071 VanDerWaalsContact CA-O 3.27Å; S1062-K1071 WeakPolarHBondContact CA-O 3.32Å; S1062-K1071 WeakPolarHBondContact OG-CG 3.42Å; R1063-K1071 HydrophobicContact CB-CB 4.19Å; R1063-K1071 PolarHBondContact N-O 3.15Å; E1069-K1071 WeakPolarHBondContact OE1-CE 3.21Å; K1071-T1073 PolarHBondContact O-N 2.82Å; K1071-F1111 HydrophobicContact CB-CE2 4.15Å; K1071-F1111 HydrophobicContact CB-CZ 3.97Å; K1071-F1111 HydrophobicContact CD-CE2 4.2Å; K1071-F1111 HydrophobicContact CG-CE2 3.9Å; K1071-F1111 HydrophobicContact CG-CZ 4.25Å; K1071-F1111 WeakPolarHBondContact O-CZ 3.38Å; K1071-P1112 HydrophobicContact CD-CG 3.81Å
1072	I	79.6	Confident	79.3	Confident	63 Å²	63	78.7 Å²	78.7	32%	0.323	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	-46.9	-179.7	-58.7	158.5	0	0	0	110.4	L1049 T1060 L1061 R1063 E1069 E1070 Q1074 F1111	L1049-I1072 HydrophobicContact CD1-CD1 3.58Å; T1060-I1072 HydrophobicContact CG2-CB 4.49Å; T1060-I1072 HydrophobicContact CG2-CG1 4.3Å; T1060-I1072 HydrophobicContact CG2-CG2 3.7Å; L1061-I1072 HydrophobicContact CD2-CD1 4.4Å; L1061-I1072 HydrophobicContact CG-CD1 4.02Å; L1061-I1072 CarbonylContact O-C 3.54Å; L1061-I1072 WeakPolarHBondContact O-CA 3.37Å; L1061-I1072 WeakPolarHBondContact O-CB 3.29Å; L1061-I1072 PolarHBondContact O-N 2.95Å; R1063-I1072 HydrophobicContact CB-CD1 3.84Å; R1063-I1072 HydrophobicContact CB-CG1 3.91Å; E1069-I1072 HydrophobicContact CG-CD1 3.91Å; E1069-I1072 HydrophobicContact CG-CG1 3.83Å; E1069-I1072 WeakPolarHBondContact OE1-CD1 3.38Å; E1070-I1072 PolarHBondContact O-N 2.91Å; E1070-I1072 VanDerWaalsContact O-N 3.12Å; I1072-Q1074 HydrophobicContact CG2-CG 4.01Å; I1072-F1111 HydrophobicContact CD1-CD2 3.69Å; I1072-F1111 HydrophobicContact CD1-CE1 4.38Å; I1072-F1111 HydrophobicContact CD1-CE2 3.36Å; I1072-F1111 VanDerWaalsContact CD1-CE2 3.42Å; I1072-F1111 HydrophobicContact CD1-CG 4.33Å; I1072-F1111 HydrophobicContact CD1-CZ 3.76Å; I1072-F1111 HydrophobicContact CG1-CD2 4.21Å; I1072-F1111 HydrophobicContact CG1-CE2 4.36Å; I1072-F1111 HydrophobicContact CG2-CB 4.01Å; I1072-F1111 HydrophobicContact CG2-CD1 3.76Å; I1072-F1111 HydrophobicContact CG2-CD2 4.17Å; I1072-F1111 HydrophobicContact CG2-CE1 4.28Å; I1072-F1111 HydrophobicContact CG2-CG 3.71Å
1073	T	82.9	Confident	78.2	Confident	38.8 Å²	38.8	79.8 Å²	79.8	24%	0.238	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	141	174.7	-135.8	0	0	0	0	110.9	T1060 L1061 K1071 F1075 F1111	T1060-T1073 WeakPolarHBondContact CA-O 3.2Å; L1061-T1073 HydrophobicContact CB-CG2 3.87Å; L1061-T1073 HydrophobicContact CD2-CG2 4.09Å; L1061-T1073 PolarHBondContact N-O 3.02Å; L1061-T1073 PolarHBondContact O-N 3.02Å; K1071-T1073 PolarHBondContact O-N 2.82Å; T1073-F1075 HydrophobicContact CG2-CD1 4.19Å; T1073-F1075 HydrophobicContact CG2-CE1 4.39Å; T1073-F1111 VanDerWaalsContact OG1-CD2 3.29Å; T1073-F1111 WeakPolarHBondContact OG1-CD2 3.39Å; T1073-F1111 WeakPolarHBondContact OG1-CE2 3.44Å
1074	Q	85.6	Confident	77.5	Confident	123.6 Å²	123.6	78.7 Å²	78.7	58%	0.578	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109	141.4	169.7	-70.2	-172.1	-19.7	0	0	111.3	P1058 W1059 T1060 I1072	P1058-Q1074 HydrophobicContact CB-CB 4.32Å; W1059-Q1074 CarbonylContact O-C 3.56Å; W1059-Q1074 VanDerWaalsContact O-CA 3.25Å; W1059-Q1074 WeakPolarHBondContact O-CA 3.25Å; T1060-Q1074 HydrophobicContact CG2-CG 4.01Å; T1060-Q1074 PolarHBondContact OG1-NE2 3.12Å; I1072-Q1074 HydrophobicContact CG2-CG 4.01Å
1075	F	84.6	Confident	76.9	Confident	18.8 Å²	18.8	84.2 Å²	84.2	8%	0.082	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	149.1	179.1	54.4	-94.4	0	0	0	111.5	L1051 P1058 W1059 L1061 T1073 P1077 L1100 V1102 I1107	L1051-F1075 HydrophobicContact CD1-CE1 4.11Å; L1051-F1075 HydrophobicContact CD1-CE2 4.18Å; L1051-F1075 HydrophobicContact CD1-CZ 3.66Å; P1058-F1075 CarbonylContact C-O 3.55Å; P1058-F1075 WeakPolarHBondContact CA-O 3.5Å; W1059-F1075 WeakPolarHBondContact CA-O 3.12Å; W1059-F1075 HydrophobicContact CB-CD2 4.12Å; W1059-F1075 HydrophobicContact CB-CE1 4.42Å; W1059-F1075 HydrophobicContact CB-CE2 3.8Å; W1059-F1075 HydrophobicContact CB-CZ 4.16Å; W1059-F1075 WeakPolarHBondContact CB-O 3.5Å; W1059-F1075 HydrophobicContact CD2-CE2 4.15Å; W1059-F1075 AromaticContact CE3-CE2 3.61Å; W1059-F1075 HydrophobicContact CE3-CE2 3.8Å; W1059-F1075 AromaticContact CE3-CZ 3.95Å; W1059-F1075 HydrophobicContact CE3-CZ 4.03Å; W1059-F1075 HydrophobicContact CG-CE2 4.34Å; W1059-F1075 HydrophobicContact CZ3-CE2 4.44Å; W1059-F1075 PolarHBondContact N-O 2.97Å; W1059-F1075 PolarHBondContact O-N 2.86Å; L1061-F1075 HydrophobicContact CB-CE1 4.04Å; L1061-F1075 HydrophobicContact CB-CZ 4.1Å; T1073-F1075 HydrophobicContact CG2-CD1 4.19Å; T1073-F1075 HydrophobicContact CG2-CE1 4.39Å; F1075-P1077 HydrophobicContact CD2-CB 4.42Å; F1075-P1077 HydrophobicContact CD2-CG 4.41Å; F1075-P1077 HydrophobicContact CE2-CB 4.38Å; F1075-P1077 HydrophobicContact CE2-CG 4.35Å; F1075-P1077 WeakPolarHBondContact O-CD 3.28Å; F1075-L1100 HydrophobicContact CE1-CD2 4.23Å; F1075-L1100 HydrophobicContact CE2-CD2 3.9Å; F1075-L1100 HydrophobicContact CZ-CD2 3.7Å; F1075-L1100 VanDerWaalsContact CZ-CD2 3.47Å; F1075-V1102 HydrophobicContact CE2-CG2 4.15Å; F1075-V1102 HydrophobicContact CZ-CG2 4.23Å; F1075-I1107 HydrophobicContact CB-CG2 3.6Å; F1075-I1107 HydrophobicContact CD1-CB 4.41Å; F1075-I1107 HydrophobicContact CD1-CG2 3.75Å; F1075-I1107 HydrophobicContact CD2-CB 4.32Å; F1075-I1107 HydrophobicContact CD2-CD1 3.29Å; F1075-I1107 HydrophobicContact CD2-CG1 4.19Å; F1075-I1107 HydrophobicContact CD2-CG2 3.46Å; F1075-I1107 VanDerWaalsContact CD2-CG2 3.47Å; F1075-I1107 HydrophobicContact CE1-CB 4.5Å; F1075-I1107 HydrophobicContact CE1-CG2 4.27Å; F1075-I1107 HydrophobicContact CE2-CB 4.38Å; F1075-I1107 HydrophobicContact CE2-CD1 3.36Å; F1075-I1107 HydrophobicContact CE2-CG1 4.19Å; F1075-I1107 HydrophobicContact CE2-CG2 4.09Å; F1075-I1107 HydrophobicContact CG-CB 4.28Å; F1075-I1107 HydrophobicContact CG-CD1 4.2Å; F1075-I1107 HydrophobicContact CG-CG1 4.35Å; F1075-I1107 HydrophobicContact CG-CG2 3.44Å; F1075-I1107 HydrophobicContact CZ-CB 4.48Å; F1075-I1107 HydrophobicContact CZ-CD1 4.34Å; F1075-I1107 HydrophobicContact CZ-CG2 4.38Å
1076	K	80.6	Confident	76.9	Confident	163.2 Å²	163.2	85.3 Å²	85.3	71%	0.71	43%	0.432	S	S	*	.			trans	-107.5	103.4	174.3	-170	175.5	-178.5	178.5	0	109.1
1077	P	75.8	Confident	77.1	Confident	18.2 Å²	18.2	79.9 Å²	79.9	12%	0.118	40%	0.404	C	S	.	.			trans	-71.2	138.9	177.8	30	-32.7	0	0	0	110.1	W1059 F1075 L1079 V1102 I1107	W1059-P1077 HydrophobicContact CD2-CG 3.52Å; W1059-P1077 VanDerWaalsContact CD2-CG 3.47Å; W1059-P1077 VanDerWaalsContact CE2-CG 3.45Å; W1059-P1077 HydrophobicContact CE3-CG 3.79Å; W1059-P1077 HydrophobicContact CG-CG 4.1Å; W1059-P1077 HydrophobicContact CH2-CG 3.87Å; W1059-P1077 HydrophobicContact CZ2-CG 3.64Å; W1059-P1077 VanDerWaalsContact CZ2-CG 3.49Å; W1059-P1077 HydrophobicContact CZ3-CB 4.48Å; W1059-P1077 HydrophobicContact CZ3-CG 3.95Å; F1075-P1077 HydrophobicContact CD2-CB 4.42Å; F1075-P1077 HydrophobicContact CD2-CG 4.41Å; F1075-P1077 HydrophobicContact CE2-CB 4.38Å; F1075-P1077 HydrophobicContact CE2-CG 4.35Å; F1075-P1077 WeakPolarHBondContact O-CD 3.28Å; P1077-L1079 VanDerWaalsContact C-N 3.32Å; P1077-L1079 HydrophobicContact CB-CG 4.29Å; P1077-L1079 HydrophobicContact CG-CD1 4.39Å; P1077-L1079 HydrophobicContact CG-CG 4.31Å; P1077-L1079 PolarHBondContact O-N 3.06Å; P1077-L1079 VanDerWaalsContact O-N 3.14Å; P1077-V1102 HydrophobicContact CB-CG1 4.31Å; P1077-I1107 HydrophobicContact CB-CD1 3.84Å; P1077-I1107 HydrophobicContact CG-CD1 4.46Å
1078	N	73.5	Confident	77.5	Confident	118.8 Å²	118.8	78.3 Å²	78.3	64%	0.635	38%	0.381	S	S	*	.			trans	-81.9	81.3	173.6	-152.6	-6.7	0	0	0	109.5	W894 K946 I948	W894-N1078 VanDerWaalsContact CE2-ND2 3.33Å; W894-N1078 HydrophobicContact CH2-CB 4Å; W894-N1078 HydrophobicContact CZ2-CB 3.22Å; W894-N1078 WeakPolarHBondContact CZ2-ND2 3.41Å; K946-N1078 PolarHBondContact NZ-O 2.73Å; I948-N1078 WeakPolarHBondContact CD1-O 3.32Å
1079	L	74	Confident	78	Confident	39 Å²	39	72.6 Å²	72.6	20%	0.204	35%	0.351	C	S	.	.			trans	-89.1	130.2	173.9	-64	179.3	0	0	0	110	W1059 P1077 D1083 L1084 I1087 V1102 N1103	W1059-L1079 HydrophobicContact CH2-CD1 3.74Å; W1059-L1079 HydrophobicContact CZ2-CD1 3.5Å; W1059-L1079 VanDerWaalsContact CZ2-CD1 3.47Å; W1059-L1079 HydrophobicContact CZ2-CG 4.46Å; P1077-L1079 VanDerWaalsContact C-N 3.32Å; P1077-L1079 HydrophobicContact CB-CG 4.29Å; P1077-L1079 HydrophobicContact CG-CD1 4.39Å; P1077-L1079 HydrophobicContact CG-CG 4.31Å; P1077-L1079 PolarHBondContact O-N 3.06Å; P1077-L1079 VanDerWaalsContact O-N 3.14Å; L1079-D1083 WeakPolarHBondContact CA-OD2 3.29Å; L1079-D1083 HydrophobicContact CB-CB 4.25Å; L1079-D1083 HydrophobicContact CD2-CB 4.14Å; L1079-L1084 HydrophobicContact CB-CD2 4.32Å; L1079-L1084 HydrophobicContact CD1-CD2 4.18Å; L1079-I1087 HydrophobicContact CD1-CD1 3.79Å; L1079-I1087 HydrophobicContact CD1-CG1 4.37Å; L1079-I1087 HydrophobicContact CD2-CD1 4.31Å; L1079-I1087 HydrophobicContact CD2-CG1 4.34Å; L1079-I1087 HydrophobicContact CD2-CG2 4.21Å; L1079-V1102 HydrophobicContact CD2-CG1 4.08Å; L1079-N1103 WeakPolarHBondContact CD2-ND2 3.33Å
1080	R	70.9	Confident	78.3	Confident	113.6 Å²	113.6	69.2 Å²	69.2	43%	0.429	34%	0.336	S	S	.	.			trans	-86.4	160.8	167.8	-58.3	162.7	-164.7	-156.2	2.3	109.6	Q503 R911 I948 I949 G950 T1082 D1083 L1084 K1332	Q503-R1080 PolarHBondContact O-NH1 3.44Å; R911-R1080 VanDerWaalsContact CD-NH2 3.34Å; I948-R1080 PolarHBondContact O-NH1 2.99Å; I949-R1080 WeakPolarHBondContact O-CB 3.28Å; I949-R1080 VanDerWaalsContact O-CD 3.29Å; I949-R1080 WeakPolarHBondContact O-CD 3.14Å; I949-R1080 PolarHBondContact O-NH1 3.31Å; G950-R1080 VanDerWaalsContact N-NH1 3.18Å; R1080-T1082 VanDerWaalsContact CB-OG1 3.3Å; R1080-T1082 WeakPolarHBondContact CB-OG1 3.4Å; R1080-T1082 PolarHBondContact O-N 2.97Å; R1080-T1082 VanDerWaalsContact O-N 3.11Å; R1080-D1083 WeakPolarHBondContact CB-OD2 3.32Å; R1080-D1083 IonicContact CZ-OD1 3.95Å; R1080-D1083 PolarHBondContact N-OD2 2.99Å; R1080-D1083 IonicContact NE-OD1 3.42Å; R1080-D1083 IonicContact NE-OD2 3.53Å; R1080-D1083 PolarHBondContact NE-OD2 2.89Å; R1080-D1083 IonicContact NH2-OD1 3.64Å; R1080-D1083 PolarHBondContact NH2-OD1 2.94Å; R1080-D1083 WeakPolarHBondContact O-CB 3.21Å; R1080-D1083 PolarHBondContact O-N 2.83Å; R1080-L1084 PolarHBondContact O-N 2.87Å; R1080-K1332 WeakPolarHBondContact CD-O 3.27Å; R1080-K1332 PolarHBondContact NH1-O 3.3Å
1081	M	62.8	Low	78.7	Confident	158.8 Å²	158.8	64.5 Å²	64.5	78%	0.782	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-26.4	175.6	-122.5	28.8	-160.8	0	0	113.3	D1083 L1084	M1081-D1083 VanDerWaalsContact C-N 3.32Å; M1081-D1083 PolarHBondContact O-N 2.98Å; M1081-L1084 HydrophobicContact CE-CD1 3.95Å; M1081-L1084 HydrophobicContact CG-CD1 4.28Å; M1081-L1084 WeakPolarHBondContact O-CB 3.24Å; M1081-L1084 PolarHBondContact O-N 3.05Å; M1081-L1084 HydrophobicContact SD-CD1 3.85Å
1082	T	59.8	Low	79.1	Confident	67.8 Å²	67.8	60.2 Å²	60.2	42%	0.416	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-32.8	174.2	51.7	0	0	0	0	113.3	I949 G950 G951 V953 F956 R1080 L1084 K1085 T1330	I949-T1082 PolarHBondContact O-OG1 2.86Å; G950-T1082 VanDerWaalsContact C-CG2 3.49Å; G950-T1082 WeakPolarHBondContact CA-OG1 3.43Å; G950-T1082 PolarHBondContact N-OG1 2.86Å; G951-T1082 WeakPolarHBondContact O-CG2 3.43Å; V953-T1082 HydrophobicContact CB-CG2 3.41Å; V953-T1082 VanDerWaalsContact CB-CG2 3.41Å; V953-T1082 HydrophobicContact CG2-CG2 3.57Å; F956-T1082 WeakPolarHBondContact CE1-O 3.45Å; R1080-T1082 VanDerWaalsContact CB-OG1 3.3Å; R1080-T1082 WeakPolarHBondContact CB-OG1 3.4Å; R1080-T1082 PolarHBondContact O-N 2.97Å; R1080-T1082 VanDerWaalsContact O-N 3.11Å; T1082-L1084 VanDerWaalsContact C-N 3.34Å; T1082-L1084 PolarHBondContact O-N 2.87Å; T1082-K1085 WeakPolarHBondContact O-CB 3.24Å; T1082-K1085 PolarHBondContact O-N 2.93Å; T1082-T1330 WeakPolarHBondContact CG2-O 3.42Å; T1082-T1330 WeakPolarHBondContact CG2-OG1 3.47Å
1083	D	67.4	Low	79.4	Confident	23 Å²	23	58.1 Å²	58.1	12%	0.123	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-78.2	-25	-170.9	-52.2	-22.7	0	0	0	110.7	I948 L1079 R1080 M1081 K1085 N1086 I1087 N1103	I948-D1083 VanDerWaalsContact CG2-CG 3.46Å; I948-D1083 VanDerWaalsContact CG2-OD1 3.32Å; I948-D1083 WeakPolarHBondContact CG2-OD1 3.34Å; I948-D1083 WeakPolarHBondContact CG2-OD2 3.35Å; L1079-D1083 WeakPolarHBondContact CA-OD2 3.29Å; L1079-D1083 HydrophobicContact CB-CB 4.25Å; L1079-D1083 HydrophobicContact CD2-CB 4.14Å; R1080-D1083 WeakPolarHBondContact CB-OD2 3.32Å; R1080-D1083 IonicContact CZ-OD1 3.95Å; R1080-D1083 PolarHBondContact N-OD2 2.99Å; R1080-D1083 IonicContact NE-OD1 3.42Å; R1080-D1083 IonicContact NE-OD2 3.53Å; R1080-D1083 PolarHBondContact NE-OD2 2.89Å; R1080-D1083 IonicContact NH2-OD1 3.64Å; R1080-D1083 PolarHBondContact NH2-OD1 2.94Å; R1080-D1083 WeakPolarHBondContact O-CB 3.21Å; R1080-D1083 PolarHBondContact O-N 2.83Å; M1081-D1083 VanDerWaalsContact C-N 3.32Å; M1081-D1083 PolarHBondContact O-N 2.98Å; D1083-K1085 PolarHBondContact O-N 3.05Å; D1083-K1085 VanDerWaalsContact O-N 3.1Å; D1083-N1086 CarbonylContact O-C 3.54Å; D1083-N1086 WeakPolarHBondContact O-CA 3.49Å; D1083-N1086 PolarHBondContact O-N 3.02Å; D1083-N1086 VanDerWaalsContact O-O 3.05Å; D1083-I1087 VanDerWaalsContact O-CG1 3.26Å; D1083-I1087 WeakPolarHBondContact O-CG1 3.34Å; D1083-I1087 PolarHBondContact O-N 3Å; D1083-N1103 WeakPolarHBondContact CB-ND2 3.31Å; D1083-N1103 VanDerWaalsContact CG-ND2 3.33Å; D1083-N1103 PolarHBondContact OD1-ND2 2.88Å; D1083-N1103 PolarHBondContact OD2-ND2 2.78Å; D1083-N1103 VanDerWaalsContact OD2-ND2 3.12Å
1084	L	75.5	Confident	79.1	Confident	39.8 Å²	39.8	60.2 Å²	60.2	21%	0.208	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-58.6	-20.2	177.6	-52.9	-177.5	0	0	0	113.3	A1029 L1030 L1055 L1079 R1080 M1081 T1082 I1087	A1029-L1084 CarbonylContact C-O 3.55Å; A1029-L1084 WeakPolarHBondContact CA-O 3.47Å; L1030-L1084 HydrophobicContact CD1-CD2 4.21Å; L1030-L1084 PolarHBondContact N-O 2.94Å; L1030-L1084 VanDerWaalsContact N-O 3.11Å; L1055-L1084 HydrophobicContact CD1-CD1 4.39Å; L1055-L1084 HydrophobicContact CD1-CD2 4.31Å; L1055-L1084 HydrophobicContact CD2-CD2 4.45Å; L1079-L1084 HydrophobicContact CB-CD2 4.32Å; L1079-L1084 HydrophobicContact CD1-CD2 4.18Å; R1080-L1084 PolarHBondContact O-N 2.87Å; M1081-L1084 HydrophobicContact CE-CD1 3.95Å; M1081-L1084 HydrophobicContact CG-CD1 4.28Å; M1081-L1084 WeakPolarHBondContact O-CB 3.24Å; M1081-L1084 PolarHBondContact O-N 3.05Å; M1081-L1084 HydrophobicContact SD-CD1 3.85Å; T1082-L1084 VanDerWaalsContact C-N 3.34Å; T1082-L1084 PolarHBondContact O-N 2.87Å; L1084-I1087 HydrophobicContact CD2-CD1 4.27Å
1085	K	75.4	Confident	78.6	Confident	135.6 Å²	135.6	60.7 Å²	60.7	59%	0.59	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-79.3	-20.5	175	-65.7	-167.6	178.6	-170.4	0	113.9	N914 E954 A1029 T1082 D1083	N914-K1085 PolarHBondContact ND2-NZ 3.04Å; N914-K1085 WeakPolarHBondContact OD1-CD 3.45Å; E954-K1085 WeakPolarHBondContact O-CD 3.43Å; E954-K1085 PolarHBondContact O-NZ 2.95Å; E954-K1085 WeakPolarHBondContact OE1-CE 3.45Å; E954-K1085 IonicContact OE1-NZ 2.62Å; E954-K1085 PolarHBondContact OE1-NZ 2.87Å; E954-K1085 IonicContact OE2-NZ 2.7Å; E954-K1085 PolarHBondContact OE2-NZ 2.85Å; A1029-K1085 VanDerWaalsContact CB-O 3.27Å; A1029-K1085 WeakPolarHBondContact CB-O 3.29Å; T1082-K1085 WeakPolarHBondContact O-CB 3.24Å; T1082-K1085 PolarHBondContact O-N 2.93Å; D1083-K1085 PolarHBondContact O-N 3.05Å; D1083-K1085 VanDerWaalsContact O-N 3.1Å
1086	N	82.9	Confident	78.2	Confident	53.8 Å²	53.8	61.8 Å²	61.8	29%	0.288	32%	0.318	S	S	.	.			trans	-163.8	106.2	169.4	-174.1	27.9	0	0	0	110.3	N959 N1027 V1028 D1083 P1088	N959-N1086 PolarHBondContact ND2-ND2 3.26Å; N959-N1086 PolarHBondContact ND2-OD1 2.72Å; N1027-N1086 WeakPolarHBondContact CA-OD1 3.26Å; N1027-N1086 VanDerWaalsContact CB-OD1 3.31Å; N1027-N1086 WeakPolarHBondContact CB-OD1 3.23Å; N1027-N1086 PolarHBondContact OD1-ND2 3Å; V1028-N1086 CarbonylContact O-C 3.48Å; V1028-N1086 WeakPolarHBondContact O-CA 3.32Å; D1083-N1086 CarbonylContact O-C 3.54Å; D1083-N1086 WeakPolarHBondContact O-CA 3.49Å; D1083-N1086 PolarHBondContact O-N 3.02Å; D1083-N1086 VanDerWaalsContact O-O 3.05Å; N1086-P1088 VanDerWaalsContact O-CD 3.24Å; N1086-P1088 WeakPolarHBondContact O-CD 3.33Å
1087	I	85.8	Confident	78.3	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	97.3	175.3	-50.2	170.9	0	0	0	107.9	V1028 L1030 F1037 W1059 L1079 D1083 L1084 L1089 V1102	V1028-I1087 HydrophobicContact CB-CB 4.46Å; V1028-I1087 PolarHBondContact N-O 3.03Å; V1028-I1087 WeakPolarHBondContact O-CB 3.47Å; V1028-I1087 PolarHBondContact O-N 2.99Å; L1030-I1087 HydrophobicContact CD1-CD1 3.72Å; L1030-I1087 HydrophobicContact CG-CD1 4.09Å; F1037-I1087 HydrophobicContact CE1-CD1 4.05Å; F1037-I1087 HydrophobicContact CZ-CD1 4.26Å; W1059-I1087 HydrophobicContact CH2-CD1 4.44Å; W1059-I1087 HydrophobicContact CH2-CG2 4.36Å; L1079-I1087 HydrophobicContact CD1-CD1 3.79Å; L1079-I1087 HydrophobicContact CD1-CG1 4.37Å; L1079-I1087 HydrophobicContact CD2-CD1 4.31Å; L1079-I1087 HydrophobicContact CD2-CG1 4.34Å; L1079-I1087 HydrophobicContact CD2-CG2 4.21Å; D1083-I1087 VanDerWaalsContact O-CG1 3.26Å; D1083-I1087 WeakPolarHBondContact O-CG1 3.34Å; D1083-I1087 PolarHBondContact O-N 3Å; L1084-I1087 HydrophobicContact CD2-CD1 4.27Å; I1087-L1089 HydrophobicContact CG2-CD2 3.82Å; I1087-L1089 HydrophobicContact CG2-CG 4.29Å; I1087-L1089 PolarHBondContact O-N 3Å; I1087-V1102 HydrophobicContact CG2-CG1 3.91Å
1088	P	85.4	Confident	78.7	Confident	30.4 Å²	30.4	56.9 Å²	56.9	20%	0.197	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	124.6	170.5	19.1	-23.2	0	0	0	111	T1025 T1026 N1027 N1086 V1102 N1103 F1341	T1025-P1088 HydrophobicContact CG2-CB 4.19Å; T1026-P1088 CarbonylContact O-C 3.49Å; N1027-P1088 WeakPolarHBondContact OD1-CB 3.24Å; N1086-P1088 VanDerWaalsContact O-CD 3.24Å; N1086-P1088 WeakPolarHBondContact O-CD 3.33Å; P1088-V1102 CarbonylContact O-C 3.6Å; P1088-V1102 WeakPolarHBondContact O-CA 3.16Å; P1088-N1103 VanDerWaalsContact CD-OD1 3.24Å; P1088-N1103 WeakPolarHBondContact CD-OD1 3.22Å; P1088-N1103 HydrophobicContact CG-CB 4.33Å; P1088-N1103 WeakPolarHBondContact O-CA 3.24Å; P1088-N1103 PolarHBondContact O-N 2.84Å; P1088-F1341 HydrophobicContact CB-CD2 4.42Å; P1088-F1341 HydrophobicContact CB-CE2 3.52Å; P1088-F1341 HydrophobicContact CB-CZ 3.75Å; P1088-F1341 HydrophobicContact CG-CD2 4.3Å; P1088-F1341 HydrophobicContact CG-CE2 3.72Å; P1088-F1341 HydrophobicContact CG-CZ 4.45Å
1089	L	90.2	Very high	79.4	Confident	0 Å²	0	53 Å²	53	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	105.8	177.8	-55.9	171.2	0	0	0	108.2	T1025 T1026 V1028 F1037 V1039 L1051 W1059 I1087 F1091 L1100 S1101 V1102	T1025-L1089 CarbonylContact C-O 3.54Å; T1025-L1089 WeakPolarHBondContact CA-O 3.41Å; T1026-L1089 PolarHBondContact N-O 3.12Å; T1026-L1089 WeakPolarHBondContact O-CB 3.31Å; T1026-L1089 PolarHBondContact O-N 2.89Å; V1028-L1089 HydrophobicContact CB-CD1 4.45Å; V1028-L1089 HydrophobicContact CG2-CD1 3.71Å; V1028-L1089 HydrophobicContact CG2-CG 4.46Å; F1037-L1089 HydrophobicContact CE2-CD1 3.77Å; F1037-L1089 HydrophobicContact CZ-CD1 4.2Å; V1039-L1089 HydrophobicContact CG2-CD1 3.78Å; L1051-L1089 HydrophobicContact CD2-CD1 4.11Å; L1051-L1089 HydrophobicContact CD2-CD2 4.26Å; W1059-L1089 HydrophobicContact CH2-CD2 4.42Å; W1059-L1089 HydrophobicContact CZ3-CD2 4.06Å; I1087-L1089 HydrophobicContact CG2-CD2 3.82Å; I1087-L1089 HydrophobicContact CG2-CG 4.29Å; I1087-L1089 PolarHBondContact O-N 3Å; L1089-F1091 HydrophobicContact CB-CE2 4.35Å; L1089-L1100 HydrophobicContact CB-CD1 4.34Å; L1089-S1101 CarbonylContact C-O 3.56Å; L1089-S1101 WeakPolarHBondContact CA-O 3.25Å; L1089-V1102 HydrophobicContact CD2-CB 4.22Å; L1089-V1102 HydrophobicContact CD2-CG1 3.91Å; L1089-V1102 HydrophobicContact CD2-CG2 3.73Å
1090	T	90.7	Very high	80.2	Confident	19 Å²	19	51.2 Å²	51.2	12%	0.117	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	120.6	179	-48	0	0	0	0	110.7	T1023 A1024 T1025 T1092 L1100 S1101 F1341 R1379	T1023-T1090 HydrophobicContact CG2-CG2 4.39Å; A1024-T1090 CarbonylContact O-C 2.83Å; A1024-T1090 WeakPolarHBondContact O-CA 3.48Å; T1025-T1090 VanDerWaalsContact CG2-OG1 3.31Å; T1025-T1090 WeakPolarHBondContact CG2-OG1 3.42Å; T1025-T1090 WeakPolarHBondContact OG1-CB 3.19Å; T1025-T1090 WeakPolarHBondContact OG1-CG2 3.37Å; T1025-T1090 PolarHBondContact OG1-OG1 3.06Å; T1025-T1090 VanDerWaalsContact OG1-OG1 3.05Å; T1090-T1092 PolarHBondContact O-N 3.03Å; T1090-L1100 CarbonylContact O-C 3.45Å; T1090-L1100 WeakPolarHBondContact O-CA 3.26Å; T1090-S1101 WeakPolarHBondContact CB-OG 3.36Å; T1090-S1101 PolarHBondContact N-O 3.07Å; T1090-S1101 PolarHBondContact O-N 3.02Å; T1090-S1101 PolarHBondContact OG1-OG 2.76Å; T1090-F1341 HydrophobicContact CG2-CD1 4.45Å; T1090-F1341 HydrophobicContact CG2-CE1 3.73Å; T1090-F1341 HydrophobicContact CG2-CZ 4.07Å; T1090-F1341 WeakPolarHBondContact OG1-CE1 3.25Å; T1090-F1341 WeakPolarHBondContact OG1-CE2 3.21Å; T1090-F1341 WeakPolarHBondContact OG1-CZ 3.07Å; T1090-R1379 PolarHBondContact OG1-NH2 2.84Å
1091	F	89.9	Confident	81	Confident	1.2 Å²	1.2	46 Å²	46	1%	0.005	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	105.4	165.1	-57.7	-89.6	0	0	0	107.9	T1023 A1024 V1039 V1041 L1049 L1061 L1089 V1098 Q1099 L1100 M1118	T1023-F1091 WeakPolarHBondContact CA-O 3.39Å; A1024-F1091 HydrophobicContact CB-CB 4.44Å; A1024-F1091 PolarHBondContact N-O 2.86Å; A1024-F1091 WeakPolarHBondContact O-CD2 3.22Å; A1024-F1091 PolarHBondContact O-N 3.06Å; V1039-F1091 HydrophobicContact CB-CZ 4.34Å; V1039-F1091 HydrophobicContact CG1-CE2 4.12Å; V1039-F1091 HydrophobicContact CG1-CZ 4.09Å; V1041-F1091 HydrophobicContact CG2-CD1 4.27Å; V1041-F1091 HydrophobicContact CG2-CD2 4.16Å; V1041-F1091 HydrophobicContact CG2-CE1 4.05Å; V1041-F1091 HydrophobicContact CG2-CE2 3.81Å; V1041-F1091 HydrophobicContact CG2-CG 4.26Å; V1041-F1091 HydrophobicContact CG2-CZ 3.74Å; L1049-F1091 HydrophobicContact CD2-CD1 3.71Å; L1049-F1091 HydrophobicContact CD2-CE1 3.82Å; L1049-F1091 HydrophobicContact CG-CE1 4.26Å; L1061-F1091 HydrophobicContact CD1-CE1 4.37Å; L1089-F1091 HydrophobicContact CB-CE2 4.35Å; F1091-V1098 HydrophobicContact CB-CG2 4.08Å; F1091-V1098 HydrophobicContact CD1-CG2 4.19Å; F1091-V1098 HydrophobicContact CG-CG2 4.31Å; F1091-Q1099 WeakPolarHBondContact CA-O 3.36Å; F1091-L1100 HydrophobicContact CD1-CD1 4.1Å; F1091-L1100 HydrophobicContact CE1-CD1 3.86Å; F1091-L1100 HydrophobicContact CE2-CD1 4.39Å; F1091-L1100 HydrophobicContact CG-CD1 4.43Å; F1091-L1100 HydrophobicContact CZ-CD1 4.04Å; F1091-M1118 HydrophobicContact CB-SD 4.06Å
1092	T	88.6	Confident	82.1	Confident	37.8 Å²	37.8	38.6 Å²	38.6	23%	0.232	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	120.8	174.7	-58	0	0	0	0	108.8	T1023 T1090 V1098 Q1099 R1379	T1023-T1092 HydrophobicContact CG2-CG2 4.27Å; T1090-T1092 PolarHBondContact O-N 3.03Å; T1092-V1098 CarbonylContact O-C 3.54Å; T1092-V1098 VanDerWaalsContact O-CA 3.28Å; T1092-V1098 WeakPolarHBondContact O-CA 3.38Å; T1092-Q1099 PolarHBondContact N-O 2.9Å; T1092-Q1099 PolarHBondContact O-N 3.06Å; T1092-R1379 PolarHBondContact OG1-NH1 2.86Å; T1092-R1379 PolarHBondContact OG1-NH2 2.93Å
1093	I	85.2	Confident	83.1	Confident	19.4 Å²	19.4	37.4 Å²	37.4	10%	0.099	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	120.9	-178.8	-63.4	173.2	0	0	0	108.9	L1020 P1021 K1022 M1043 F1097 V1098 L1113 M1118	L1020-I1093 HydrophobicContact CB-CG2 4.29Å; L1020-I1093 HydrophobicContact CD1-CG2 4.28Å; P1021-I1093 HydrophobicContact CG-CD1 4.38Å; P1021-I1093 VanDerWaalsContact O-CB 3.28Å; P1021-I1093 WeakPolarHBondContact O-CB 3.31Å; P1021-I1093 WeakPolarHBondContact O-CD1 3.17Å; K1022-I1093 WeakPolarHBondContact CG-O 3.12Å; K1022-I1093 PolarHBondContact O-N 3.02Å; M1043-I1093 HydrophobicContact CE-CD1 4.31Å; I1093-F1097 CarbonylContact C-O 3.58Å; I1093-F1097 VanDerWaalsContact CA-O 3.28Å; I1093-F1097 WeakPolarHBondContact CA-O 3.26Å; I1093-V1098 HydrophobicContact CG1-CB 4.25Å; I1093-V1098 HydrophobicContact CG1-CG2 4.28Å; I1093-L1113 HydrophobicContact CD1-CD2 4.04Å; I1093-L1113 HydrophobicContact CG1-CD1 4.34Å; I1093-L1113 HydrophobicContact CG1-CD2 4.37Å; I1093-L1113 HydrophobicContact CG2-CD1 3.91Å; I1093-L1113 HydrophobicContact CG2-CD2 4.17Å; I1093-L1113 HydrophobicContact CG2-CG 4.43Å; I1093-M1118 HydrophobicContact CD1-CB 4.19Å; I1093-M1118 HydrophobicContact CD1-CE 3.8Å; I1093-M1118 VanDerWaalsContact CD1-CE 3.5Å; I1093-M1118 HydrophobicContact CD1-CG 3.74Å; I1093-M1118 HydrophobicContact CD1-SD 4.38Å; I1093-M1118 HydrophobicContact CG1-CE 3.97Å; I1093-M1118 HydrophobicContact CG1-CG 4.48Å; I1093-M1118 HydrophobicContact CG1-SD 4.49Å
1094	E	77.4	Confident	83.5	Confident	83.4 Å²	83.4	37.7 Å²	37.7	39%	0.39	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	125	-177.6	-173.6	176.5	-123.2	0	0	110.3	K1022 G1096 F1097 K1110	K1022-E1094 IonicContact NZ-OE1 2.72Å; E1094-G1096 VanDerWaalsContact C-N 3.31Å; E1094-G1096 PolarHBondContact O-N 3.06Å; E1094-G1096 VanDerWaalsContact O-N 3.15Å; E1094-F1097 PolarHBondContact N-O 3.28Å; E1094-F1097 VanDerWaalsContact O-CB 3.32Å; E1094-F1097 WeakPolarHBondContact O-CB 3.28Å; E1094-F1097 PolarHBondContact O-N 3.13Å; E1094-F1097 VanDerWaalsContact O-O 3.13Å; E1094-K1110 IonicContact OE2-NZ 3.18Å; E1094-K1110 PolarHBondContact OE2-NZ 2.94Å
1095	N	74.8	Confident	83.5	Confident	133.6 Å²	133.6	40.5 Å²	40.5	71%	0.714	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.9	40.7	173.4	-56.2	-15.8	0	0	0	114.8	F1097 Q1168 L1169	N1095-F1097 VanDerWaalsContact C-N 3.3Å; N1095-F1097 VanDerWaalsContact O-CD2 3.26Å; N1095-F1097 WeakPolarHBondContact O-CD2 3.34Å; N1095-F1097 VanDerWaalsContact O-CE2 3.29Å; N1095-F1097 WeakPolarHBondContact O-CE2 3.35Å; N1095-F1097 PolarHBondContact O-N 3.17Å; N1095-Q1168 CarbonylContact C-O 3.32Å; N1095-Q1168 VanDerWaalsContact O-O 3.1Å; N1095-L1169 HydrophobicContact CB-CD1 4.07Å; N1095-L1169 WeakPolarHBondContact ND2-CD1 3.45Å
1096	G	75.1	Confident	83.7	Confident	40.8 Å²	40.8	37.1 Å²	37.1	42%	0.421	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	81	1.4	-178.5	0	0	0	0	0	115	E1094 P1112 L1113	E1094-G1096 VanDerWaalsContact C-N 3.31Å; E1094-G1096 PolarHBondContact O-N 3.06Å; E1094-G1096 VanDerWaalsContact O-N 3.15Å; G1096-P1112 CarbonylContact O-C 3.58Å; G1096-P1112 WeakPolarHBondContact O-CA 3.28Å; G1096-L1113 VanDerWaalsContact C-CD1 3.45Å; G1096-L1113 WeakPolarHBondContact O-CB 3.5Å; G1096-L1113 VanDerWaalsContact O-CD1 3.32Å; G1096-L1113 WeakPolarHBondContact O-CD1 3.35Å; G1096-L1113 WeakPolarHBondContact O-CG 3.46Å; G1096-L1113 PolarHBondContact O-N 3.05Å
1097	F	82.9	Confident	83.5	Confident	78.4 Å²	78.4	36.9 Å²	36.9	34%	0.344	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	149.6	174.3	-63.5	-90	0	0	0	111.4	I1093 E1094 N1095 K1110 F1111 P1112 L1113 S1166 K1167	I1093-F1097 CarbonylContact C-O 3.58Å; I1093-F1097 VanDerWaalsContact CA-O 3.28Å; I1093-F1097 WeakPolarHBondContact CA-O 3.26Å; E1094-F1097 PolarHBondContact N-O 3.28Å; E1094-F1097 VanDerWaalsContact O-CB 3.32Å; E1094-F1097 WeakPolarHBondContact O-CB 3.28Å; E1094-F1097 PolarHBondContact O-N 3.13Å; E1094-F1097 VanDerWaalsContact O-O 3.13Å; N1095-F1097 VanDerWaalsContact C-N 3.3Å; N1095-F1097 VanDerWaalsContact O-CD2 3.26Å; N1095-F1097 WeakPolarHBondContact O-CD2 3.34Å; N1095-F1097 VanDerWaalsContact O-CE2 3.29Å; N1095-F1097 WeakPolarHBondContact O-CE2 3.35Å; N1095-F1097 PolarHBondContact O-N 3.17Å; F1097-K1110 HydrophobicContact CB-CB 4.11Å; F1097-K1110 HydrophobicContact CB-CD 4.29Å; F1097-K1110 HydrophobicContact CB-CG 4.44Å; F1097-K1110 HydrophobicContact CD1-CB 4.2Å; F1097-K1110 HydrophobicContact CG-CB 4.28Å; F1097-K1110 HydrophobicContact CG-CD 4.43Å; F1097-F1111 CarbonylContact C-O 3.57Å; F1097-F1111 VanDerWaalsContact CA-O 3.3Å; F1097-F1111 WeakPolarHBondContact CA-O 3.33Å; F1097-F1111 VanDerWaalsContact CD1-O 3.28Å; F1097-F1111 WeakPolarHBondContact CD1-O 3.28Å; F1097-P1112 HydrophobicContact CD1-CB 4.13Å; F1097-P1112 HydrophobicContact CD1-CG 4.37Å; F1097-P1112 HydrophobicContact CE1-CB 4.1Å; F1097-P1112 HydrophobicContact CE1-CG 4.09Å; F1097-P1112 HydrophobicContact CZ-CB 4.23Å; F1097-P1112 HydrophobicContact CZ-CG 3.77Å; F1097-L1113 WeakPolarHBondContact O-CD1 3.23Å; F1097-S1166 WeakPolarHBondContact CZ-O 3.4Å; F1097-K1167 HydrophobicContact CE1-CG 3.71Å; F1097-K1167 VanDerWaalsContact CE2-CA 3.49Å; F1097-K1167 HydrophobicContact CE2-CB 3.87Å; F1097-K1167 HydrophobicContact CE2-CG 3.82Å; F1097-K1167 VanDerWaalsContact CZ-CA 3.41Å; F1097-K1167 HydrophobicContact CZ-CB 3.68Å; F1097-K1167 HydrophobicContact CZ-CD 4.46Å; F1097-K1167 HydrophobicContact CZ-CG 3.17Å
1098	V	85.6	Confident	83	Confident	1.2 Å²	1.2	37.1 Å²	37.1	1%	0.007	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	144.5	167.2	55.6	0	0	0	0	110	M1043 L1049 L1061 F1091 T1092 I1093 K1110 F1111 L1113	M1043-V1098 HydrophobicContact CE-CG2 4.24Å; L1049-V1098 HydrophobicContact CD1-CG1 4.02Å; L1049-V1098 HydrophobicContact CD2-CB 4.3Å; L1049-V1098 HydrophobicContact CD2-CG1 4.06Å; L1049-V1098 HydrophobicContact CD2-CG2 4.02Å; L1049-V1098 HydrophobicContact CG-CG1 4.48Å; L1061-V1098 HydrophobicContact CD2-CG1 4.5Å; F1091-V1098 HydrophobicContact CB-CG2 4.08Å; F1091-V1098 HydrophobicContact CD1-CG2 4.19Å; F1091-V1098 HydrophobicContact CG-CG2 4.31Å; T1092-V1098 CarbonylContact O-C 3.54Å; T1092-V1098 VanDerWaalsContact O-CA 3.28Å; T1092-V1098 WeakPolarHBondContact O-CA 3.38Å; I1093-V1098 HydrophobicContact CG1-CB 4.25Å; I1093-V1098 HydrophobicContact CG1-CG2 4.28Å; V1098-K1110 WeakPolarHBondContact O-CA 3.49Å; V1098-F1111 HydrophobicContact CB-CZ 4.44Å; V1098-F1111 HydrophobicContact CG1-CB 4.05Å; V1098-F1111 HydrophobicContact CG1-CD1 4.26Å; V1098-F1111 HydrophobicContact CG1-CD2 3.8Å; V1098-F1111 HydrophobicContact CG1-CE1 4.2Å; V1098-F1111 HydrophobicContact CG1-CE2 3.28Å; V1098-F1111 HydrophobicContact CG1-CG 4.37Å; V1098-F1111 HydrophobicContact CG1-CZ 3.5Å; V1098-F1111 VanDerWaalsContact CG1-CZ 3.48Å; V1098-F1111 WeakPolarHBondContact CG1-O 3.45Å; V1098-F1111 HydrophobicContact CG2-CZ 4.35Å; V1098-F1111 PolarHBondContact N-O 2.91Å; V1098-F1111 WeakPolarHBondContact O-CD1 3.24Å; V1098-F1111 WeakPolarHBondContact O-CE1 3.42Å; V1098-F1111 PolarHBondContact O-N 3.04Å; V1098-F1111 VanDerWaalsContact O-N 3.09Å; V1098-L1113 HydrophobicContact CB-CD1 3.81Å; V1098-L1113 HydrophobicContact CB-CD2 3.66Å; V1098-L1113 HydrophobicContact CB-CG 4.34Å; V1098-L1113 HydrophobicContact CG1-CD1 4.06Å; V1098-L1113 HydrophobicContact CG1-CD2 3.9Å; V1098-L1113 HydrophobicContact CG1-CG 4.24Å; V1098-L1113 HydrophobicContact CG2-CD2 4.46Å
1099	Q	87.9	Confident	82.6	Confident	37 Å²	37	44.2 Å²	44.2	17%	0.173	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	129	171.1	-167.2	166.4	21.7	0	0	110	F1091 T1092 N1106 S1108 K1110	F1091-Q1099 WeakPolarHBondContact CA-O 3.36Å; T1092-Q1099 PolarHBondContact N-O 2.9Å; T1092-Q1099 PolarHBondContact O-N 3.06Å; Q1099-N1106 VanDerWaalsContact CD-CG 3.43Å; Q1099-N1106 HydrophobicContact CG-CB 4.12Å; Q1099-N1106 WeakPolarHBondContact CG-OD1 3.39Å; Q1099-N1106 VanDerWaalsContact NE2-CG 3.3Å; Q1099-N1106 PolarHBondContact NE2-OD1 3.48Å; Q1099-N1106 PolarHBondContact OE1-ND2 2.88Å; Q1099-S1108 WeakPolarHBondContact CG-O 3.5Å; Q1099-S1108 PolarHBondContact NE2-O 3.09Å; Q1099-S1108 VanDerWaalsContact NE2-O 3.11Å; Q1099-K1110 HydrophobicContact CB-CG 4.24Å; Q1099-K1110 HydrophobicContact CG-CG 4.27Å
1100	L	89.7	Confident	82.1	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	125	177.3	176.6	64.7	0	0	0	110.8	L1051 L1061 F1075 L1089 T1090 F1091 V1102 N1106 I1107 S1108	L1051-L1100 HydrophobicContact CD1-CD2 3.89Å; L1051-L1100 HydrophobicContact CD2-CD2 3.9Å; L1051-L1100 HydrophobicContact CG-CD2 4.44Å; L1061-L1100 HydrophobicContact CD1-CD2 3.96Å; L1061-L1100 HydrophobicContact CD2-CB 4.06Å; L1061-L1100 HydrophobicContact CD2-CD2 4.03Å; L1061-L1100 HydrophobicContact CG-CD2 4.35Å; F1075-L1100 HydrophobicContact CE1-CD2 4.23Å; F1075-L1100 HydrophobicContact CE2-CD2 3.9Å; F1075-L1100 HydrophobicContact CZ-CD2 3.7Å; F1075-L1100 VanDerWaalsContact CZ-CD2 3.47Å; L1089-L1100 HydrophobicContact CB-CD1 4.34Å; T1090-L1100 CarbonylContact O-C 3.45Å; T1090-L1100 WeakPolarHBondContact O-CA 3.26Å; F1091-L1100 HydrophobicContact CD1-CD1 4.1Å; F1091-L1100 HydrophobicContact CE1-CD1 3.86Å; F1091-L1100 HydrophobicContact CE2-CD1 4.39Å; F1091-L1100 HydrophobicContact CG-CD1 4.43Å; F1091-L1100 HydrophobicContact CZ-CD1 4.04Å; L1100-V1102 HydrophobicContact CD1-CG2 4.3Å; L1100-V1102 HydrophobicContact CD2-CG2 4.41Å; L1100-V1102 HydrophobicContact CG-CG2 4.27Å; L1100-N1106 CarbonylContact O-C 3.59Å; L1100-N1106 WeakPolarHBondContact O-CA 3.36Å; L1100-I1107 PolarHBondContact O-N 2.93Å; L1100-I1107 VanDerWaalsContact O-N 3.12Å; L1100-S1108 PolarHBondContact N-OG 3.07Å; L1100-S1108 PolarHBondContact O-N 3.14Å
1101	S	87.5	Confident	81.6	Confident	5 Å²	5	48.6 Å²	48.6	4%	0.035	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	129.2	171.6	-44.4	0	0	0	0	111.6	L1089 T1090 G1104 R1105 N1106 E1340	L1089-S1101 CarbonylContact C-O 3.56Å; L1089-S1101 WeakPolarHBondContact CA-O 3.25Å; T1090-S1101 WeakPolarHBondContact CB-OG 3.36Å; T1090-S1101 PolarHBondContact N-O 3.07Å; T1090-S1101 PolarHBondContact O-N 3.02Å; T1090-S1101 PolarHBondContact OG1-OG 2.76Å; S1101-G1104 WeakPolarHBondContact CB-O 3.18Å; S1101-G1104 WeakPolarHBondContact OG-CA 3.22Å; S1101-G1104 PolarHBondContact OG-O 3.41Å; S1101-R1105 CarbonylContact C-O 3.43Å; S1101-R1105 VanDerWaalsContact CA-O 3.25Å; S1101-R1105 WeakPolarHBondContact CA-O 3.32Å; S1101-R1105 WeakPolarHBondContact CB-O 3.37Å; S1101-R1105 PolarHBondContact OG-O 3.45Å; S1101-N1106 WeakPolarHBondContact CB-OD1 3.48Å; S1101-N1106 VanDerWaalsContact OG-CA 3.31Å; S1101-N1106 WeakPolarHBondContact OG-CA 3.35Å; S1101-N1106 PolarHBondContact OG-N 2.82Å; S1101-N1106 VanDerWaalsContact OG-N 3.08Å; S1101-N1106 PolarHBondContact OG-OD1 3.12Å; S1101-E1340 WeakPolarHBondContact CB-OE2 3.41Å; S1101-E1340 PolarHBondContact OG-OE2 2.64Å
1102	V	86.4	Confident	81.1	Confident	3.6 Å²	3.6	50.7 Å²	50.7	2%	0.022	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	126	179.8	-177.4	0	0	0	0	109	K946 W1059 F1075 P1077 L1079 I1087 P1088 L1089 L1100 G1104 R1105 I1107	K946-V1102 WeakPolarHBondContact CD-O 3.47Å; K946-V1102 WeakPolarHBondContact CE-O 3.32Å; K946-V1102 WeakPolarHBondContact CG-O 3.11Å; W1059-V1102 HydrophobicContact CH2-CG1 4.35Å; W1059-V1102 HydrophobicContact CZ3-CG1 4.15Å; W1059-V1102 HydrophobicContact CZ3-CG2 4.27Å; F1075-V1102 HydrophobicContact CE2-CG2 4.15Å; F1075-V1102 HydrophobicContact CZ-CG2 4.23Å; P1077-V1102 HydrophobicContact CB-CG1 4.31Å; L1079-V1102 HydrophobicContact CD2-CG1 4.08Å; I1087-V1102 HydrophobicContact CG2-CG1 3.91Å; P1088-V1102 CarbonylContact O-C 3.6Å; P1088-V1102 WeakPolarHBondContact O-CA 3.16Å; L1089-V1102 HydrophobicContact CD2-CB 4.22Å; L1089-V1102 HydrophobicContact CD2-CG1 3.91Å; L1089-V1102 HydrophobicContact CD2-CG2 3.73Å; L1100-V1102 HydrophobicContact CD1-CG2 4.3Å; L1100-V1102 HydrophobicContact CD2-CG2 4.41Å; L1100-V1102 HydrophobicContact CG-CG2 4.27Å; V1102-G1104 PolarHBondContact O-N 2.86Å; V1102-G1104 VanDerWaalsContact O-N 3.17Å; V1102-R1105 PolarHBondContact N-O 3.2Å; V1102-R1105 VanDerWaalsContact O-CB 3.27Å; V1102-R1105 WeakPolarHBondContact O-CB 3.27Å; V1102-R1105 WeakPolarHBondContact O-CG 3.21Å; V1102-R1105 PolarHBondContact O-N 3.05Å; V1102-I1107 HydrophobicContact CB-CD1 4.09Å; V1102-I1107 HydrophobicContact CB-CG1 4.03Å; V1102-I1107 HydrophobicContact CG2-CB 4.45Å; V1102-I1107 HydrophobicContact CG2-CD1 3.55Å; V1102-I1107 HydrophobicContact CG2-CG1 3.84Å
1103	N	80.8	Confident	80.7	Confident	43.4 Å²	43.4	49.9 Å²	49.9	23%	0.232	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	49.8	32.6	-167.1	-54.8	-3	0	0	0	112.5	K946 L1079 D1083 P1088 R1105	K946-N1103 HydrophobicContact CD-CB 4.11Å; K946-N1103 WeakPolarHBondContact CE-OD1 3.44Å; K946-N1103 VanDerWaalsContact CG-C 3.48Å; K946-N1103 HydrophobicContact CG-CB 3.72Å; K946-N1103 VanDerWaalsContact CG-O 3.23Å; K946-N1103 WeakPolarHBondContact CG-O 3.28Å; K946-N1103 PolarHBondContact NZ-OD1 2.99Å; L1079-N1103 WeakPolarHBondContact CD2-ND2 3.33Å; D1083-N1103 WeakPolarHBondContact CB-ND2 3.31Å; D1083-N1103 VanDerWaalsContact CG-ND2 3.33Å; D1083-N1103 PolarHBondContact OD1-ND2 2.88Å; D1083-N1103 PolarHBondContact OD2-ND2 2.78Å; D1083-N1103 VanDerWaalsContact OD2-ND2 3.12Å; P1088-N1103 VanDerWaalsContact CD-OD1 3.24Å; P1088-N1103 WeakPolarHBondContact CD-OD1 3.22Å; P1088-N1103 HydrophobicContact CG-CB 4.33Å; P1088-N1103 WeakPolarHBondContact O-CA 3.24Å; P1088-N1103 PolarHBondContact O-N 2.84Å; N1103-R1105 PolarHBondContact O-N 2.88Å
1104	G	75.4	Confident	80.5	Confident	27.6 Å²	27.6	49.6 Å²	49.6	29%	0.285	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.8	-3.3	-174.1	0	0	0	0	0	115.9	K945 S1101 V1102 N1106 A1339 E1340 D1399 G1400	K945-G1104 CarbonylContact C-O 3.59Å; K945-G1104 WeakPolarHBondContact CA-O 3.3Å; K945-G1104 WeakPolarHBondContact CB-O 3.48Å; K945-G1104 CarbonylContact O-C 3.59Å; K945-G1104 VanDerWaalsContact O-CA 3.26Å; K945-G1104 WeakPolarHBondContact O-CA 3.27Å; S1101-G1104 WeakPolarHBondContact CB-O 3.18Å; S1101-G1104 WeakPolarHBondContact OG-CA 3.22Å; S1101-G1104 PolarHBondContact OG-O 3.41Å; V1102-G1104 PolarHBondContact O-N 2.86Å; V1102-G1104 VanDerWaalsContact O-N 3.17Å; G1104-N1106 PolarHBondContact O-N 3.05Å; G1104-N1106 VanDerWaalsContact O-N 3.12Å; G1104-A1339 VanDerWaalsContact C-C 3.44Å; G1104-A1339 CarbonylContact O-C 3.57Å; G1104-A1339 VanDerWaalsContact O-C 3.3Å; G1104-E1340 WeakPolarHBondContact CA-O 3.27Å; G1104-E1340 WeakPolarHBondContact O-CA 3.49Å; G1104-E1340 WeakPolarHBondContact O-CB 3.42Å; G1104-E1340 WeakPolarHBondContact O-CG 2.99Å; G1104-E1340 PolarHBondContact O-N 3.38Å; G1104-D1399 CarbonylContact O-C 3.59Å; G1104-D1399 VanDerWaalsContact O-O 3.14Å; G1104-G1400 PolarHBondContact O-N 2.88Å
1105	R	76.6	Confident	80.5	Confident	100.2 Å²	100.2	46.6 Å²	46.6	38%	0.378	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	120.8	175.3	-70.4	179.5	-178.1	-162.4	-2.6	109.2	K501 E910 K945 K946 S1101 V1102 N1103 I1107 E1336 R1337 P1338 A1339	K501-R1105 PolarHBondContact O-NH2 2.9Å; E910-R1105 PolarHBondContact O-NH2 3.39Å; E910-R1105 VanDerWaalsContact O-NH2 3.1Å; K945-R1105 HydrophobicContact CB-CB 4.41Å; K945-R1105 HydrophobicContact CB-CG 4.02Å; K946-R1105 HydrophobicContact CB-CB 3.5Å; K946-R1105 HydrophobicContact CB-CG 3.45Å; K946-R1105 VanDerWaalsContact CB-CG 3.45Å; K946-R1105 HydrophobicContact CD-CB 4Å; K946-R1105 HydrophobicContact CG-CB 4.13Å; K946-R1105 PolarHBondContact O-NH2 3.4Å; K946-R1105 VanDerWaalsContact O-NH2 3.13Å; S1101-R1105 CarbonylContact C-O 3.43Å; S1101-R1105 VanDerWaalsContact CA-O 3.25Å; S1101-R1105 WeakPolarHBondContact CA-O 3.32Å; S1101-R1105 WeakPolarHBondContact CB-O 3.37Å; S1101-R1105 PolarHBondContact OG-O 3.45Å; V1102-R1105 PolarHBondContact N-O 3.2Å; V1102-R1105 VanDerWaalsContact O-CB 3.27Å; V1102-R1105 WeakPolarHBondContact O-CB 3.27Å; V1102-R1105 WeakPolarHBondContact O-CG 3.21Å; V1102-R1105 PolarHBondContact O-N 3.05Å; N1103-R1105 PolarHBondContact O-N 2.88Å; R1105-I1107 HydrophobicContact CB-CD1 3.81Å; R1105-I1107 WeakPolarHBondContact O-CD1 3.42Å; R1105-I1107 WeakPolarHBondContact O-CG1 3.25Å; R1105-I1107 PolarHBondContact O-N 2.96Å; R1105-I1107 VanDerWaalsContact O-N 3.07Å; R1105-E1336 PolarHBondContact NH1-O 3.15Å; R1105-E1336 PolarHBondContact NH2-O 2.74Å; R1105-R1337 PolarHBondContact NH1-O 2.74Å; R1105-R1337 PolarHBondContact NH2-O 2.94Å; R1105-P1338 VanDerWaalsContact CB-O 3.27Å; R1105-P1338 WeakPolarHBondContact CB-O 3.5Å; R1105-P1338 VanDerWaalsContact CD-O 3.23Å; R1105-P1338 WeakPolarHBondContact CD-O 3.43Å; R1105-P1338 WeakPolarHBondContact CG-O 3.27Å; R1105-A1339 WeakPolarHBondContact CG-O 3.4Å; R1105-A1339 PolarHBondContact N-O 2.87Å
1106	N	79.4	Confident	80.3	Confident	64 Å²	64	46.2 Å²	46.2	34%	0.342	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.7	115.6	170.6	-72.4	-16.6	0	0	0	109.3	K945 Q1099 L1100 S1101 G1104 E1340 D1399	K945-N1106 WeakPolarHBondContact CB-OD1 3.49Å; K945-N1106 HydrophobicContact CD-CB 4.16Å; K945-N1106 WeakPolarHBondContact CD-OD1 3.46Å; K945-N1106 WeakPolarHBondContact CE-OD1 3.17Å; K945-N1106 VanDerWaalsContact CG-OD1 3.27Å; K945-N1106 WeakPolarHBondContact CG-OD1 3.36Å; Q1099-N1106 VanDerWaalsContact CD-CG 3.43Å; Q1099-N1106 HydrophobicContact CG-CB 4.12Å; Q1099-N1106 WeakPolarHBondContact CG-OD1 3.39Å; Q1099-N1106 VanDerWaalsContact NE2-CG 3.3Å; Q1099-N1106 PolarHBondContact NE2-OD1 3.48Å; Q1099-N1106 PolarHBondContact OE1-ND2 2.88Å; L1100-N1106 CarbonylContact O-C 3.59Å; L1100-N1106 WeakPolarHBondContact O-CA 3.36Å; S1101-N1106 WeakPolarHBondContact CB-OD1 3.48Å; S1101-N1106 VanDerWaalsContact OG-CA 3.31Å; S1101-N1106 WeakPolarHBondContact OG-CA 3.35Å; S1101-N1106 PolarHBondContact OG-N 2.82Å; S1101-N1106 VanDerWaalsContact OG-N 3.08Å; S1101-N1106 PolarHBondContact OG-OD1 3.12Å; G1104-N1106 PolarHBondContact O-N 3.05Å; G1104-N1106 VanDerWaalsContact O-N 3.12Å; N1106-E1340 WeakPolarHBondContact CB-OE1 3.42Å; N1106-E1340 PolarHBondContact N-OE1 2.7Å; N1106-E1340 PolarHBondContact ND2-OE1 3.4Å; N1106-E1340 PolarHBondContact ND2-OE2 2.83Å; N1106-D1399 PolarHBondContact N-O 3.18Å; N1106-D1399 WeakPolarHBondContact ND2-CB 3.31Å
1107	I	77.9	Confident	80.1	Confident	48 Å²	48	47.2 Å²	47.2	25%	0.246	24%	0.239	C	C	.	.			trans	-106.6	-34.1	-178.8	-31.8	-96.8	0	0	0	111.6	F1075 P1077 L1100 V1102 R1105	F1075-I1107 HydrophobicContact CB-CG2 3.6Å; F1075-I1107 HydrophobicContact CD1-CB 4.41Å; F1075-I1107 HydrophobicContact CD1-CG2 3.75Å; F1075-I1107 HydrophobicContact CD2-CB 4.32Å; F1075-I1107 HydrophobicContact CD2-CD1 3.29Å; F1075-I1107 HydrophobicContact CD2-CG1 4.19Å; F1075-I1107 HydrophobicContact CD2-CG2 3.46Å; F1075-I1107 VanDerWaalsContact CD2-CG2 3.47Å; F1075-I1107 HydrophobicContact CE1-CB 4.5Å; F1075-I1107 HydrophobicContact CE1-CG2 4.27Å; F1075-I1107 HydrophobicContact CE2-CB 4.38Å; F1075-I1107 HydrophobicContact CE2-CD1 3.36Å; F1075-I1107 HydrophobicContact CE2-CG1 4.19Å; F1075-I1107 HydrophobicContact CE2-CG2 4.09Å; F1075-I1107 HydrophobicContact CG-CB 4.28Å; F1075-I1107 HydrophobicContact CG-CD1 4.2Å; F1075-I1107 HydrophobicContact CG-CG1 4.35Å; F1075-I1107 HydrophobicContact CG-CG2 3.44Å; F1075-I1107 HydrophobicContact CZ-CB 4.48Å; F1075-I1107 HydrophobicContact CZ-CD1 4.34Å; F1075-I1107 HydrophobicContact CZ-CG2 4.38Å; P1077-I1107 HydrophobicContact CB-CD1 3.84Å; P1077-I1107 HydrophobicContact CG-CD1 4.46Å; L1100-I1107 PolarHBondContact O-N 2.93Å; L1100-I1107 VanDerWaalsContact O-N 3.12Å; V1102-I1107 HydrophobicContact CB-CD1 4.09Å; V1102-I1107 HydrophobicContact CB-CG1 4.03Å; V1102-I1107 HydrophobicContact CG2-CB 4.45Å; V1102-I1107 HydrophobicContact CG2-CD1 3.55Å; V1102-I1107 HydrophobicContact CG2-CG1 3.84Å; R1105-I1107 HydrophobicContact CB-CD1 3.81Å; R1105-I1107 WeakPolarHBondContact O-CD1 3.42Å; R1105-I1107 WeakPolarHBondContact O-CG1 3.25Å; R1105-I1107 PolarHBondContact O-N 2.96Å; R1105-I1107 VanDerWaalsContact O-N 3.07Å
1108	S	76.6	Confident	79.7	Confident	5.6 Å²	5.6	44.2 Å²	44.2	4%	0.039	23%	0.226	C	C	.	.	S	Bend	trans	-84.4	152.5	172.7	81.2	0	0	0	0	111.2	Q1099 L1100	Q1099-S1108 WeakPolarHBondContact CG-O 3.5Å; Q1099-S1108 PolarHBondContact NE2-O 3.09Å; Q1099-S1108 VanDerWaalsContact NE2-O 3.11Å; L1100-S1108 PolarHBondContact N-OG 3.07Å; L1100-S1108 PolarHBondContact O-N 3.14Å
1109	K	76.9	Confident	79.2	Confident	178.8 Å²	178.8	47.6 Å²	47.6	78%	0.777	24%	0.242	S	C	*	.	P	Polyproline II helix	trans	-62.8	164.2	153.9	-66.6	-179	179	178.6	0	108.8	F1111	K1109-F1111 WeakPolarHBondContact O-CD1 3.32Å; K1109-F1111 PolarHBondContact O-N 2.97Å
1110	K	79.7	Confident	78.8	Confident	100.6 Å²	100.6	47.8 Å²	47.8	44%	0.437	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-62.6	126.7	165.7	-74.9	-170.3	172.2	-170.6	0	108.6	E1094 F1097 V1098 Q1099	E1094-K1110 IonicContact OE2-NZ 3.18Å; E1094-K1110 PolarHBondContact OE2-NZ 2.94Å; F1097-K1110 HydrophobicContact CB-CB 4.11Å; F1097-K1110 HydrophobicContact CB-CD 4.29Å; F1097-K1110 HydrophobicContact CB-CG 4.44Å; F1097-K1110 HydrophobicContact CD1-CB 4.2Å; F1097-K1110 HydrophobicContact CG-CB 4.28Å; F1097-K1110 HydrophobicContact CG-CD 4.43Å; V1098-K1110 WeakPolarHBondContact O-CA 3.49Å; Q1099-K1110 HydrophobicContact CB-CG 4.24Å; Q1099-K1110 HydrophobicContact CG-CG 4.27Å
1111	F	79.5	Confident	78.5	Confident	11 Å²	11	48.5 Å²	48.5	5%	0.048	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	146.2	-179.9	102	-89.8	0	0	0	109.5	L1049 L1061 R1063 K1071 I1072 T1073 F1097 V1098 K1109	L1049-F1111 HydrophobicContact CD1-CD1 3.7Å; L1049-F1111 HydrophobicContact CD1-CE1 3.64Å; L1049-F1111 HydrophobicContact CD1-CE2 3.66Å; L1049-F1111 HydrophobicContact CD1-CZ 3.62Å; L1049-F1111 HydrophobicContact CD2-CE2 4.17Å; L1049-F1111 HydrophobicContact CD2-CZ 3.78Å; L1049-F1111 HydrophobicContact CG-CZ 4.36Å; L1061-F1111 HydrophobicContact CD2-CB 4.08Å; L1061-F1111 HydrophobicContact CD2-CD1 3.98Å; L1061-F1111 HydrophobicContact CD2-CD2 4.41Å; L1061-F1111 HydrophobicContact CD2-CE1 3.62Å; L1061-F1111 HydrophobicContact CD2-CG 3.96Å; L1061-F1111 HydrophobicContact CD2-CZ 3.77Å; L1061-F1111 HydrophobicContact CG-CD1 4.26Å; L1061-F1111 HydrophobicContact CG-CE1 4.33Å; L1061-F1111 HydrophobicContact CG-CZ 4.37Å; L1061-F1111 WeakPolarHBondContact O-CZ 3.26Å; R1063-F1111 HydrophobicContact CB-CE1 3.79Å; R1063-F1111 HydrophobicContact CB-CZ 3.94Å; K1071-F1111 HydrophobicContact CB-CE2 4.15Å; K1071-F1111 HydrophobicContact CB-CZ 3.97Å; K1071-F1111 HydrophobicContact CD-CE2 4.2Å; K1071-F1111 HydrophobicContact CG-CE2 3.9Å; K1071-F1111 HydrophobicContact CG-CZ 4.25Å; K1071-F1111 WeakPolarHBondContact O-CZ 3.38Å; I1072-F1111 HydrophobicContact CD1-CD2 3.69Å; I1072-F1111 HydrophobicContact CD1-CE1 4.38Å; I1072-F1111 HydrophobicContact CD1-CE2 3.36Å; I1072-F1111 VanDerWaalsContact CD1-CE2 3.42Å; I1072-F1111 HydrophobicContact CD1-CG 4.33Å; I1072-F1111 HydrophobicContact CD1-CZ 3.76Å; I1072-F1111 HydrophobicContact CG1-CD2 4.21Å; I1072-F1111 HydrophobicContact CG1-CE2 4.36Å; I1072-F1111 HydrophobicContact CG2-CB 4.01Å; I1072-F1111 HydrophobicContact CG2-CD1 3.76Å; I1072-F1111 HydrophobicContact CG2-CD2 4.17Å; I1072-F1111 HydrophobicContact CG2-CE1 4.28Å; I1072-F1111 HydrophobicContact CG2-CG 3.71Å; T1073-F1111 VanDerWaalsContact OG1-CD2 3.29Å; T1073-F1111 WeakPolarHBondContact OG1-CD2 3.39Å; T1073-F1111 WeakPolarHBondContact OG1-CE2 3.44Å; F1097-F1111 CarbonylContact C-O 3.57Å; F1097-F1111 VanDerWaalsContact CA-O 3.3Å; F1097-F1111 WeakPolarHBondContact CA-O 3.33Å; F1097-F1111 VanDerWaalsContact CD1-O 3.28Å; F1097-F1111 WeakPolarHBondContact CD1-O 3.28Å; V1098-F1111 HydrophobicContact CB-CZ 4.44Å; V1098-F1111 HydrophobicContact CG1-CB 4.05Å; V1098-F1111 HydrophobicContact CG1-CD1 4.26Å; V1098-F1111 HydrophobicContact CG1-CD2 3.8Å; V1098-F1111 HydrophobicContact CG1-CE1 4.2Å; V1098-F1111 HydrophobicContact CG1-CE2 3.28Å; V1098-F1111 HydrophobicContact CG1-CG 4.37Å; V1098-F1111 HydrophobicContact CG1-CZ 3.5Å; V1098-F1111 VanDerWaalsContact CG1-CZ 3.48Å; V1098-F1111 WeakPolarHBondContact CG1-O 3.45Å; V1098-F1111 HydrophobicContact CG2-CZ 4.35Å; V1098-F1111 PolarHBondContact N-O 2.91Å; V1098-F1111 WeakPolarHBondContact O-CD1 3.24Å; V1098-F1111 WeakPolarHBondContact O-CE1 3.42Å; V1098-F1111 PolarHBondContact O-N 3.04Å; V1098-F1111 VanDerWaalsContact O-N 3.09Å; K1109-F1111 WeakPolarHBondContact O-CD1 3.32Å; K1109-F1111 PolarHBondContact O-N 2.97Å
1112	P	79.9	Confident	78.3	Confident	44.4 Å²	44.4	51.1 Å²	51.1	29%	0.288	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	144.8	-177.3	-14.6	23.7	0	0	0	112.2	K1071 G1096 F1097 A1165	K1071-P1112 HydrophobicContact CD-CG 3.81Å; G1096-P1112 CarbonylContact O-C 3.58Å; G1096-P1112 WeakPolarHBondContact O-CA 3.28Å; F1097-P1112 HydrophobicContact CD1-CB 4.13Å; F1097-P1112 HydrophobicContact CD1-CG 4.37Å; F1097-P1112 HydrophobicContact CE1-CB 4.1Å; F1097-P1112 HydrophobicContact CE1-CG 4.09Å; F1097-P1112 HydrophobicContact CZ-CB 4.23Å; F1097-P1112 HydrophobicContact CZ-CG 3.77Å; P1112-A1165 HydrophobicContact CB-CB 4.13Å; P1112-A1165 HydrophobicContact CG-CB 3.66Å
1113	L	80.2	Confident	78.3	Confident	22.6 Å²	22.6	51.5 Å²	51.5	12%	0.118	26%	0.263	C	S	.	.			trans	-63.7	139.3	173	-81.3	135	0	0	0	110.8	L1020 M1043 L1049 R1063 I1093 G1096 F1097 V1098 G1115	L1020-L1113 HydrophobicContact CD1-CD1 3.71Å; L1020-L1113 HydrophobicContact CD1-CD2 3.45Å; L1020-L1113 VanDerWaalsContact CD1-CD2 3.45Å; L1020-L1113 HydrophobicContact CD2-CD2 4.17Å; L1020-L1113 HydrophobicContact CG-CD2 4.43Å; M1043-L1113 HydrophobicContact CE-CD1 4.38Å; M1043-L1113 HydrophobicContact CE-CD2 3.72Å; M1043-L1113 HydrophobicContact CE-CG 4.25Å; M1043-L1113 HydrophobicContact SD-CB 4.32Å; M1043-L1113 HydrophobicContact SD-CD1 4.46Å; M1043-L1113 HydrophobicContact SD-CD2 3.69Å; M1043-L1113 HydrophobicContact SD-CG 4.35Å; L1049-L1113 HydrophobicContact CD2-CD2 4.32Å; R1063-L1113 PolarHBondContact NH1-O 3.46Å; I1093-L1113 HydrophobicContact CD1-CD2 4.04Å; I1093-L1113 HydrophobicContact CG1-CD1 4.34Å; I1093-L1113 HydrophobicContact CG1-CD2 4.37Å; I1093-L1113 HydrophobicContact CG2-CD1 3.91Å; I1093-L1113 HydrophobicContact CG2-CD2 4.17Å; I1093-L1113 HydrophobicContact CG2-CG 4.43Å; G1096-L1113 VanDerWaalsContact C-CD1 3.45Å; G1096-L1113 WeakPolarHBondContact O-CB 3.5Å; G1096-L1113 VanDerWaalsContact O-CD1 3.32Å; G1096-L1113 WeakPolarHBondContact O-CD1 3.35Å; G1096-L1113 WeakPolarHBondContact O-CG 3.46Å; G1096-L1113 PolarHBondContact O-N 3.05Å; F1097-L1113 WeakPolarHBondContact O-CD1 3.23Å; V1098-L1113 HydrophobicContact CB-CD1 3.81Å; V1098-L1113 HydrophobicContact CB-CD2 3.66Å; V1098-L1113 HydrophobicContact CB-CG 4.34Å; V1098-L1113 HydrophobicContact CG1-CD1 4.06Å; V1098-L1113 HydrophobicContact CG1-CD2 3.9Å; V1098-L1113 HydrophobicContact CG1-CG 4.24Å; V1098-L1113 HydrophobicContact CG2-CD2 4.46Å; L1113-G1115 VanDerWaalsContact C-N 3.3Å; L1113-G1115 WeakPolarHBondContact CB-O 3.4Å; L1113-G1115 WeakPolarHBondContact CD2-O 3.38Å; L1113-G1115 PolarHBondContact O-N 2.84Å
1114	P	79.8	Confident	78.6	Confident	13.4 Å²	13.4	51.6 Å²	51.6	9%	0.087	27%	0.267	C	S	.	.	S	Bend	trans	-72	-20.9	172.4	24.6	-29.2	0	0	0	113.4	M1043 A1047 T1048 L1049 R1063 V1065	M1043-P1114 HydrophobicContact CB-CG 4.18Å; M1043-P1114 HydrophobicContact CG-CG 4.18Å; M1043-P1114 VanDerWaalsContact SD-CD 3.53Å; M1043-P1114 HydrophobicContact SD-CG 3.9Å; M1043-P1114 VanDerWaalsContact SD-CG 3.59Å; A1047-P1114 HydrophobicContact CB-CB 4.17Å; A1047-P1114 WeakPolarHBondContact CB-O 3.14Å; T1048-P1114 VanDerWaalsContact C-CG 3.45Å; L1049-P1114 HydrophobicContact CB-CG 4.09Å; R1063-P1114 HydrophobicContact CG-CB 3.71Å; R1063-P1114 HydrophobicContact CG-CG 4.25Å; V1065-P1114 HydrophobicContact CG2-CB 3.9Å; V1065-P1114 WeakPolarHBondContact CG2-O 3.43Å
1115	G	78	Confident	79.2	Confident	19 Å²	19	51.8 Å²	51.8	20%	0.196	27%	0.27	C	S	.	.			trans	-157.5	177.1	180	0	0	0	0	0	112.4	M1043 L1113	M1043-G1115 WeakPolarHBondContact CE-O 3.42Å; M1043-G1115 CarbonylContact O-C 3.54Å; M1043-G1115 VanDerWaalsContact O-C 3.31Å; M1043-G1115 VanDerWaalsContact O-CA 3.3Å; M1043-G1115 WeakPolarHBondContact O-CA 3.35Å; L1113-G1115 VanDerWaalsContact C-N 3.3Å; L1113-G1115 WeakPolarHBondContact CB-O 3.4Å; L1113-G1115 WeakPolarHBondContact CD2-O 3.38Å; L1113-G1115 PolarHBondContact O-N 2.84Å
1116	N	70.7	Confident	79.7	Confident	125.2 Å²	125.2	49 Å²	49	67%	0.67	26%	0.262	S	S	*	.	S	Bend	trans	-99.4	-4.6	-168.7	49.8	-9.1	0	0	0	114.6	L1020 M1043	L1020-N1116 WeakPolarHBondContact CD2-O 3.38Å; L1020-N1116 VanDerWaalsContact CG-O 3.25Å; L1020-N1116 WeakPolarHBondContact CG-O 3.33Å; M1043-N1116 PolarHBondContact O-N 3Å
1117	Q	70.6	Confident	79.8	Confident	62.4 Å²	62.4	46.3 Å²	46.3	29%	0.292	25%	0.248	S	C	.	.	S	Bend	trans	-142.5	135.1	-175.5	-26.1	-171.1	-2.4	0	0	110.1	Q1018 L1020 M1043 G1044 E1119	Q1018-Q1117 HydrophobicContact CB-CG 4.12Å; Q1018-Q1117 HydrophobicContact CG-CG 4.48Å; Q1018-Q1117 VanDerWaalsContact NE2-CD 3.31Å; Q1018-Q1117 VanDerWaalsContact OE1-CA 3.31Å; Q1018-Q1117 VanDerWaalsContact OE1-CB 3.27Å; Q1018-Q1117 VanDerWaalsContact OE1-CD 3.32Å; L1020-Q1117 HydrophobicContact CD1-CB 3.49Å; L1020-Q1117 VanDerWaalsContact CD1-CB 3.49Å; L1020-Q1117 VanDerWaalsContact CD2-C 3.45Å; L1020-Q1117 HydrophobicContact CD2-CB 3.86Å; L1020-Q1117 HydrophobicContact CD2-CG 4.35Å; L1020-Q1117 HydrophobicContact CG-CB 4.18Å; M1043-Q1117 CarbonylContact C-O 3.56Å; M1043-Q1117 WeakPolarHBondContact CA-O 3.42Å; M1043-Q1117 WeakPolarHBondContact CB-O 3.39Å; M1043-Q1117 WeakPolarHBondContact CG-O 3.46Å; M1043-Q1117 PolarHBondContact O-N 3.3Å; M1043-Q1117 VanDerWaalsContact O-O 3.12Å; G1044-Q1117 PolarHBondContact N-O 3.12Å; Q1117-E1119 HydrophobicContact CG-CG 3.99Å; Q1117-E1119 PolarHBondContact NE2-OE1 2.92Å; Q1117-E1119 PolarHBondContact O-N 2.94Å
1118	M	75.6	Confident	79.9	Confident	15.6 Å²	15.6	47.2 Å²	47.2	8%	0.077	25%	0.253	C	S	.	.			trans	-91.3	115.7	175.3	-163.8	-178.3	-82.8	0	0	109.4	L1010 L1011 L1020 P1021 A1024 V1041 K1042 M1043 F1091 I1093 I1121 T1134	L1010-M1118 HydrophobicContact CD1-CB 3.95Å; L1011-M1118 WeakPolarHBondContact CD1-O 3.46Å; L1020-M1118 HydrophobicContact CD2-CB 4.11Å; P1021-M1118 HydrophobicContact CB-CE 4.4Å; P1021-M1118 HydrophobicContact CG-CB 4.25Å; P1021-M1118 HydrophobicContact CG-CE 3.96Å; P1021-M1118 HydrophobicContact CG-SD 3.64Å; P1021-M1118 VanDerWaalsContact CG-SD 3.6Å; P1021-M1118 WeakPolarHBondContact CG-SD 2.8Å; P1021-M1118 WeakPolarHBondContact O-CE 3.49Å; A1024-M1118 HydrophobicContact CB-CE 3.76Å; A1024-M1118 HydrophobicContact CB-SD 4.09Å; V1041-M1118 HydrophobicContact CG1-CE 3.78Å; V1041-M1118 HydrophobicContact CG1-CG 4.08Å; V1041-M1118 HydrophobicContact CG1-SD 4.05Å; K1042-M1118 CarbonylContact O-C 3.56Å; K1042-M1118 WeakPolarHBondContact O-CA 3.41Å; M1043-M1118 HydrophobicContact CE-CE 4.19Å; M1043-M1118 HydrophobicContact CE-CG 3.9Å; M1043-M1118 HydrophobicContact CE-SD 4.4Å; M1043-M1118 HydrophobicContact CG-CG 4.43Å; M1043-M1118 HydrophobicContact SD-CB 3.97Å; M1043-M1118 HydrophobicContact SD-CE 3.92Å; M1043-M1118 HydrophobicContact SD-CG 4.08Å; F1091-M1118 HydrophobicContact CB-SD 4.06Å; I1093-M1118 HydrophobicContact CD1-CB 4.19Å; I1093-M1118 HydrophobicContact CD1-CE 3.8Å; I1093-M1118 VanDerWaalsContact CD1-CE 3.5Å; I1093-M1118 HydrophobicContact CD1-CG 3.74Å; I1093-M1118 HydrophobicContact CD1-SD 4.38Å; I1093-M1118 HydrophobicContact CG1-CE 3.97Å; I1093-M1118 HydrophobicContact CG1-CG 4.48Å; I1093-M1118 HydrophobicContact CG1-SD 4.49Å; M1118-I1121 HydrophobicContact CE-CD1 3.93Å; M1118-I1121 HydrophobicContact CE-CG1 3.19Å; M1118-I1121 HydrophobicContact SD-CD1 4.02Å; M1118-I1121 HydrophobicContact SD-CG1 4.24Å; M1118-T1134 HydrophobicContact CE-CG2 3.99Å
1119	E	75	Confident	79.9	Confident	72 Å²	72	49 Å²	49	34%	0.336	26%	0.262	S	S	.	.			trans	-94.2	-54	-176.9	-64.5	-176.3	169.3	0	0	111.8	L1010 L1011 K1042 G1044 P1045 Q1117	L1010-E1119 WeakPolarHBondContact CB-O 3.45Å; L1010-E1119 PolarHBondContact N-O 3.15Å; L1011-E1119 WeakPolarHBondContact CD1-O 3.49Å; K1042-E1119 HydrophobicContact CB-CB 4.23Å; K1042-E1119 PolarHBondContact O-N 3.03Å; G1044-E1119 VanDerWaalsContact CA-CD 3.45Å; G1044-E1119 WeakPolarHBondContact CA-OE1 3.28Å; G1044-E1119 WeakPolarHBondContact CA-OE2 3.33Å; G1044-E1119 PolarHBondContact N-OE2 2.94Å; G1044-E1119 VanDerWaalsContact N-OE2 3.16Å; P1045-E1119 WeakPolarHBondContact CD-OE1 3.32Å; Q1117-E1119 HydrophobicContact CG-CG 3.99Å; Q1117-E1119 PolarHBondContact NE2-OE1 2.92Å; Q1117-E1119 PolarHBondContact O-N 2.94Å
1120	T	78.4	Confident	80.2	Confident	40.8 Å²	40.8	42.2 Å²	42.2	25%	0.25	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	157.3	-175.9	52.6	0	0	0	0	111.5	E1007 F1008 V1041 K1042 E1122	E1007-T1120 HydrophobicContact CG-CG2 3.49Å; E1007-T1120 VanDerWaalsContact CG-CG2 3.49Å; F1008-T1120 CarbonylContact O-C 3.56Å; F1008-T1120 VanDerWaalsContact O-CA 3.24Å; F1008-T1120 WeakPolarHBondContact O-CA 3.13Å; F1008-T1120 WeakPolarHBondContact O-CG2 3.49Å; V1041-T1120 CarbonylContact C-O 3.54Å; V1041-T1120 WeakPolarHBondContact CA-O 3.37Å; K1042-T1120 WeakPolarHBondContact CB-OG1 3.49Å; K1042-T1120 WeakPolarHBondContact CD-OG1 3.29Å; K1042-T1120 HydrophobicContact CG-CG2 4.08Å; K1042-T1120 WeakPolarHBondContact CG-OG1 3.46Å; K1042-T1120 PolarHBondContact N-O 3.09Å; T1120-E1122 WeakPolarHBondContact CB-OE1 3.39Å; T1120-E1122 HydrophobicContact CG2-CG 4.19Å; T1120-E1122 PolarHBondContact OG1-OE1 3.2Å
1121	I	83.9	Confident	79.9	Confident	15.8 Å²	15.8	38.9 Å²	38.9	8%	0.081	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	118.9	163.6	-59.4	-177.7	0	0	0	108.3	F1008 L1010 A1024 T1026 V1039 D1040 V1041 M1118 V1123 V1132	F1008-I1121 WeakPolarHBondContact CB-O 3.4Å; F1008-I1121 PolarHBondContact N-O 2.78Å; F1008-I1121 VanDerWaalsContact N-O 3.14Å; F1008-I1121 PolarHBondContact O-N 3.44Å; L1010-I1121 HydrophobicContact CD1-CD1 4.04Å; L1010-I1121 HydrophobicContact CD1-CG1 4.07Å; L1010-I1121 HydrophobicContact CD2-CD1 4.45Å; A1024-I1121 HydrophobicContact CB-CD1 3.82Å; T1026-I1121 HydrophobicContact CG2-CG2 4.48Å; V1039-I1121 HydrophobicContact CG1-CG2 3.8Å; D1040-I1121 WeakPolarHBondContact O-CA 3.38Å; V1041-I1121 HydrophobicContact CB-CG1 4.43Å; V1041-I1121 HydrophobicContact CG1-CD1 4.46Å; V1041-I1121 HydrophobicContact CG1-CG1 4.1Å; V1041-I1121 HydrophobicContact CG2-CD1 4.21Å; V1041-I1121 HydrophobicContact CG2-CG1 4.07Å; V1041-I1121 HydrophobicContact CG2-CG2 4.18Å; M1118-I1121 HydrophobicContact CE-CD1 3.93Å; M1118-I1121 HydrophobicContact CE-CG1 3.19Å; M1118-I1121 HydrophobicContact SD-CD1 4.02Å; M1118-I1121 HydrophobicContact SD-CG1 4.24Å; I1121-V1123 HydrophobicContact CG2-CG2 4.3Å; I1121-V1132 HydrophobicContact CB-CG1 4.15Å; I1121-V1132 HydrophobicContact CB-CG2 4.24Å; I1121-V1132 HydrophobicContact CD1-CG1 3.88Å; I1121-V1132 VanDerWaalsContact CD1-CG1 3.45Å; I1121-V1132 HydrophobicContact CG1-CG1 4.16Å; I1121-V1132 HydrophobicContact CG2-CG2 4.18Å
1122	E	83.7	Confident	79.9	Confident	59.2 Å²	59.2	40 Å²	40	28%	0.277	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	136.9	178.8	-72.5	165.1	-160.2	0	0	109.6	P1005 V1039 D1040 K1042 T1120	P1005-E1122 HydrophobicContact CG-CG 4.46Å; V1039-E1122 CarbonylContact C-O 3.48Å; V1039-E1122 WeakPolarHBondContact CA-O 3.31Å; D1040-E1122 HydrophobicContact CB-CB 4.32Å; D1040-E1122 PolarHBondContact N-O 2.96Å; D1040-E1122 PolarHBondContact O-N 3.07Å; K1042-E1122 VanDerWaalsContact CE-OE1 3.29Å; K1042-E1122 WeakPolarHBondContact CE-OE1 3.36Å; K1042-E1122 WeakPolarHBondContact CE-OE2 3.36Å; K1042-E1122 IonicContact NZ-OE1 2.74Å; K1042-E1122 PolarHBondContact NZ-OE1 3.01Å; K1042-E1122 IonicContact NZ-OE2 3.34Å; K1042-E1122 PolarHBondContact NZ-OE2 2.95Å; T1120-E1122 WeakPolarHBondContact CB-OE1 3.39Å; T1120-E1122 HydrophobicContact CG2-CG 4.19Å; T1120-E1122 PolarHBondContact OG1-OE1 3.2Å
1123	V	86.3	Confident	79.6	Confident	11.4 Å²	11.4	41.1 Å²	41.1	7%	0.069	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	128.4	-178.1	-179.1	0	0	0	0	108.7	L996 T1026 V1028 R1038 V1039 I1121 V1127 Y1130	L996-V1123 HydrophobicContact CD1-CG1 4.42Å; L996-V1123 VanDerWaalsContact CD1-O 3.28Å; L996-V1123 WeakPolarHBondContact CD1-O 3.31Å; T1026-V1123 HydrophobicContact CG2-CG2 3.61Å; V1028-V1123 HydrophobicContact CG1-CG1 4.34Å; V1028-V1123 HydrophobicContact CG2-CG1 4.24Å; R1038-V1123 CarbonylContact O-C 3.52Å; R1038-V1123 WeakPolarHBondContact O-CA 3.4Å; V1039-V1123 HydrophobicContact CG1-CG2 4.24Å; V1039-V1123 HydrophobicContact CG2-CG1 4.35Å; V1039-V1123 HydrophobicContact CG2-CG2 4.17Å; I1121-V1123 HydrophobicContact CG2-CG2 4.3Å; V1123-V1127 HydrophobicContact CG1-CB 4.3Å; V1123-V1127 HydrophobicContact CG1-CG1 4Å; V1123-V1127 HydrophobicContact CG1-CG2 3.83Å; V1123-Y1130 HydrophobicContact CB-CD1 3.7Å; V1123-Y1130 HydrophobicContact CB-CD2 3.83Å; V1123-Y1130 HydrophobicContact CB-CE1 3.82Å; V1123-Y1130 HydrophobicContact CB-CE2 3.92Å; V1123-Y1130 HydrophobicContact CB-CG 3.79Å; V1123-Y1130 HydrophobicContact CG1-CD1 4.02Å; V1123-Y1130 HydrophobicContact CG1-CD2 4.4Å; V1123-Y1130 HydrophobicContact CG1-CE1 4.37Å; V1123-Y1130 HydrophobicContact CG1-CG 4.08Å; V1123-Y1130 HydrophobicContact CG2-CD1 4.21Å; V1123-Y1130 HydrophobicContact CG2-CD2 3.6Å; V1123-Y1130 VanDerWaalsContact CG2-CD2 3.44Å; V1123-Y1130 HydrophobicContact CG2-CE1 4.34Å; V1123-Y1130 HydrophobicContact CG2-CE2 3.64Å; V1123-Y1130 HydrophobicContact CG2-CG 3.81Å
1124	S	86.5	Confident	79.4	Confident	45.6 Å²	45.6	41.8 Å²	41.8	32%	0.319	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	174.1	-172.2	57.7	0	0	0	0	112.8	F1037 R1038 V1127	F1037-S1124 CarbonylContact C-O 3.52Å; F1037-S1124 VanDerWaalsContact CA-O 3.24Å; F1037-S1124 WeakPolarHBondContact CA-O 3.33Å; F1037-S1124 WeakPolarHBondContact CB-O 3.38Å; R1038-S1124 PolarHBondContact N-O 3.03Å; R1038-S1124 PolarHBondContact O-N 3.1Å; S1124-V1127 WeakPolarHBondContact O-CG2 3.42Å
1125	G	87	Confident	79.1	Confident	32.2 Å²	32.2	44.9 Å²	44.9	33%	0.332	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	90	-147.4	-173.7	0	0	0	0	0	113.3	K1031 V1127	K1031-G1125 PolarHBondContact NZ-O 3.14Å; G1125-V1127 PolarHBondContact O-N 3.14Å
1126	D	87.2	Confident	78.8	Confident	40.4 Å²	40.4	48.1 Å²	48.1	22%	0.216	26%	0.258	C	S	.	.	S	Bend	trans	-78.8	40.8	-172.5	-60.6	-49.8	0	0	0	113.7	L1030 K1031 A1034 Q1035 N1036 D1128	L1030-D1126 WeakPolarHBondContact CA-O 3.37Å; K1031-D1126 PolarHBondContact N-O 2.99Å; A1034-D1126 HydrophobicContact CB-CB 3.43Å; A1034-D1126 VanDerWaalsContact CB-CB 3.43Å; Q1035-D1126 WeakPolarHBondContact CA-OD2 3.34Å; Q1035-D1126 PolarHBondContact N-OD2 3.08Å; N1036-D1126 PolarHBondContact N-OD2 2.83Å; N1036-D1126 PolarHBondContact ND2-OD2 3.1Å; N1036-D1126 WeakPolarHBondContact O-CA 3.28Å; N1036-D1126 VanDerWaalsContact O-CB 3.27Å; N1036-D1126 WeakPolarHBondContact O-CB 3.31Å; N1036-D1126 PolarHBondContact O-N 3.05Å; N1036-D1126 VanDerWaalsContact O-OD2 3.07Å; D1126-D1128 PolarHBondContact O-N 2.73Å
1127	V	83.2	Confident	78.3	Confident	7.4 Å²	7.4	44.9 Å²	44.9	5%	0.045	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	123.6	-177.6	178.1	0	0	0	0	110.3	L996 V1028 A1029 L1030 K1031 F1037 V1123 S1124 G1125 N1129 Y1130	L996-V1127 HydrophobicContact CD1-CB 3.74Å; L996-V1127 HydrophobicContact CD1-CG1 3.86Å; L996-V1127 HydrophobicContact CD1-CG2 4.49Å; V1028-V1127 HydrophobicContact CG1-CB 4.38Å; V1028-V1127 HydrophobicContact CG1-CG1 3.91Å; V1028-V1127 HydrophobicContact CG1-CG2 3.79Å; A1029-V1127 CarbonylContact O-C 3.48Å; A1029-V1127 VanDerWaalsContact O-CA 3.28Å; A1029-V1127 WeakPolarHBondContact O-CA 3.46Å; A1029-V1127 WeakPolarHBondContact O-CG1 3.35Å; L1030-V1127 HydrophobicContact CD2-CB 4.46Å; L1030-V1127 HydrophobicContact CD2-CG2 3.89Å; K1031-V1127 VanDerWaalsContact CE-O 3.24Å; K1031-V1127 WeakPolarHBondContact CE-O 3.2Å; F1037-V1127 HydrophobicContact CB-CG2 3.5Å; F1037-V1127 VanDerWaalsContact CB-CG2 3.47Å; F1037-V1127 HydrophobicContact CD2-CG2 3.98Å; F1037-V1127 HydrophobicContact CG-CG2 4.25Å; V1123-V1127 HydrophobicContact CG1-CB 4.3Å; V1123-V1127 HydrophobicContact CG1-CG1 4Å; V1123-V1127 HydrophobicContact CG1-CG2 3.83Å; S1124-V1127 WeakPolarHBondContact O-CG2 3.42Å; G1125-V1127 PolarHBondContact O-N 3.14Å; V1127-N1129 VanDerWaalsContact CG1-N 3.28Å; V1127-N1129 WeakPolarHBondContact CG1-O 3.26Å; V1127-N1129 PolarHBondContact O-N 3.45Å; V1127-N1129 VanDerWaalsContact O-N 3.15Å; V1127-Y1130 HydrophobicContact CG1-CD1 4.29Å
1128	D	78.2	Confident	77.1	Confident	68.2 Å²	68.2	49.2 Å²	49.2	37%	0.365	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	-35.3	171.3	-171.9	71.1	0	0	0	110.1	L916 L995 A1029 K1031 D1126	L916-D1128 WeakPolarHBondContact CD2-OD2 3.18Å; L995-D1128 WeakPolarHBondContact CD1-O 3.23Å; A1029-D1128 CarbonylContact C-O 3.51Å; A1029-D1128 WeakPolarHBondContact CB-O 3.03Å; A1029-D1128 CarbonylContact O-C 3.59Å; A1029-D1128 WeakPolarHBondContact O-CA 3.27Å; A1029-D1128 WeakPolarHBondContact O-CB 3.41Å; A1029-D1128 PolarHBondContact O-N 3Å; K1031-D1128 HydrophobicContact CG-CB 4.16Å; K1031-D1128 WeakPolarHBondContact CG-OD1 3.26Å; D1126-D1128 PolarHBondContact O-N 2.73Å
1129	N	78.4	Confident	75.5	Confident	43 Å²	43	55.2 Å²	55.2	23%	0.23	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.8	155.2	175.9	104.7	67.8	0	0	0	113.3	L916 K918 L961 K993 G994 A1029 V1127	L916-N1129 HydrophobicContact CD1-CB 4Å; L916-N1129 WeakPolarHBondContact CD1-ND2 3.41Å; K918-N1129 WeakPolarHBondContact CG-ND2 3.34Å; L961-N1129 HydrophobicContact CB-CB 4.35Å; L961-N1129 WeakPolarHBondContact CB-ND2 2.97Å; L961-N1129 WeakPolarHBondContact CB-OD1 3.45Å; L961-N1129 HydrophobicContact CD1-CB 3.25Å; L961-N1129 VanDerWaalsContact CD1-ND2 3.33Å; L961-N1129 WeakPolarHBondContact CD1-ND2 3.37Å; L961-N1129 HydrophobicContact CG-CB 4.29Å; K993-N1129 WeakPolarHBondContact CE-OD1 3.45Å; K993-N1129 PolarHBondContact NZ-OD1 3.23Å; G994-N1129 WeakPolarHBondContact O-CA 3.36Å; G994-N1129 WeakPolarHBondContact O-CB 3.43Å; A1029-N1129 WeakPolarHBondContact CB-ND2 3.29Å; A1029-N1129 WeakPolarHBondContact CB-O 3.43Å; A1029-N1129 WeakPolarHBondContact CB-OD1 3.33Å; A1029-N1129 PolarHBondContact N-O 2.98Å; A1029-N1129 PolarHBondContact O-N 3.24Å; A1029-N1129 VanDerWaalsContact O-N 3.17Å; V1127-N1129 VanDerWaalsContact CG1-N 3.28Å; V1127-N1129 WeakPolarHBondContact CG1-O 3.26Å; V1127-N1129 PolarHBondContact O-N 3.45Å; V1127-N1129 VanDerWaalsContact O-N 3.15Å
1130	Y	82.7	Confident	73.7	Confident	35.8 Å²	35.8	59.8 Å²	59.8	14%	0.14	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	160.6	175.1	70.3	-82.5	0	0	0	113.4	L961 K993 G994 L996 P1006 F1008 T1026 N1027 V1123 V1127 V1132	L961-Y1130 WeakPolarHBondContact CD2-O 3.18Å; K993-Y1130 CarbonylContact C-O 3.44Å; K993-Y1130 VanDerWaalsContact CA-O 3.29Å; K993-Y1130 WeakPolarHBondContact CA-O 3.43Å; K993-Y1130 VanDerWaalsContact CG-O 3.3Å; K993-Y1130 WeakPolarHBondContact CG-O 3.48Å; G994-Y1130 PolarHBondContact N-O 3.02Å; G994-Y1130 PolarHBondContact O-N 2.76Å; G994-Y1130 VanDerWaalsContact O-N 3.13Å; L996-Y1130 HydrophobicContact CD1-CD1 3.89Å; L996-Y1130 HydrophobicContact CD1-CE1 4.14Å; L996-Y1130 HydrophobicContact CD2-CE1 4.41Å; L996-Y1130 HydrophobicContact CG-CD1 4.38Å; L996-Y1130 HydrophobicContact CG-CE1 4.1Å; P1006-Y1130 HydrophobicContact CG-CE1 4.26Å; P1006-Y1130 WeakPolarHBondContact CG-OH 3.37Å; P1006-Y1130 PolarHBondContact O-OH 3.26Å; P1006-Y1130 VanDerWaalsContact O-OH 3.1Å; F1008-Y1130 HydrophobicContact CD1-CE2 4.4Å; F1008-Y1130 AromaticContact CD2-CE2 3.78Å; F1008-Y1130 HydrophobicContact CD2-CE2 3.78Å; F1008-Y1130 AromaticContact CD2-CZ 3.88Å; F1008-Y1130 VanDerWaalsContact CD2-OH 3.25Å; F1008-Y1130 WeakPolarHBondContact CD2-OH 3.28Å; F1008-Y1130 HydrophobicContact CE1-CE2 4.2Å; F1008-Y1130 AromaticContact CE2-CE2 3.58Å; F1008-Y1130 HydrophobicContact CE2-CE2 3.58Å; F1008-Y1130 AromaticContact CE2-CZ 3.51Å; F1008-Y1130 WeakPolarHBondContact CE2-OH 3.48Å; F1008-Y1130 HydrophobicContact CG-CE2 4.21Å; F1008-Y1130 AromaticContact CZ-CE2 3.81Å; F1008-Y1130 HydrophobicContact CZ-CE2 3.81Å; T1026-Y1130 HydrophobicContact CG2-CD2 4.29Å; N1027-Y1130 CarbonylContact O-C 3.5Å; N1027-Y1130 WeakPolarHBondContact O-CA 3.39Å; N1027-Y1130 VanDerWaalsContact O-CB 3.3Å; N1027-Y1130 WeakPolarHBondContact O-CB 3.37Å; V1123-Y1130 HydrophobicContact CB-CD1 3.7Å; V1123-Y1130 HydrophobicContact CB-CD2 3.83Å; V1123-Y1130 HydrophobicContact CB-CE1 3.82Å; V1123-Y1130 HydrophobicContact CB-CE2 3.92Å; V1123-Y1130 HydrophobicContact CB-CG 3.79Å; V1123-Y1130 HydrophobicContact CG1-CD1 4.02Å; V1123-Y1130 HydrophobicContact CG1-CD2 4.4Å; V1123-Y1130 HydrophobicContact CG1-CE1 4.37Å; V1123-Y1130 HydrophobicContact CG1-CG 4.08Å; V1123-Y1130 HydrophobicContact CG2-CD1 4.21Å; V1123-Y1130 HydrophobicContact CG2-CD2 3.6Å; V1123-Y1130 VanDerWaalsContact CG2-CD2 3.44Å; V1123-Y1130 HydrophobicContact CG2-CE1 4.34Å; V1123-Y1130 HydrophobicContact CG2-CE2 3.64Å; V1123-Y1130 HydrophobicContact CG2-CG 3.81Å; V1127-Y1130 HydrophobicContact CG1-CD1 4.29Å; Y1130-V1132 HydrophobicContact CD2-CG2 4.14Å; Y1130-V1132 HydrophobicContact CE2-CG2 4.19Å
1131	S	73.5	Confident	71.5	Confident	31.4 Å²	31.4	66.2 Å²	66.2	22%	0.22	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	148.7	166.4	66.5	0	0	0	0	110.3	L961 Q992 T1026 N1027	L961-S1131 VanDerWaalsContact CD2-N 3.32Å; Q992-S1131 VanDerWaalsContact O-CA 3.3Å; Q992-S1131 WeakPolarHBondContact O-CA 3.24Å; Q992-S1131 WeakPolarHBondContact O-CB 3.34Å; T1026-S1131 CarbonylContact C-O 3.49Å; T1026-S1131 VanDerWaalsContact CA-O 3.27Å; T1026-S1131 WeakPolarHBondContact CA-O 3.39Å; N1027-S1131 WeakPolarHBondContact CB-OG 3.26Å; N1027-S1131 PolarHBondContact N-O 3.2Å; N1027-S1131 PolarHBondContact ND2-OG 3.01Å; N1027-S1131 VanDerWaalsContact ND2-OG 3.09Å; N1027-S1131 PolarHBondContact O-N 2.91Å; N1027-S1131 VanDerWaalsContact O-N 3.09Å
1132	V	78.3	Confident	69.2	Low	33.4 Å²	33.4	71.1 Å²	71.1	20%	0.202	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	126.4	177.6	-178.7	0	0	0	0	109.4	I991 F1008 L1010 T1025 T1026 I1121 Y1130 T1134	I991-V1132 PolarHBondContact N-O 3.03Å; F1008-V1132 HydrophobicContact CD1-CB 4.23Å; F1008-V1132 HydrophobicContact CD1-CG2 3.96Å; F1008-V1132 HydrophobicContact CE1-CG2 4.49Å; L1010-V1132 HydrophobicContact CD2-CG1 4.08Å; T1025-V1132 CarbonylContact O-C 3.58Å; T1025-V1132 WeakPolarHBondContact O-CA 3.32Å; T1026-V1132 HydrophobicContact CG2-CG2 4.23Å; I1121-V1132 HydrophobicContact CB-CG1 4.15Å; I1121-V1132 HydrophobicContact CB-CG2 4.24Å; I1121-V1132 HydrophobicContact CD1-CG1 3.88Å; I1121-V1132 VanDerWaalsContact CD1-CG1 3.45Å; I1121-V1132 HydrophobicContact CG1-CG1 4.16Å; I1121-V1132 HydrophobicContact CG2-CG2 4.18Å; Y1130-V1132 HydrophobicContact CD2-CG2 4.14Å; Y1130-V1132 HydrophobicContact CE2-CG2 4.19Å; V1132-T1134 HydrophobicContact CG1-CG2 4.22Å
1133	D	73.6	Confident	66.8	Low	68.4 Å²	68.4	74 Å²	74	37%	0.366	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	131.2	171.6	-82.8	-52.5	0	0	0	109.2	T990 A1024 T1025 N1027 R1321	T990-D1133 VanDerWaalsContact CA-OD1 3.28Å; T990-D1133 WeakPolarHBondContact CA-OD1 3.32Å; T990-D1133 VanDerWaalsContact CB-OD1 3.22Å; T990-D1133 WeakPolarHBondContact CB-OD1 3.5Å; T990-D1133 WeakPolarHBondContact CG2-OD1 3.14Å; T990-D1133 PolarHBondContact OG1-OD1 3.17Å; A1024-D1133 CarbonylContact C-O 3.53Å; A1024-D1133 WeakPolarHBondContact CA-O 3.33Å; T1025-D1133 WeakPolarHBondContact CB-O 3.41Å; T1025-D1133 PolarHBondContact N-O 3.18Å; T1025-D1133 PolarHBondContact O-N 2.85Å; N1027-D1133 PolarHBondContact ND2-OD2 2.93Å; D1133-R1321 IonicContact OD1-NH1 3.58Å
1134	T	76.6	Confident	64.1	Low	36.6 Å²	36.6	79 Å²	79	23%	0.225	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	138.1	179.7	52	0	0	0	0	112.3	T989 L1010 P1021 T1023 A1024 M1118 V1132 Y1136	T989-T1134 PolarHBondContact N-O 2.88Å; T989-T1134 PolarHBondContact O-N 2.94Å; T989-T1134 PolarHBondContact O-OG1 2.87Å; T989-T1134 VanDerWaalsContact O-OG1 3.09Å; L1010-T1134 HydrophobicContact CD2-CG2 4.01Å; P1021-T1134 HydrophobicContact CB-CG2 4.22Å; P1021-T1134 HydrophobicContact CG-CG2 4.45Å; T1023-T1134 CarbonylContact O-C 3.56Å; T1023-T1134 WeakPolarHBondContact O-CA 3.36Å; A1024-T1134 HydrophobicContact CB-CG2 4.07Å; M1118-T1134 HydrophobicContact CE-CG2 3.99Å; V1132-T1134 HydrophobicContact CG1-CG2 4.22Å; T1134-Y1136 HydrophobicContact CG2-CE2 4.43Å; T1134-Y1136 WeakPolarHBondContact OG1-CE2 3.42Å
1135	E	74	Confident	61.5	Low	78.6 Å²	78.6	81.8 Å²	81.8	37%	0.367	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	120	177.2	-171.1	-171.5	168.6	0	0	109.5	F986 P1021 K1022 T1023 P1343	F986-E1135 HydrophobicContact CB-CG 4.01Å; F986-E1135 HydrophobicContact CD1-CG 4.47Å; F986-E1135 HydrophobicContact CG-CG 4.4Å; P1021-E1135 CarbonylContact C-O 3.51Å; P1021-E1135 VanDerWaalsContact C-O 3.27Å; P1021-E1135 WeakPolarHBondContact CA-O 3.43Å; P1021-E1135 WeakPolarHBondContact CB-O 3.37Å; K1022-E1135 WeakPolarHBondContact CE-OE1 3.31Å; K1022-E1135 PolarHBondContact N-O 2.97Å; K1022-E1135 IonicContact NZ-OE1 3.02Å; K1022-E1135 PolarHBondContact NZ-OE1 3.12Å; K1022-E1135 IonicContact NZ-OE2 3.15Å; T1023-E1135 WeakPolarHBondContact CG2-OE2 3.3Å; T1023-E1135 PolarHBondContact N-O 3.33Å; T1023-E1135 PolarHBondContact O-N 3.05Å; T1023-E1135 VanDerWaalsContact OG1-CB 3.24Å; T1023-E1135 WeakPolarHBondContact OG1-CB 3.31Å; T1023-E1135 PolarHBondContact OG1-OE2 3.17Å; E1135-P1343 VanDerWaalsContact OE1-O 3.08Å
1136	Y	70.8	Confident	59	Low	86.8 Å²	86.8	88.4 Å²	88.4	34%	0.34	47%	0.468	S	S	.	.			trans	-100.6	141.6	178.3	-67.4	-92.5	0	0	0	111.1	R964 V987 L1010 I1019 P1021 T1134	R964-Y1136 PolarHBondContact NH2-O 3.29Å; R964-Y1136 VanDerWaalsContact NH2-O 3.13Å; V987-Y1136 PolarHBondContact N-O 2.84Å; V987-Y1136 PolarHBondContact O-N 3.48Å; L1010-Y1136 PolarHBondContact O-OH 2.83Å; I1019-Y1136 HydrophobicContact CB-CD1 3.97Å; I1019-Y1136 HydrophobicContact CG2-CD1 4.23Å; I1019-Y1136 HydrophobicContact CG2-CG 4.44Å; I1019-Y1136 VanDerWaalsContact O-CD1 3.27Å; I1019-Y1136 WeakPolarHBondContact O-CD1 3.29Å; I1019-Y1136 VanDerWaalsContact O-CE1 3.27Å; I1019-Y1136 WeakPolarHBondContact O-CE1 3.37Å; P1021-Y1136 HydrophobicContact CB-CD1 4.06Å; P1021-Y1136 HydrophobicContact CB-CD2 4.36Å; P1021-Y1136 HydrophobicContact CB-CE1 3.93Å; P1021-Y1136 HydrophobicContact CB-CE2 4.35Å; P1021-Y1136 HydrophobicContact CB-CG 4.3Å; P1021-Y1136 HydrophobicContact CG-CE1 4.3Å; T1134-Y1136 HydrophobicContact CG2-CE2 4.43Å; T1134-Y1136 WeakPolarHBondContact OG1-CE2 3.42Å
1137	P	60.1	Low	56.3	Low	58 Å²	58	96.3 Å²	96.3	38%	0.377	50%	0.5	S	S	.	.			trans	-67	145.9	173.6	29.4	-33.4	0	0	0	111	I1019 L1020 K1022 K1139	I1019-P1137 HydrophobicContact CG2-CG 3.67Å; I1019-P1137 VanDerWaalsContact CG2-CG 3.41Å; L1020-P1137 WeakPolarHBondContact O-CD 3.3Å; K1022-P1137 HydrophobicContact CB-CB 4.36Å; P1137-K1139 PolarHBondContact O-N 3.12Å
1138	E	44.9	Very low	53.9	Low	151.6 Å²	151.6	99.3 Å²	99.3	71%	0.708	53%	0.532	S	S	*	.			trans	-66.7	124.3	179	-65.1	-177.8	139.8	0	0	111.3	P967 V987 K1140	P967-E1138 WeakPolarHBondContact CG-OE1 3.32Å; V987-E1138 HydrophobicContact CG2-CG 4.09Å; E1138-K1140 VanDerWaalsContact C-N 3.29Å; E1138-K1140 PolarHBondContact O-N 2.99Å; E1138-K1140 VanDerWaalsContact O-N 3.14Å
1139	K	42.2	Very low	51.7	Low	142.8 Å²	142.8	104.7 Å²	104.7	62%	0.621	55%	0.553	S	S	*	*			trans	-64.4	106.1	171.6	-86.6	-169.4	177.4	-176.1	0	109.3	G1016 T1017 I1019 P1137 Q1141	G1016-K1139 PolarHBondContact O-NZ 2.94Å; T1017-K1139 VanDerWaalsContact O-CE 3.23Å; T1017-K1139 WeakPolarHBondContact O-CE 3.42Å; T1017-K1139 PolarHBondContact O-NZ 3.26Å; T1017-K1139 PolarHBondContact OG1-NZ 3.46Å; I1019-K1139 HydrophobicContact CD1-CB 4.33Å; I1019-K1139 HydrophobicContact CD1-CD 4.12Å; I1019-K1139 HydrophobicContact CD1-CG 3.76Å; I1019-K1139 VanDerWaalsContact CD1-CG 3.49Å; I1019-K1139 HydrophobicContact CG1-CD 3.83Å; I1019-K1139 HydrophobicContact CG1-CG 4.27Å; P1137-K1139 PolarHBondContact O-N 3.12Å; K1139-Q1141 PolarHBondContact O-N 3.01Å
1140	K	37.9	Very low	49.4	Very low	169.2 Å²	169.2	108.7 Å²	108.7	74%	0.736	57%	0.574	S	S	*	*			trans	-67.1	126	160.8	-72.1	-165.1	175.6	-174.4	0	108.1	E1138 V1142 N1347 E1348	E1138-K1140 VanDerWaalsContact C-N 3.29Å; E1138-K1140 PolarHBondContact O-N 2.99Å; E1138-K1140 VanDerWaalsContact O-N 3.14Å; K1140-V1142 PolarHBondContact O-N 3.04Å; K1140-V1142 VanDerWaalsContact O-N 3.16Å; K1140-N1347 HydrophobicContact CD-CB 4.05Å; K1140-N1347 PolarHBondContact NZ-O 2.99Å; K1140-E1348 PolarHBondContact NZ-O 2.69Å
1141	Q	32.6	Very low	47	Very low	174.2 Å²	174.2	114.5 Å²	114.5	81%	0.814	61%	0.606	S	S	*	*			trans	-66.8	129.6	172.2	-72.8	176.7	-48.2	0	0	109.5	K1139 P1143	K1139-Q1141 PolarHBondContact O-N 3.01Å; Q1141-P1143 VanDerWaalsContact O-CD 3.31Å; Q1141-P1143 WeakPolarHBondContact O-CD 3.27Å
1142	V	34.5	Very low	44.9	Very low	119.8 Å²	119.8	120.9 Å²	120.9	73%	0.726	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-100.6	129.6	172.6	-178.8	0	0	0	0	107.3	K1140 S1144	K1140-V1142 PolarHBondContact O-N 3.04Å; K1140-V1142 VanDerWaalsContact O-N 3.16Å; V1142-S1144 PolarHBondContact O-N 2.93Å
1143	P	33.2	Very low	42.7	Very low	119.4 Å²	119.4	125.2 Å²	125.2	78%	0.775	65%	0.654	S	S	*	*	P	Polyproline II helix	trans	-73.8	139.1	174.4	13.5	-8.6	0	0	0	110.6	Q1141 S1145	Q1141-P1143 VanDerWaalsContact O-CD 3.31Å; Q1141-P1143 WeakPolarHBondContact O-CD 3.27Å; P1143-S1145 PolarHBondContact O-N 2.85Å
1144	S	30.6	Very low	40.7	Very low	116.6 Å²	116.6	129.2 Å²	129.2	82%	0.815	67%	0.668	S	S	*	*	P	Polyproline II helix	trans	-100.8	134.1	177.2	53.1	0	0	0	0	111.6	V1142	V1142-S1144 PolarHBondContact O-N 2.93Å
1145	S	32	Very low	38.5	Very low	104 Å²	104	134.2 Å²	134.2	73%	0.727	69%	0.693	S	S	*	*			trans	-118.6	142.1	173.5	54.4	0	0	0	0	112.5	P1143	P1143-S1145 PolarHBondContact O-N 2.85Å
1146	E	33.8	Very low	36.5	Very low	171.8 Å²	171.8	136.5 Å²	136.5	80%	0.803	71%	0.713	S	S	*	*				-172.3	132.2	116.6	-103.1	158.4	-155.6	0	0	110.6
1147	K	31.4	Very low	34.5	Very low	204.6 Å²	204.6	139.6 Å²	139.6	89%	0.89	73%	0.731	S	S	*	*				112.6	120.7	87.8	-98.7	-171.8	176.7	169.3	0	114.5
1148	G	31.6	Very low	33	Very low	70.6 Å²	70.6	144.9 Å²	144.9	73%	0.728	75%	0.748	S	S	*	*			trans	128.1	145.3	157.1	0	0	0	0	0	113.1
1149	K	31.8	Very low	32.4	Very low	183 Å²	183	144.8 Å²	144.8	80%	0.796	75%	0.752	S	S	*	*			cis	155.9	141.5	17.9	-91.6	-172.3	157.3	-124.1	0	111
1150	D	30	Very low	31.7	Very low	125.6 Å²	125.6	146.7 Å²	146.7	67%	0.672	76%	0.76	S	S	*	*				96.2	152.5	96.2	-64.7	-30.5	0	0	0	114.8
1151	I	33.7	Very low	31.3	Very low	158.4 Å²	158.4	144.8 Å²	144.8	81%	0.812	76%	0.758	S	S	*	*			trans	113.3	133.6	151.2	-71.7	161.5	0	0	0	113.8
1152	E	28.9	Very low	31.2	Very low	166.4 Å²	166.4	143.2 Å²	143.2	78%	0.778	76%	0.755	S	S	*	*			trans	-10.6	159.7	158.9	-75.7	175.8	139.9	0	0	113.6	K1154	E1152-K1154 IonicContact OE1-NZ 3.89Å; E1152-K1154 PolarHBondContact OE1-NZ 2.82Å
1153	D	32.1	Very low	30.9	Very low	122 Å²	122	142 Å²	142	65%	0.652	76%	0.757	S	S	*	*				156.3	151.5	57.8	-112.4	-7	0	0	0	113.6
1154	K	31.3	Very low	30.8	Very low	152.8 Å²	152.8	142.4 Å²	142.4	66%	0.664	75%	0.754	S	S	*	*				106	128.8	94.1	-88.7	176.4	-166	114.7	0	114.9	E1152	E1152-K1154 IonicContact OE1-NZ 3.89Å; E1152-K1154 PolarHBondContact OE1-NZ 2.82Å
1155	D	31.3	Very low	30.7	Very low	142.2 Å²	142.2	140.2 Å²	140.2	76%	0.76	74%	0.742	S	S	*	*			trans	64.8	133.7	130.3	-68.3	-34	0	0	0	119.3
1156	T	30.5	Very low	30.5	Very low	127.6 Å²	127.6	139.2 Å²	139.2	78%	0.783	74%	0.735	S	S	*	*				151.6	121.1	125.4	-53.1	0	0	0	0	113
1157	E	30.1	Very low	30.3	Very low	151.8 Å²	151.8	138.7 Å²	138.7	71%	0.709	73%	0.731	S	S	*	*			trans	50.2	140.7	134.5	-107.7	-165.7	151.6	0	0	118.7
1158	K	29.1	Very low	30.3	Very low	168.2 Å²	168.2	136.3 Å²	136.3	73%	0.731	72%	0.722	S	S	*	*			trans	100.4	132.4	136.9	-88.9	166.6	-170.9	145.4	0	116.3
1159	N	30.9	Very low	30.1	Very low	150.2 Å²	150.2	138.4 Å²	138.4	80%	0.803	72%	0.716	S	S	*	*			trans	-133.1	134.9	145.4	-72	-44.1	0	0	0	111.1
1160	K	28.4	Very low	30	Very low	181.8 Å²	181.8	134 Å²	134	79%	0.79	71%	0.709	S	S	*	*				81.5	139.5	117.1	-76.5	-169.7	171.3	-175.5	0	113.7	N1225	K1160-N1225 PolarHBondContact O-ND2 3.33Å
1161	D	29.3	Very low	30.2	Very low	129.8 Å²	129.8	136.8 Å²	136.8	69%	0.694	71%	0.71	S	S	*	*				143.6	137.8	124.8	-66.9	-32.5	0	0	0	112.2
1162	D	30.2	Very low	30.1	Very low	141.2 Å²	141.2	134.5 Å²	134.5	76%	0.755	71%	0.705	S	S	*	*			trans	97.1	116.9	154.6	-86.6	-22.4	0	0	0	117.1	W1227	D1162-W1227 VanDerWaalsContact OD2-CE2 3.26Å; D1162-W1227 WeakPolarHBondContact OD2-CZ2 3.16Å; D1162-W1227 PolarHBondContact OD2-NE1 3.31Å
1163	A	28.5	Very low	30.7	Very low	93 Å²	93	131.9 Å²	131.9	77%	0.769	69%	0.692	S	S	*	*			trans	-105.8	151.2	165.6	0	0	0	0	0	113.2
1164	D	30.7	Very low	31.4	Very low	129.4 Å²	129.4	133.5 Å²	133.5	69%	0.692	69%	0.693	S	S	*	*				-168.8	139	68.1	-154.1	9.4	0	0	0	114	R1063 S1166 N1283	R1063-D1164 IonicContact CZ-OD1 2.69Å; R1063-D1164 VanDerWaalsContact CZ-OD1 3.27Å; R1063-D1164 IonicContact NH1-OD1 2.67Å; R1063-D1164 PolarHBondContact NH1-OD1 3.26Å; R1063-D1164 IonicContact NH2-OD1 3.99Å; R1063-D1164 PolarHBondContact NH2-OD1 3.1Å; D1164-S1166 PolarHBondContact O-OG 2.93Å; D1164-N1283 PolarHBondContact OD2-ND2 3.49Å
1165	A	28.5	Very low	32.6	Very low	70.2 Å²	70.2	131.8 Å²	131.8	58%	0.58	69%	0.687	S	S	*	*			trans	-106.2	92.5	164	0	0	0	0	0	116.4	P1112 N1283	P1112-A1165 HydrophobicContact CB-CB 4.13Å; P1112-A1165 HydrophobicContact CG-CB 3.66Å; A1165-N1283 PolarHBondContact O-ND2 2.03Å
1166	S	27.8	Very low	34.3	Very low	83.4 Å²	83.4	125.3 Å²	125.3	58%	0.583	65%	0.654	S	S	*	*			trans	-136.4	114.9	155.7	51.7	0	0	0	0	114.8	F1097 D1164 Q1168 K1279 V1281	F1097-S1166 WeakPolarHBondContact CZ-O 3.4Å; D1164-S1166 PolarHBondContact O-OG 2.93Å; S1166-Q1168 PolarHBondContact O-N 3.26Å; S1166-K1279 WeakPolarHBondContact OG-CE 3.39Å; S1166-K1279 PolarHBondContact OG-NZ 3.49Å; S1166-K1279 VanDerWaalsContact OG-NZ 3.09Å; S1166-V1281 WeakPolarHBondContact OG-CG1 3.37Å; S1166-V1281 WeakPolarHBondContact OG-CG2 3.44Å
1167	K	30.1	Very low	36.8	Very low	161.2 Å²	161.2	121.3 Å²	121.3	70%	0.701	63%	0.63	S	S	*	*			trans	-111.5	115.5	166	-80.5	168.7	-175.2	165.9	0	111.6	F1097 L1169 V1286 Q1287 Y1289	F1097-K1167 HydrophobicContact CE1-CG 3.71Å; F1097-K1167 VanDerWaalsContact CE2-CA 3.49Å; F1097-K1167 HydrophobicContact CE2-CB 3.87Å; F1097-K1167 HydrophobicContact CE2-CG 3.82Å; F1097-K1167 VanDerWaalsContact CZ-CA 3.41Å; F1097-K1167 HydrophobicContact CZ-CB 3.68Å; F1097-K1167 HydrophobicContact CZ-CD 4.46Å; F1097-K1167 HydrophobicContact CZ-CG 3.17Å; K1167-L1169 PolarHBondContact O-N 3.33Å; K1167-V1286 PolarHBondContact NZ-O 2.72Å; K1167-Q1287 PolarHBondContact NZ-O 3.06Å; K1167-Y1289 HydrophobicContact CB-CD1 4.08Å; K1167-Y1289 HydrophobicContact CB-CE1 3.46Å; K1167-Y1289 VanDerWaalsContact CB-CE1 3.46Å; K1167-Y1289 HydrophobicContact CB-CE2 4.08Å; K1167-Y1289 VanDerWaalsContact CB-CZ 3.48Å; K1167-Y1289 HydrophobicContact CD-CD1 3.9Å; K1167-Y1289 HydrophobicContact CD-CE1 3.71Å; K1167-Y1289 HydrophobicContact CG-CD1 4.45Å; K1167-Y1289 HydrophobicContact CG-CE1 3.88Å; K1167-Y1289 PolarHBondContact N-OH 3.4Å; K1167-Y1289 WeakPolarHBondContact O-CE2 3.37Å
1168	Q	31.2	Very low	39.4	Very low	152.8 Å²	152.8	114.4 Å²	114.4	71%	0.714	60%	0.598	S	S	*	*			trans	-70.6	124.6	172.6	-84.4	179.2	20.4	0	0	113.7	N1095 S1166 S1170 R1171	N1095-Q1168 CarbonylContact C-O 3.32Å; N1095-Q1168 VanDerWaalsContact O-O 3.1Å; S1166-Q1168 PolarHBondContact O-N 3.26Å; Q1168-S1170 VanDerWaalsContact C-N 3.28Å; Q1168-S1170 WeakPolarHBondContact CG-OG 3.42Å; Q1168-R1171 VanDerWaalsContact CD-NH2 3.27Å; Q1168-R1171 VanDerWaalsContact OE1-CZ 3.24Å
1169	L	28	Very low	42	Very low	114.6 Å²	114.6	109.3 Å²	109.3	60%	0.6	58%	0.577	S	S	*	*				-124.6	107.3	122.5	-123.1	108	0	0	0	111.1	N1095 K1167 R1171 F1173	N1095-L1169 HydrophobicContact CB-CD1 4.07Å; N1095-L1169 WeakPolarHBondContact ND2-CD1 3.45Å; K1167-L1169 PolarHBondContact O-N 3.33Å; L1169-R1171 PolarHBondContact O-N 3.29Å; L1169-F1173 HydrophobicContact CD2-CE2 4.2Å; L1169-F1173 HydrophobicContact CD2-CZ 4Å
1170	S	29.7	Very low	44.6	Very low	90.8 Å²	90.8	103.8 Å²	103.8	64%	0.635	55%	0.546	S	S	*	.			trans	-126.7	93.8	166.1	-22.4	0	0	0	0	111.7	Q1168 P1172 R1355	Q1168-S1170 VanDerWaalsContact C-N 3.28Å; Q1168-S1170 WeakPolarHBondContact CG-OG 3.42Å; S1170-P1172 WeakPolarHBondContact O-CD 3.35Å; S1170-R1355 PolarHBondContact OG-NH1 2.65Å; S1170-R1355 VanDerWaalsContact OG-NH1 3.14Å; S1170-R1355 PolarHBondContact OG-NH2 3.38Å
1171	R	33.2	Very low	47.4	Very low	184.2 Å²	184.2	95.3 Å²	95.3	70%	0.695	51%	0.509	S	S	*	.			trans	-103.9	133.7	168.8	-68.8	-176.3	-179.1	171.9	1.9	110.4	Q1168 L1169 F1173 D1292	Q1168-R1171 VanDerWaalsContact CD-NH2 3.27Å; Q1168-R1171 VanDerWaalsContact OE1-CZ 3.24Å; L1169-R1171 PolarHBondContact O-N 3.29Å; R1171-F1173 PolarHBondContact O-N 3.05Å; R1171-F1173 VanDerWaalsContact O-N 3.11Å; R1171-D1292 IonicContact NE-OD1 2.69Å
1172	P	33.3	Very low	49.9	Very low	111.2 Å²	111.2	93.6 Å²	93.6	72%	0.722	49%	0.493	S	S	*	.	P	Polyproline II helix	trans	-62.9	136.2	177.7	24.2	-33.1	0	0	0	111.9	S1170 K1174 E1468	S1170-P1172 WeakPolarHBondContact O-CD 3.35Å; P1172-K1174 PolarHBondContact O-N 2.84Å; P1172-E1468 WeakPolarHBondContact CA-OE1 3.3Å; P1172-E1468 WeakPolarHBondContact CB-OE1 3.34Å
1173	F	40.1	Very low	52.5	Low	112 Å²	112	86.9 Å²	86.9	49%	0.491	46%	0.457	S	S	.	.	P	Polyproline II helix	trans	-64	128.6	175.6	-64.9	-84.3	0	0	0	110.5	L1169 R1171 E1175 A1277 K1278 I1280 A1293 H1295 L1299 P1300 E1471	L1169-F1173 HydrophobicContact CD2-CE2 4.2Å; L1169-F1173 HydrophobicContact CD2-CZ 4Å; R1171-F1173 PolarHBondContact O-N 3.05Å; R1171-F1173 VanDerWaalsContact O-N 3.11Å; F1173-E1175 PolarHBondContact O-N 2.78Å; F1173-A1277 WeakPolarHBondContact CG-O 3.37Å; F1173-K1278 VanDerWaalsContact CD2-O 3.23Å; F1173-K1278 WeakPolarHBondContact CD2-O 3.08Å; F1173-K1278 WeakPolarHBondContact CE2-O 3.21Å; F1173-I1280 HydrophobicContact CE1-CD1 4.34Å; F1173-I1280 HydrophobicContact CE1-CG1 4.3Å; F1173-I1280 HydrophobicContact CZ-CG1 4.38Å; F1173-A1293 HydrophobicContact CD1-CB 4.17Å; F1173-A1293 HydrophobicContact CE1-CB 3.8Å; F1173-H1295 AromaticContact CD1-CE1 3.57Å; F1173-L1299 HydrophobicContact CD1-CD2 4.32Å; F1173-L1299 HydrophobicContact CE1-CD2 3.91Å; F1173-P1300 HydrophobicContact CD1-CG 4.17Å; F1173-P1300 HydrophobicContact CE1-CG 3.85Å; F1173-E1471 HydrophobicContact CZ-CG 4.28Å; F1173-E1471 WeakPolarHBondContact CZ-OE1 3.39Å
1174	K	46.8	Very low	55	Low	156 Å²	156	84 Å²	84	68%	0.678	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-85	135.9	178.6	-69.1	-177.1	178.8	179.5	0	110.7	P1172 G1176 H1295 T1298	P1172-K1174 PolarHBondContact O-N 2.84Å; K1174-G1176 PolarHBondContact O-N 2.84Å; K1174-H1295 WeakPolarHBondContact O-CB 3.29Å; K1174-H1295 PolarHBondContact O-CD2 3.41Å; K1174-T1298 PolarHBondContact O-N 2.83Å; K1174-T1298 VanDerWaalsContact O-N 3.09Å; K1174-T1298 PolarHBondContact O-OG1 2.94Å
1175	E	56.2	Low	57.6	Low	116 Å²	116	77.8 Å²	77.8	54%	0.542	40%	0.397	S	S	.	.	S	Bend	trans	-55	133	166.6	-65.9	177.3	162.7	0	0	110.8	F1173 R1276 H1295 V1320	F1173-E1175 PolarHBondContact O-N 2.78Å; E1175-R1276 WeakPolarHBondContact O-CD 3.48Å; E1175-R1276 IonicContact OE1-NH2 2.75Å; E1175-R1276 IonicContact OE2-CZ 3.5Å; E1175-R1276 IonicContact OE2-NE 3.1Å; E1175-R1276 PolarHBondContact OE2-NE 2.77Å; E1175-R1276 IonicContact OE2-NH2 3.03Å; E1175-R1276 PolarHBondContact OE2-NH2 2.81Å; E1175-H1295 IonicContact OE2-CD2 3.15Å; E1175-H1295 IonicContact OE2-NE2 3.61Å; E1175-V1320 HydrophobicContact CG-CG1 4.44Å
1176	G	68.7	Low	60.2	Low	5.4 Å²	5.4	76.2 Å²	76.2	6%	0.056	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	-173.6	176.1	0	0	0	0	0	113	K1174 R1276 H1295 K1296 T1298	K1174-G1176 PolarHBondContact O-N 2.84Å; G1176-R1276 WeakPolarHBondContact O-CG 3.37Å; G1176-H1295 WeakPolarHBondContact O-CB 3.35Å; G1176-H1295 PolarHBondContact O-CD2 3.06Å; G1176-H1295 VanDerWaalsContact O-CD2 3.25Å; G1176-K1296 CarbonylContact C-O 3.53Å; G1176-K1296 VanDerWaalsContact CA-O 3.31Å; G1176-K1296 WeakPolarHBondContact CA-O 3.46Å; G1176-K1296 PolarHBondContact N-O 2.94Å; G1176-K1296 VanDerWaalsContact N-O 3.16Å; G1176-T1298 VanDerWaalsContact CA-OG1 3.31Å; G1176-T1298 WeakPolarHBondContact CA-OG1 3.34Å; G1176-T1298 PolarHBondContact N-OG1 2.88Å
1177	P	81.1	Confident	63	Low	44.4 Å²	44.4	72.6 Å²	72.6	29%	0.288	35%	0.352	S	S	.	.			trans	-67.8	144	-172.8	25.3	-33.7	0	0	0	112.8	H1179 E1275 H1295 K1296 T1298	P1177-H1179 PolarHBondContact O-N 3.09Å; P1177-E1275 CarbonylContact C-O 3.51Å; P1177-E1275 VanDerWaalsContact CA-O 3.29Å; P1177-E1275 WeakPolarHBondContact CA-O 3.35Å; P1177-E1275 HydrophobicContact CB-CB 4.36Å; P1177-H1295 CarbonylContact O-C 3.54Å; P1177-H1295 WeakPolarHBondContact O-CA 3.32Å; P1177-K1296 HydrophobicContact CG-CB 4.35Å; P1177-K1296 HydrophobicContact CG-CD 4.32Å; P1177-K1296 PolarHBondContact O-N 3.05Å; P1177-T1298 WeakPolarHBondContact CD-OG1 3.26Å
1178	L	85.6	Confident	65.5	Low	7 Å²	7	67.9 Å²	67.9	4%	0.037	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.5	133	173.2	-178.5	69.6	0	0	0	110.4	I1181 V1252 L1272 E1275 A1277 A1293	L1178-I1181 HydrophobicContact CD1-CG1 4.1Å; L1178-I1181 HydrophobicContact CD2-CD1 3.96Å; L1178-I1181 HydrophobicContact CD2-CG1 4.16Å; L1178-I1181 HydrophobicContact CG-CG1 4.49Å; L1178-V1252 HydrophobicContact CD2-CG2 3.95Å; L1178-V1252 HydrophobicContact CG-CB 4.41Å; L1178-V1252 HydrophobicContact CG-CG2 4.15Å; L1178-V1252 VanDerWaalsContact O-CB 3.3Å; L1178-V1252 WeakPolarHBondContact O-CB 3.17Å; L1178-V1252 VanDerWaalsContact O-CG1 3.25Å; L1178-V1252 WeakPolarHBondContact O-CG1 3.35Å; L1178-L1272 HydrophobicContact CD2-CD1 3.9Å; L1178-E1275 WeakPolarHBondContact CB-O 3.29Å; L1178-E1275 PolarHBondContact N-O 3.05Å; L1178-A1277 HydrophobicContact CD1-CB 4.09Å; L1178-A1277 HydrophobicContact CD2-CB 4.19Å; L1178-A1277 HydrophobicContact CG-CB 4.46Å; L1178-A1293 HydrophobicContact CD1-CB 4.37Å
1179	H	83.2	Confident	67.7	Low	61.6 Å²	61.6	63.8 Å²	63.8	29%	0.285	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	-39.6	-176.5	-173.7	-111.9	0	0	0	112.8	P1177 V1252 F1294 K1296 L1319 T1323	P1177-H1179 PolarHBondContact O-N 3.09Å; H1179-V1252 WeakPolarHBondContact CA-O 3.34Å; H1179-V1252 PolarHBondContact CD2-O 3.05Å; H1179-V1252 PolarHBondContact ND1-O 3.08Å; H1179-V1252 VanDerWaalsContact ND1-O 3.08Å; H1179-V1252 CarbonylContact O-C 3.59Å; H1179-V1252 WeakPolarHBondContact O-CA 3.25Å; H1179-V1252 WeakPolarHBondContact O-CB 3.03Å; H1179-V1252 PolarHBondContact O-N 2.88Å; H1179-V1252 VanDerWaalsContact O-O 3.09Å; H1179-F1294 WeakPolarHBondContact CA-O 3.16Å; H1179-F1294 VanDerWaalsContact CB-O 3.28Å; H1179-F1294 WeakPolarHBondContact CB-O 3.27Å; H1179-F1294 PolarHBondContact N-O 2.89Å; H1179-K1296 HydrophobicContact CB-CB 4.43Å; H1179-K1296 HydrophobicContact CB-CD 4.46Å; H1179-K1296 HydrophobicContact CB-CG 4.1Å; H1179-K1296 VanDerWaalsContact CD2-CE 3.42Å; H1179-K1296 WeakPolarHBondContact CD2-CE 3.1Å; H1179-K1296 VanDerWaalsContact NE2-CE 3.33Å; H1179-K1296 WeakPolarHBondContact NE2-CE 3.33Å; H1179-L1319 HydrophobicContact CB-CD2 3.97Å; H1179-T1323 PolarHBondContact CE1-O 3.04Å; H1179-T1323 VanDerWaalsContact CE1-O 3.24Å
1180	H	85.5	Confident	70.1	Confident	33.2 Å²	33.2	64.5 Å²	64.5	15%	0.154	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	151.9	175.9	116.2	26.9	0	0	0	112.3	L1249 A1250 A1293 F1294 T1323	H1180-L1249 WeakPolarHBondContact CE1-CD1 3.47Å; H1180-L1249 WeakPolarHBondContact NE2-CD1 3.46Å; H1180-A1250 CarbonylContact C-O 3.51Å; H1180-A1250 WeakPolarHBondContact CA-O 3.33Å; H1180-A1250 VanDerWaalsContact CB-O 3.28Å; H1180-A1250 WeakPolarHBondContact CB-O 3.45Å; H1180-A1250 PolarHBondContact ND1-O 3.04Å; H1180-A1250 VanDerWaalsContact ND1-O 3.13Å; H1180-A1293 CarbonylContact O-C 3.49Å; H1180-A1293 WeakPolarHBondContact O-CA 3.22Å; H1180-F1294 HydrophobicContact CB-CB 4.12Å; H1180-F1294 HydrophobicContact CB-CD2 3.99Å; H1180-F1294 HydrophobicContact CB-CG 4.43Å; H1180-F1294 AromaticContact CD2-CD2 3.52Å; H1180-F1294 VanDerWaalsContact CD2-CD2 3.45Å; H1180-F1294 WeakPolarHBondContact CD2-CD2 3.4Å; H1180-F1294 AromaticContact CD2-CE2 3.84Å; H1180-F1294 AromaticContact CD2-CG 3.84Å; H1180-F1294 AromaticContact CE1-CD2 3.81Å; H1180-F1294 AromaticContact CE1-CG 3.67Å; H1180-F1294 PolarHBondContact N-O 3.08Å; H1180-F1294 VanDerWaalsContact N-O 3.16Å; H1180-F1294 AromaticContact NE2-CD2 3.14Å; H1180-F1294 WeakPolarHBondContact NE2-CD2 3.33Å; H1180-F1294 AromaticContact NE2-CE2 3.53Å; H1180-F1294 WeakPolarHBondContact NE2-CE2 3.34Å; H1180-F1294 AromaticContact NE2-CG 3.48Å; H1180-F1294 WeakPolarHBondContact NE2-CG 2.98Å; H1180-F1294 PolarHBondContact O-N 2.86Å; H1180-T1323 PolarHBondContact CE1-OG1 2.73Å
1181	I	87.5	Confident	72.6	Confident	3 Å²	3	61.1 Å²	61.1	2%	0.015	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	131.9	168.4	-53	162.5	0	0	0	107.3	L1178 I1198 L1249 A1250 I1280 I1291 D1292	L1178-I1181 HydrophobicContact CD1-CG1 4.1Å; L1178-I1181 HydrophobicContact CD2-CD1 3.96Å; L1178-I1181 HydrophobicContact CD2-CG1 4.16Å; L1178-I1181 HydrophobicContact CG-CG1 4.49Å; I1181-I1198 HydrophobicContact CD1-CD1 3.51Å; I1181-I1198 VanDerWaalsContact CD1-CD1 3.48Å; I1181-I1198 HydrophobicContact CD1-CG1 4.04Å; I1181-L1249 CarbonylContact O-C 3.54Å; I1181-L1249 WeakPolarHBondContact O-CA 3.49Å; I1181-A1250 HydrophobicContact CB-CB 4.01Å; I1181-A1250 HydrophobicContact CD1-CB 4.22Å; I1181-A1250 HydrophobicContact CG1-CB 4.34Å; I1181-A1250 PolarHBondContact N-O 3Å; I1181-A1250 PolarHBondContact O-N 3.09Å; I1181-I1280 HydrophobicContact CB-CD1 4.44Å; I1181-I1280 HydrophobicContact CD1-CD1 3.67Å; I1181-I1280 HydrophobicContact CG1-CD1 3.7Å; I1181-I1280 HydrophobicContact CG2-CD1 3.85Å; I1181-I1291 HydrophobicContact CG2-CD1 3.73Å; I1181-I1291 HydrophobicContact CG2-CG1 3.79Å; I1181-I1291 HydrophobicContact CG2-CG2 3.81Å; I1181-D1292 CarbonylContact C-O 3.53Å; I1181-D1292 WeakPolarHBondContact CA-O 3.46Å
1182	R	82.5	Confident	75.1	Confident	95.2 Å²	95.2	54 Å²	54	36%	0.359	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	119.8	170	178.1	-174.2	-176.7	172.7	4.9	108.3	L1249 I1291 D1292 R1337 F1341 V1465 D1466	R1182-L1249 HydrophobicContact CB-CD1 4.14Å; R1182-L1249 HydrophobicContact CG-CD1 4.11Å; R1182-I1291 CarbonylContact O-C 3.58Å; R1182-I1291 VanDerWaalsContact O-CA 3.25Å; R1182-I1291 WeakPolarHBondContact O-CA 3.43Å; R1182-D1292 HydrophobicContact CB-CB 4.39Å; R1182-D1292 PolarHBondContact N-O 3.17Å; R1182-D1292 PolarHBondContact O-N 2.91Å; R1182-R1337 VanDerWaalsContact NH2-CZ 3.35Å; R1182-R1337 VanDerWaalsContact NH2-NH1 3.11Å; R1182-F1341 PolarHBondContact NH1-O 2.9Å; R1182-F1341 PolarHBondContact NH2-O 3.27Å; R1182-V1465 PolarHBondContact NH2-O 3.02Å; R1182-D1466 IonicContact NH1-OD1 3.93Å; R1182-D1466 PolarHBondContact NH1-OD1 2.72Å
1183	A	84.6	Confident	77.8	Confident	0.8 Å²	0.8	52.5 Å²	52.5	1%	0.007	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	137.1	173.9	0	0	0	0	0	111	V1185 N1247 L1248 I1282 N1290 I1291	A1183-V1185 HydrophobicContact CB-CG2 4.19Å; A1183-N1247 CarbonylContact O-C 3.52Å; A1183-N1247 WeakPolarHBondContact O-CA 3.24Å; A1183-L1248 HydrophobicContact CB-CB 4.35Å; A1183-L1248 PolarHBondContact N-O 3.08Å; A1183-L1248 PolarHBondContact O-N 3.17Å; A1183-I1282 HydrophobicContact CB-CD1 3.77Å; A1183-N1290 CarbonylContact C-O 3.41Å; A1183-N1290 VanDerWaalsContact CA-O 3.27Å; A1183-N1290 WeakPolarHBondContact CA-O 3.28Å; A1183-I1291 HydrophobicContact CB-CB 4.43Å; A1183-I1291 HydrophobicContact CB-CD1 4.14Å; A1183-I1291 HydrophobicContact CB-CG1 4Å
1184	T	81.2	Confident	80.2	Confident	31.4 Å²	31.4	47.2 Å²	47.2	19%	0.193	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	122.8	162.1	-59.2	0	0	0	0	106.7	T1245 F1246 N1247 Y1289 N1290 L1329 R1337	T1184-T1245 HydrophobicContact CG2-CG2 3.96Å; T1184-F1246 WeakPolarHBondContact CA-O 3.37Å; T1184-N1247 WeakPolarHBondContact CB-OD1 3.33Å; T1184-N1247 WeakPolarHBondContact CG2-OD1 3.23Å; T1184-N1247 PolarHBondContact OG1-OD1 3.21Å; T1184-Y1289 CarbonylContact O-C 3.54Å; T1184-Y1289 WeakPolarHBondContact O-CA 3.37Å; T1184-Y1289 WeakPolarHBondContact O-CB 3.25Å; T1184-N1290 PolarHBondContact N-O 2.89Å; T1184-N1290 PolarHBondContact O-N 3.22Å; T1184-L1329 HydrophobicContact CG2-CD1 3.85Å; T1184-L1329 HydrophobicContact CG2-CD2 4.38Å; T1184-R1337 PolarHBondContact OG1-NH2 2.91Å
1185	V	84.3	Confident	82.3	Confident	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	131.6	-173.2	-173.4	0	0	0	0	108.6	A1183 L1187 T1245 F1246 I1282 V1286	A1183-V1185 HydrophobicContact CB-CG2 4.19Å; V1185-L1187 PolarHBondContact O-N 2.71Å; V1185-T1245 CarbonylContact O-C 3.55Å; V1185-T1245 VanDerWaalsContact O-CA 3.29Å; V1185-T1245 WeakPolarHBondContact O-CA 3.26Å; V1185-T1245 WeakPolarHBondContact O-CG2 3.42Å; V1185-F1246 HydrophobicContact CB-CD1 4.42Å; V1185-F1246 HydrophobicContact CB-CD2 4.08Å; V1185-F1246 HydrophobicContact CB-CE1 4.05Å; V1185-F1246 HydrophobicContact CB-CE2 3.58Å; V1185-F1246 VanDerWaalsContact CB-CE2 3.47Å; V1185-F1246 HydrophobicContact CB-CG 4.45Å; V1185-F1246 HydrophobicContact CB-CZ 3.55Å; V1185-F1246 VanDerWaalsContact CB-CZ 3.5Å; V1185-F1246 HydrophobicContact CG1-CE1 4.03Å; V1185-F1246 HydrophobicContact CG1-CE2 4.15Å; V1185-F1246 HydrophobicContact CG1-CZ 3.62Å; V1185-F1246 HydrophobicContact CG2-CD2 4.35Å; V1185-F1246 HydrophobicContact CG2-CE2 3.78Å; V1185-F1246 HydrophobicContact CG2-CZ 4.09Å; V1185-F1246 PolarHBondContact N-O 3.07Å; V1185-F1246 PolarHBondContact O-N 3.08Å; V1185-F1246 VanDerWaalsContact O-O 3.09Å; V1185-I1282 HydrophobicContact CG1-CG2 4.27Å; V1185-I1282 HydrophobicContact CG2-CD1 3.7Å; V1185-I1282 HydrophobicContact CG2-CG2 4.43Å; V1185-V1286 HydrophobicContact CG1-CB 4.15Å; V1185-V1286 HydrophobicContact CG1-CG1 3.74Å; V1185-V1286 HydrophobicContact CG1-CG2 3.93Å; V1185-V1286 VanDerWaalsContact CG1-CG2 3.43Å
1186	Q	84.6	Confident	84	Confident	36 Å²	36	36.4 Å²	36.4	17%	0.168	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	124.8	172.8	-162.2	174.8	-2.1	0	0	108.3	R1244 T1245 V1286 Q1287 A1288 L1329	Q1186-R1244 CarbonylContact C-O 3.31Å; Q1186-R1244 VanDerWaalsContact CA-O 3.31Å; Q1186-R1244 WeakPolarHBondContact CA-O 3.37Å; Q1186-R1244 VanDerWaalsContact CB-O 3.27Å; Q1186-R1244 WeakPolarHBondContact CB-O 3.28Å; Q1186-R1244 WeakPolarHBondContact CG-O 3.46Å; Q1186-T1245 HydrophobicContact CB-CG2 4.46Å; Q1186-T1245 HydrophobicContact CG-CG2 3.74Å; Q1186-T1245 WeakPolarHBondContact CG-OG1 3.46Å; Q1186-T1245 PolarHBondContact NE2-OG1 2.72Å; Q1186-V1286 CarbonylContact O-C 3.47Å; Q1186-V1286 VanDerWaalsContact O-CA 3.31Å; Q1186-V1286 WeakPolarHBondContact O-CA 3.37Å; Q1186-V1286 WeakPolarHBondContact O-CG1 3.42Å; Q1186-Q1287 HydrophobicContact CB-CB 4.1Å; Q1186-Q1287 VanDerWaalsContact CD-OE1 3.29Å; Q1186-Q1287 HydrophobicContact CG-CB 4.06Å; Q1186-Q1287 HydrophobicContact CG-CG 4.31Å; Q1186-Q1287 VanDerWaalsContact NE2-CD 3.26Å; Q1186-Q1287 WeakPolarHBondContact O-CA 3.47Å; Q1186-Q1287 WeakPolarHBondContact O-CB 3.48Å; Q1186-Q1287 PolarHBondContact O-N 3.07Å; Q1186-Q1287 VanDerWaalsContact OE1-CD 3.31Å; Q1186-Q1287 VanDerWaalsContact OE1-CG 3.23Å; Q1186-A1288 WeakPolarHBondContact CA-O 3.46Å; Q1186-A1288 HydrophobicContact CB-CB 4.12Å; Q1186-A1288 HydrophobicContact CG-CB 3.85Å; Q1186-A1288 PolarHBondContact N-O 3.2Å; Q1186-A1288 PolarHBondContact O-N 3.14Å; Q1186-A1288 VanDerWaalsContact O-N 3.14Å; Q1186-L1329 HydrophobicContact CB-CD2 3.76Å
1187	L	85.6	Confident	84.9	Confident	8.8 Å²	8.8	36.9 Å²	36.9	5%	0.046	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	156.7	177.9	-67.3	177.2	0	0	0	111.7	V1185 A1191 F1194 L1212 L1240 R1244 F1246 D1285 V1286 Q1287	V1185-L1187 PolarHBondContact O-N 2.71Å; L1187-A1191 HydrophobicContact CB-CB 3.95Å; L1187-A1191 HydrophobicContact CD1-CB 4.36Å; L1187-A1191 HydrophobicContact CD2-CB 4.28Å; L1187-A1191 HydrophobicContact CG-CB 4.42Å; L1187-F1194 HydrophobicContact CD2-CB 4.35Å; L1187-F1194 HydrophobicContact CD2-CD1 3.92Å; L1187-F1194 HydrophobicContact CD2-CE1 4.47Å; L1187-F1194 HydrophobicContact CD2-CG 4.27Å; L1187-L1212 HydrophobicContact CD1-CD1 3.85Å; L1187-L1212 HydrophobicContact CD1-CD2 4.18Å; L1187-L1212 HydrophobicContact CD2-CD1 4.24Å; L1187-L1240 HydrophobicContact CD1-CB 4.38Å; L1187-R1244 PolarHBondContact N-O 3.12Å; L1187-F1246 HydrophobicContact CD1-CD1 4.18Å; L1187-F1246 HydrophobicContact CD1-CE1 3.89Å; L1187-F1246 HydrophobicContact CD2-CE1 3.99Å; L1187-F1246 HydrophobicContact CG-CD1 4.14Å; L1187-F1246 HydrophobicContact CG-CE1 3.74Å; L1187-F1246 VanDerWaalsContact CG-CE1 3.47Å; L1187-D1285 CarbonylContact C-O 3.57Å; L1187-D1285 WeakPolarHBondContact CA-O 3.42Å; L1187-D1285 WeakPolarHBondContact CD2-O 3.42Å; L1187-V1286 HydrophobicContact CD2-CG2 4.29Å; L1187-Q1287 WeakPolarHBondContact O-CB 3.32Å
1188	Q	82.8	Confident	85.4	Confident	62.2 Å²	62.2	34.8 Å²	34.8	29%	0.291	18%	0.177	S	C	.	.			trans	-69.7	160.7	169.1	-67.9	-173.2	25.4	0	0	111.4	G930 R931 K932 D1190 A1191 D1285 V1286 Q1287	G930-Q1188 WeakPolarHBondContact O-CG 3.09Å; G930-Q1188 PolarHBondContact O-NE2 3.4Å; G930-Q1188 VanDerWaalsContact O-NE2 3.14Å; R931-Q1188 VanDerWaalsContact N-NE2 3.15Å; K932-Q1188 VanDerWaalsContact CA-CD 3.48Å; K932-Q1188 HydrophobicContact CB-CB 3.45Å; K932-Q1188 VanDerWaalsContact CB-CB 3.45Å; K932-Q1188 HydrophobicContact CB-CG 4.14Å; K932-Q1188 VanDerWaalsContact N-CG 3.32Å; K932-Q1188 VanDerWaalsContact N-OE1 3.14Å; Q1188-D1190 VanDerWaalsContact C-N 3.29Å; Q1188-D1190 PolarHBondContact O-N 2.96Å; Q1188-D1190 VanDerWaalsContact O-N 3.16Å; Q1188-A1191 HydrophobicContact CB-CB 4.17Å; Q1188-A1191 WeakPolarHBondContact O-CB 3.37Å; Q1188-A1191 PolarHBondContact O-N 3.1Å; Q1188-D1285 HydrophobicContact CB-CB 4.4Å; Q1188-D1285 WeakPolarHBondContact CB-O 3.15Å; Q1188-D1285 VanDerWaalsContact CG-O 3.23Å; Q1188-D1285 WeakPolarHBondContact CG-O 3.2Å; Q1188-D1285 PolarHBondContact N-O 3.07Å; Q1188-D1285 VanDerWaalsContact N-O 3.15Å; Q1188-D1285 PolarHBondContact NE2-OD1 3.32Å; Q1188-D1285 VanDerWaalsContact OE1-C 3.27Å; Q1188-V1286 WeakPolarHBondContact CG-O 3.37Å; Q1188-V1286 PolarHBondContact NE2-O 2.87Å; Q1188-Q1287 HydrophobicContact CG-CB 4.36Å
1189	P	76.4	Confident	85.3	Confident	66.6 Å²	66.6	37.5 Å²	37.5	43%	0.432	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-41.9	-177.3	-29.4	36	0	0	0	115.2	L905 R931 R1244	L905-P1189 HydrophobicContact CD2-CG 3.91Å; R931-P1189 VanDerWaalsContact CB-CD 3.43Å; R931-P1189 HydrophobicContact CB-CG 3.73Å; R931-P1189 HydrophobicContact CG-CG 4.02Å; P1189-R1244 VanDerWaalsContact CA-CZ 3.46Å; P1189-R1244 VanDerWaalsContact CA-NH2 3.28Å; P1189-R1244 VanDerWaalsContact CG-NH2 3.31Å
1190	D	80	Confident	85.4	Confident	128 Å²	128	34.7 Å²	34.7	68%	0.684	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-118.5	28	-168.6	-9.2	-49.6	0	0	0	111.3	K932 P934 Q1188 S1192	K932-D1190 WeakPolarHBondContact CD-O 3.25Å; P934-D1190 HydrophobicContact CB-CB 3.84Å; Q1188-D1190 VanDerWaalsContact C-N 3.29Å; Q1188-D1190 PolarHBondContact O-N 2.96Å; Q1188-D1190 VanDerWaalsContact O-N 3.16Å; D1190-S1192 PolarHBondContact O-N 2.89Å
1191	A	81.6	Confident	85	Confident	20.2 Å²	20.2	34 Å²	34	17%	0.167	17%	0.174	C	C	.	.			trans	-55.6	128	-172.8	0	0	0	0	0	113.3	L1187 Q1188 L1212 D1285	L1187-A1191 HydrophobicContact CB-CB 3.95Å; L1187-A1191 HydrophobicContact CD1-CB 4.36Å; L1187-A1191 HydrophobicContact CD2-CB 4.28Å; L1187-A1191 HydrophobicContact CG-CB 4.42Å; Q1188-A1191 HydrophobicContact CB-CB 4.17Å; Q1188-A1191 WeakPolarHBondContact O-CB 3.37Å; Q1188-A1191 PolarHBondContact O-N 3.1Å; A1191-L1212 VanDerWaalsContact C-CD1 3.5Å; A1191-L1212 HydrophobicContact CB-CD1 3.5Å; A1191-L1212 VanDerWaalsContact CB-CD1 3.48Å; A1191-L1212 VanDerWaalsContact O-CD1 3.31Å; A1191-L1212 WeakPolarHBondContact O-CD1 3.38Å; A1191-D1285 VanDerWaalsContact CA-CB 3.48Å; A1191-D1285 HydrophobicContact CB-CB 3.56Å; A1191-D1285 VanDerWaalsContact CB-CB 3.46Å; A1191-D1285 VanDerWaalsContact CB-O 3.31Å; A1191-D1285 WeakPolarHBondContact CB-O 3.33Å
1192	S	85.2	Confident	84.1	Confident	35.8 Å²	35.8	39.5 Å²	39.5	25%	0.25	20%	0.203	S	C	.	.			trans	-109.5	-33.4	-179.7	74.2	0	0	0	0	113.2	K932 D1190 L1212 D1285	K932-S1192 PolarHBondContact NZ-OG 3.07Å; D1190-S1192 PolarHBondContact O-N 2.89Å; S1192-L1212 VanDerWaalsContact O-CB 3.32Å; S1192-L1212 WeakPolarHBondContact O-CB 3.21Å; S1192-L1212 PolarHBondContact O-N 2.93Å; S1192-D1285 WeakPolarHBondContact CA-OD2 3.24Å; S1192-D1285 WeakPolarHBondContact CB-OD2 3.33Å; S1192-D1285 PolarHBondContact N-OD2 2.54Å; S1192-D1285 PolarHBondContact OG-OD2 2.92Å
1193	E	89.8	Confident	83.3	Confident	78.8 Å²	78.8	39.8 Å²	39.8	37%	0.368	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	156	173.8	63.4	162.2	-151.5	0	0	113.7	K918 N1209 V1210 D1285	K918-E1193 IonicContact NZ-OE1 3.81Å; K918-E1193 PolarHBondContact NZ-OE1 3.45Å; E1193-N1209 PolarHBondContact OE2-ND2 3.09Å; E1193-N1209 VanDerWaalsContact OE2-ND2 3.16Å; E1193-V1210 CarbonylContact C-O 3.46Å; E1193-V1210 WeakPolarHBondContact CA-O 3.3Å; E1193-V1210 WeakPolarHBondContact CB-O 3.44Å; E1193-D1285 PolarHBondContact N-OD2 2.97Å; E1193-D1285 VanDerWaalsContact O-CB 3.25Å; E1193-D1285 WeakPolarHBondContact O-CB 3.38Å; E1193-D1285 PolarHBondContact O-N 3.03Å
1194	F	91.1	Very high	83	Confident	1.6 Å²	1.6	41.3 Å²	41.3	1%	0.007	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	163.7	163.3	76.3	-86.8	0	0	0	111.2	L1187 N1209 V1210 L1212 W1217 L1240 F1246 I1282 N1283 V1286	L1187-F1194 HydrophobicContact CD2-CB 4.35Å; L1187-F1194 HydrophobicContact CD2-CD1 3.92Å; L1187-F1194 HydrophobicContact CD2-CE1 4.47Å; L1187-F1194 HydrophobicContact CD2-CG 4.27Å; F1194-N1209 CarbonylContact O-C 3.58Å; F1194-V1210 HydrophobicContact CD1-CB 3.86Å; F1194-V1210 HydrophobicContact CD1-CG1 4.1Å; F1194-V1210 HydrophobicContact CD1-CG2 4.41Å; F1194-V1210 HydrophobicContact CD2-CB 4.44Å; F1194-V1210 HydrophobicContact CD2-CG2 4.37Å; F1194-V1210 HydrophobicContact CE1-CB 3.6Å; F1194-V1210 HydrophobicContact CE1-CG1 3.5Å; F1194-V1210 VanDerWaalsContact CE1-CG1 3.48Å; F1194-V1210 HydrophobicContact CE1-CG2 3.97Å; F1194-V1210 HydrophobicContact CE2-CB 4.27Å; F1194-V1210 HydrophobicContact CE2-CG2 3.84Å; F1194-V1210 HydrophobicContact CG-CB 4.31Å; F1194-V1210 HydrophobicContact CZ-CB 3.81Å; F1194-V1210 HydrophobicContact CZ-CG1 3.93Å; F1194-V1210 HydrophobicContact CZ-CG2 3.61Å; F1194-V1210 PolarHBondContact N-O 3.14Å; F1194-V1210 WeakPolarHBondContact O-CA 3.23Å; F1194-V1210 WeakPolarHBondContact O-CB 3.29Å; F1194-V1210 PolarHBondContact O-N 3.07Å; F1194-L1212 HydrophobicContact CD1-CD1 4.38Å; F1194-L1212 HydrophobicContact CD1-CD2 4.17Å; F1194-L1212 HydrophobicContact CD1-CG 4.43Å; F1194-L1212 HydrophobicContact CE1-CD2 4.08Å; F1194-W1217 HydrophobicContact CE1-CH2 4.44Å; F1194-W1217 HydrophobicContact CE2-CH2 4.48Å; F1194-W1217 AromaticContact CZ-CH2 3.79Å; F1194-W1217 HydrophobicContact CZ-CH2 3.79Å; F1194-W1217 HydrophobicContact CZ-CZ2 4.24Å; F1194-W1217 HydrophobicContact CZ-CZ3 4.35Å; F1194-L1240 HydrophobicContact CE1-CD1 4.34Å; F1194-L1240 HydrophobicContact CE1-CD2 4.5Å; F1194-F1246 HydrophobicContact CD1-CZ 4.32Å; F1194-F1246 HydrophobicContact CD2-CZ 4.46Å; F1194-F1246 AromaticContact CE1-CE1 3.91Å; F1194-F1246 HydrophobicContact CE1-CE1 4.15Å; F1194-F1246 AromaticContact CE1-CZ 3.7Å; F1194-F1246 HydrophobicContact CE1-CZ 3.7Å; F1194-F1246 HydrophobicContact CE2-CE2 4.39Å; F1194-F1246 AromaticContact CE2-CZ 3.86Å; F1194-F1246 HydrophobicContact CE2-CZ 3.9Å; F1194-F1246 HydrophobicContact CZ-CE1 4.29Å; F1194-F1246 AromaticContact CZ-CE2 3.92Å; F1194-F1246 HydrophobicContact CZ-CE2 4.04Å; F1194-F1246 AromaticContact CZ-CZ 3.4Å; F1194-F1246 HydrophobicContact CZ-CZ 3.4Å; F1194-F1246 VanDerWaalsContact CZ-CZ 3.47Å; F1194-I1282 HydrophobicContact CD2-CG2 4.32Å; F1194-N1283 CarbonylContact C-O 3.39Å; F1194-N1283 VanDerWaalsContact CA-O 3.27Å; F1194-N1283 WeakPolarHBondContact CA-O 3.37Å; F1194-N1283 WeakPolarHBondContact CB-O 3.28Å; F1194-V1286 HydrophobicContact CB-CG2 3.64Å; F1194-V1286 VanDerWaalsContact CB-CG2 3.45Å; F1194-V1286 HydrophobicContact CG-CG2 4.35Å
1195	Y	91.1	Very high	83.1	Confident	41.2 Å²	41.2	39.8 Å²	39.8	16%	0.162	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	158	174	63.4	-105.9	0	0	0	113.2	K918 K920 E963 I1197 K1207 I1208 N1209 I1282 N1283	K918-Y1195 HydrophobicContact CD-CE1 4.36Å; K918-Y1195 VanDerWaalsContact CE-CD1 3.45Å; K918-Y1195 VanDerWaalsContact CE-CZ 3.49Å; K918-Y1195 VanDerWaalsContact NZ-CE1 3.29Å; K920-Y1195 HydrophobicContact CD-CD1 4.42Å; K920-Y1195 HydrophobicContact CD-CE1 4.33Å; E963-Y1195 HydrophobicContact CG-CE1 4Å; E963-Y1195 WeakPolarHBondContact CG-OH 3.26Å; E963-Y1195 WeakPolarHBondContact OE2-CE1 3.42Å; Y1195-I1197 HydrophobicContact CD2-CD1 3.98Å; Y1195-I1197 HydrophobicContact CD2-CG1 3.92Å; Y1195-I1197 HydrophobicContact CE2-CD1 3.65Å; Y1195-I1197 HydrophobicContact CE2-CG1 4.09Å; Y1195-K1207 VanDerWaalsContact CG-CE 3.49Å; Y1195-I1208 CarbonylContact C-O 3.54Å; Y1195-I1208 WeakPolarHBondContact CA-O 3.28Å; Y1195-I1208 WeakPolarHBondContact CB-O 3.38Å; Y1195-N1209 WeakPolarHBondContact CB-OD1 3.23Å; Y1195-I1282 CarbonylContact O-C 3.38Å; Y1195-I1282 VanDerWaalsContact O-CA 3.27Å; Y1195-I1282 WeakPolarHBondContact O-CA 3.35Å; Y1195-I1282 VanDerWaalsContact O-CB 3.23Å; Y1195-I1282 WeakPolarHBondContact O-CB 3.46Å; Y1195-N1283 HydrophobicContact CD2-CB 4.28Å; Y1195-N1283 HydrophobicContact CE1-CB 4.03Å; Y1195-N1283 HydrophobicContact CE2-CB 3.62Å; Y1195-N1283 VanDerWaalsContact CZ-CB 3.43Å; Y1195-N1283 PolarHBondContact N-O 3.03Å; Y1195-N1283 PolarHBondContact O-N 2.98Å; Y1195-N1283 VanDerWaalsContact O-N 3.08Å; Y1195-N1283 WeakPolarHBondContact OH-CB 3.46Å; Y1195-N1283 PolarHBondContact OH-ND2 3.19Å
1196	M	91.4	Very high	83.4	Confident	2.8 Å²	2.8	39.8 Å²	39.8	1%	0.014	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	132.5	169.9	-180	178.3	70	0	0	109.6	I1198 W1206 K1207 I1208 L1248 L1259 I1280 V1281 I1282	M1196-I1198 HydrophobicContact CE-CD1 4.32Å; M1196-I1198 HydrophobicContact CE-CG1 4.39Å; M1196-W1206 HydrophobicContact CE-CZ3 4.06Å; M1196-K1207 CarbonylContact O-C 3.51Å; M1196-K1207 VanDerWaalsContact O-CA 3.27Å; M1196-K1207 WeakPolarHBondContact O-CA 3.21Å; M1196-I1208 HydrophobicContact CB-CG2 4.1Å; M1196-I1208 HydrophobicContact CE-CG2 4.23Å; M1196-I1208 PolarHBondContact N-O 2.77Å; M1196-I1208 VanDerWaalsContact N-O 3.08Å; M1196-I1208 PolarHBondContact O-N 3.02Å; M1196-L1248 HydrophobicContact CE-CD2 3.99Å; M1196-L1248 HydrophobicContact SD-CD2 3.91Å; M1196-L1248 VanDerWaalsContact SD-CD2 3.57Å; M1196-L1259 HydrophobicContact CE-CD2 4.48Å; M1196-I1280 HydrophobicContact CG-CG2 4.19Å; M1196-I1280 HydrophobicContact SD-CG2 4.36Å; M1196-V1281 CarbonylContact C-O 3.52Å; M1196-V1281 WeakPolarHBondContact CA-O 3.37Å; M1196-V1281 WeakPolarHBondContact CG-O 3.4Å; M1196-I1282 HydrophobicContact CB-CB 4.33Å; M1196-I1282 HydrophobicContact CB-CG1 3.99Å; M1196-I1282 HydrophobicContact CG-CD1 4.35Å; M1196-I1282 HydrophobicContact CG-CG1 3.91Å; M1196-I1282 HydrophobicContact SD-CD1 4.31Å; M1196-I1282 HydrophobicContact SD-CG1 4.3Å
1197	I	88.9	Confident	83.6	Confident	16.2 Å²	16.2	39.8 Å²	39.8	8%	0.083	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	130	175.2	-59.4	170.6	0	0	0	109.2	E963 Y1195 A1205 W1206 K1207 W1227 I1280 V1281	E963-I1197 WeakPolarHBondContact OE1-CD1 3.12Å; Y1195-I1197 HydrophobicContact CD2-CD1 3.98Å; Y1195-I1197 HydrophobicContact CD2-CG1 3.92Å; Y1195-I1197 HydrophobicContact CE2-CD1 3.65Å; Y1195-I1197 HydrophobicContact CE2-CG1 4.09Å; I1197-A1205 HydrophobicContact CG2-CB 4.2Å; I1197-W1206 CarbonylContact C-O 3.58Å; I1197-W1206 WeakPolarHBondContact CA-O 3.3Å; I1197-K1207 HydrophobicContact CD1-CD 4.25Å; I1197-K1207 HydrophobicContact CD1-CG 4.46Å; I1197-K1207 HydrophobicContact CG1-CB 4.1Å; I1197-K1207 HydrophobicContact CG1-CD 4.14Å; I1197-K1207 HydrophobicContact CG1-CG 3.89Å; I1197-W1227 HydrophobicContact CD1-CZ2 4.39Å; I1197-W1227 HydrophobicContact CG2-CH2 4.17Å; I1197-W1227 HydrophobicContact CG2-CZ2 4.48Å; I1197-I1280 CarbonylContact O-C 3.49Å; I1197-I1280 VanDerWaalsContact O-CA 3.31Å; I1197-I1280 WeakPolarHBondContact O-CA 3.24Å; I1197-I1280 WeakPolarHBondContact O-CG2 3.36Å; I1197-V1281 HydrophobicContact CB-CB 4.18Å; I1197-V1281 PolarHBondContact N-O 2.82Å; I1197-V1281 PolarHBondContact O-N 3.08Å
1198	I	89.8	Confident	83.8	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	103	170.6	-54.1	168.1	0	0	0	106.9	I1181 M1196 M1200 A1205 W1206 M1257 L1272 A1277 I1280	I1181-I1198 HydrophobicContact CD1-CD1 3.51Å; I1181-I1198 VanDerWaalsContact CD1-CD1 3.48Å; I1181-I1198 HydrophobicContact CD1-CG1 4.04Å; M1196-I1198 HydrophobicContact CE-CD1 4.32Å; M1196-I1198 HydrophobicContact CE-CG1 4.39Å; I1198-M1200 HydrophobicContact CG2-CG 4Å; I1198-M1200 HydrophobicContact CG2-SD 4.46Å; I1198-M1200 PolarHBondContact O-N 3.06Å; I1198-A1205 CarbonylContact O-C 3.57Å; I1198-A1205 VanDerWaalsContact O-CA 3.28Å; I1198-A1205 WeakPolarHBondContact O-CA 3.41Å; I1198-A1205 WeakPolarHBondContact O-CB 3.38Å; I1198-W1206 HydrophobicContact CD1-CE3 3.85Å; I1198-W1206 HydrophobicContact CD1-CZ3 4.26Å; I1198-W1206 HydrophobicContact CG1-CE3 4.39Å; I1198-W1206 PolarHBondContact N-O 2.95Å; I1198-W1206 PolarHBondContact O-N 3.15Å; I1198-M1257 HydrophobicContact CD1-CE 4.26Å; I1198-M1257 HydrophobicContact CD1-SD 3.94Å; I1198-L1272 HydrophobicContact CD1-CD2 4.21Å; I1198-A1277 HydrophobicContact CG2-CB 3.85Å; I1198-I1280 HydrophobicContact CG1-CG1 4.34Å; I1198-I1280 HydrophobicContact CG1-CG2 4.22Å; I1198-I1280 HydrophobicContact CG2-CG1 4.32Å
1199	H	84.4	Confident	84.2	Confident	65 Å²	65	38.3 Å²	38.3	30%	0.301	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	129.1	169.1	-58.2	-91.3	0	0	0	108.8	A1277 K1278 K1279	H1199-A1277 CarbonylContact O-C 3.43Å; H1199-A1277 WeakPolarHBondContact O-CA 3.32Å; H1199-K1278 PolarHBondContact O-N 3.21Å; H1199-K1279 HydrophobicContact CB-CB 4.14Å; H1199-K1279 WeakPolarHBondContact CB-O 3.36Å; H1199-K1279 PolarHBondContact N-O 3Å; H1199-K1279 PolarHBondContact O-N 2.8Å
1200	M	85.5	Confident	84.8	Confident	2.4 Å²	2.4	35.1 Å²	35.1	1%	0.012	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	-175	-174.2	-54.5	-160.7	78.8	0	0	112	I1198 I1204 L1272 P1273 G1274 R1276 K1278	I1198-M1200 HydrophobicContact CG2-CG 4Å; I1198-M1200 HydrophobicContact CG2-SD 4.46Å; I1198-M1200 PolarHBondContact O-N 3.06Å; M1200-I1204 WeakPolarHBondContact CA-O 3.37Å; M1200-I1204 HydrophobicContact CB-CD1 4.42Å; M1200-I1204 HydrophobicContact CB-CG1 4.19Å; M1200-I1204 PolarHBondContact N-O 3.02Å; M1200-L1272 HydrophobicContact CE-CB 4.04Å; M1200-L1272 HydrophobicContact CE-CD1 4.05Å; M1200-L1272 HydrophobicContact CE-CG 4.28Å; M1200-L1272 HydrophobicContact SD-CB 3.9Å; M1200-L1272 HydrophobicContact SD-CD1 4.45Å; M1200-L1272 HydrophobicContact SD-CD2 4.16Å; M1200-L1272 HydrophobicContact SD-CG 4.36Å; M1200-P1273 HydrophobicContact SD-CG 3.92Å; M1200-G1274 VanDerWaalsContact CE-C 3.41Å; M1200-G1274 VanDerWaalsContact CE-O 3.26Å; M1200-G1274 WeakPolarHBondContact CE-O 3.35Å; M1200-G1274 PolarHBondContact SD-N 2.93Å; M1200-R1276 CarbonylContact C-O 3.39Å; M1200-R1276 VanDerWaalsContact C-O 3.31Å; M1200-R1276 WeakPolarHBondContact CA-O 3.25Å; M1200-R1276 VanDerWaalsContact CB-O 3.31Å; M1200-R1276 WeakPolarHBondContact CB-O 3.37Å; M1200-K1278 VanDerWaalsContact O-CD 3.27Å; M1200-K1278 WeakPolarHBondContact O-CD 3.42Å; M1200-K1278 WeakPolarHBondContact O-CE 3.18Å; M1200-K1278 WeakPolarHBondContact O-CG 3.31Å
1201	D	76	Confident	85.3	Confident	18.8 Å²	18.8	31.4 Å²	31.4	10%	0.101	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-57.5	162.6	163.6	35.9	14.6	0	0	0	112	N1203 I1204 G1274 E1275 R1276 K1278	D1201-N1203 VanDerWaalsContact C-N 3.27Å; D1201-N1203 PolarHBondContact O-N 3.02Å; D1201-I1204 VanDerWaalsContact O-CD1 3.29Å; D1201-I1204 WeakPolarHBondContact O-CD1 3.43Å; D1201-I1204 VanDerWaalsContact O-CG1 3.27Å; D1201-I1204 WeakPolarHBondContact O-CG1 3.31Å; D1201-I1204 PolarHBondContact O-N 3.04Å; D1201-G1274 VanDerWaalsContact OD1-CA 3.3Å; D1201-G1274 WeakPolarHBondContact OD1-CA 3.31Å; D1201-E1275 PolarHBondContact OD1-N 3.03Å; D1201-E1275 PolarHBondContact OD2-N 2.92Å; D1201-R1276 HydrophobicContact CB-CB 4.21Å; D1201-R1276 PolarHBondContact N-O 2.99Å; D1201-R1276 PolarHBondContact OD1-N 3.16Å; D1201-R1276 WeakPolarHBondContact OD2-CB 3.27Å; D1201-R1276 WeakPolarHBondContact OD2-CG 3.47Å; D1201-R1276 IonicContact OD2-CZ 3.44Å; D1201-R1276 VanDerWaalsContact OD2-CZ 3.26Å; D1201-R1276 PolarHBondContact OD2-N 2.87Å; D1201-R1276 IonicContact OD2-NE 3.13Å; D1201-R1276 PolarHBondContact OD2-NE 3.25Å; D1201-R1276 IonicContact OD2-NH2 2.89Å; D1201-R1276 PolarHBondContact OD2-NH2 2.88Å; D1201-K1278 VanDerWaalsContact C-NZ 3.34Å; D1201-K1278 VanDerWaalsContact CA-NZ 3.25Å
1202	N	69.3	Low	85.5	Confident	117.4 Å²	117.4	30.8 Å²	30.8	63%	0.628	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	58	26.4	174	-54.5	-19.4	0	0	0	116.5	I1204 R1541	N1202-I1204 HydrophobicContact CB-CD1 4.38Å; N1202-I1204 HydrophobicContact CB-CG1 4.24Å; N1202-I1204 WeakPolarHBondContact O-CG1 3.39Å; N1202-I1204 PolarHBondContact O-N 3.22Å; N1202-I1204 VanDerWaalsContact O-N 3.14Å; N1202-R1541 PolarHBondContact OD1-NH1 2.81Å; N1202-R1541 PolarHBondContact OD1-NH2 2.75Å
1203	N	65.3	Low	85.4	Confident	102.4 Å²	102.4	36.9 Å²	36.9	55%	0.548	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	7.8	178	-64.1	-7.2	0	0	0	115.9	D1201 K1278 L1564 N1567	D1201-N1203 VanDerWaalsContact C-N 3.27Å; D1201-N1203 PolarHBondContact O-N 3.02Å; N1203-K1278 PolarHBondContact OD1-NZ 3.24Å; N1203-L1564 WeakPolarHBondContact ND2-CD1 3.37Å; N1203-N1567 PolarHBondContact ND2-O 2.94Å; N1203-N1567 VanDerWaalsContact ND2-O 3.1Å
1204	I	78.5	Confident	85.2	Confident	32.4 Å²	32.4	35.9 Å²	35.9	17%	0.166	18%	0.179	C	C	.	.			trans	-77.7	153	169.2	37	179.5	0	0	0	110.1	M1200 D1201 N1202 T1221 L1222 P1273 G1274	M1200-I1204 WeakPolarHBondContact CA-O 3.37Å; M1200-I1204 HydrophobicContact CB-CD1 4.42Å; M1200-I1204 HydrophobicContact CB-CG1 4.19Å; M1200-I1204 PolarHBondContact N-O 3.02Å; D1201-I1204 VanDerWaalsContact O-CD1 3.29Å; D1201-I1204 WeakPolarHBondContact O-CD1 3.43Å; D1201-I1204 VanDerWaalsContact O-CG1 3.27Å; D1201-I1204 WeakPolarHBondContact O-CG1 3.31Å; D1201-I1204 PolarHBondContact O-N 3.04Å; N1202-I1204 HydrophobicContact CB-CD1 4.38Å; N1202-I1204 HydrophobicContact CB-CG1 4.24Å; N1202-I1204 WeakPolarHBondContact O-CG1 3.39Å; N1202-I1204 PolarHBondContact O-N 3.22Å; N1202-I1204 VanDerWaalsContact O-N 3.14Å; I1204-T1221 HydrophobicContact CG2-CG2 4.08Å; I1204-L1222 WeakPolarHBondContact CA-O 3.38Å; I1204-L1222 WeakPolarHBondContact CB-O 3.35Å; I1204-L1222 WeakPolarHBondContact CG2-O 3.39Å; I1204-P1273 HydrophobicContact CB-CB 4.24Å; I1204-P1273 HydrophobicContact CB-CG 4.2Å; I1204-P1273 HydrophobicContact CD1-CB 3.81Å; I1204-P1273 HydrophobicContact CD1-CG 4.07Å; I1204-P1273 WeakPolarHBondContact CD1-O 3.37Å; I1204-P1273 HydrophobicContact CG1-CB 4.26Å; I1204-P1273 HydrophobicContact CG1-CG 4.23Å; I1204-P1273 HydrophobicContact CG2-CB 3.59Å; I1204-P1273 HydrophobicContact CG2-CG 3.69Å; I1204-G1274 VanDerWaalsContact CD1-N 3.28Å
1205	A	83.5	Confident	85	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	156.9	175.5	0	0	0	0	0	110.1	I1197 I1198 T1221 L1222 W1227	I1197-A1205 HydrophobicContact CG2-CB 4.2Å; I1198-A1205 CarbonylContact O-C 3.57Å; I1198-A1205 VanDerWaalsContact O-CA 3.28Å; I1198-A1205 WeakPolarHBondContact O-CA 3.41Å; I1198-A1205 WeakPolarHBondContact O-CB 3.38Å; A1205-T1221 CarbonylContact O-C 3.48Å; A1205-T1221 WeakPolarHBondContact O-CA 3.46Å; A1205-L1222 HydrophobicContact CB-CB 3.89Å; A1205-L1222 HydrophobicContact CB-CD2 4.12Å; A1205-L1222 PolarHBondContact N-O 2.99Å; A1205-L1222 PolarHBondContact O-N 3.02Å; A1205-W1227 HydrophobicContact CB-CH2 3.79Å; A1205-W1227 HydrophobicContact CB-CZ2 4.48Å; A1205-W1227 HydrophobicContact CB-CZ3 4.44Å
1206	W	89.7	Confident	84.8	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	133.9	170.9	-177.7	89.5	0	0	0	108.8	M1196 I1197 I1198 I1208 P1219 S1220 M1257 L1259 Y1270 L1272 P1273	M1196-W1206 HydrophobicContact CE-CZ3 4.06Å; I1197-W1206 CarbonylContact C-O 3.58Å; I1197-W1206 WeakPolarHBondContact CA-O 3.3Å; I1198-W1206 HydrophobicContact CD1-CE3 3.85Å; I1198-W1206 HydrophobicContact CD1-CZ3 4.26Å; I1198-W1206 HydrophobicContact CG1-CE3 4.39Å; I1198-W1206 PolarHBondContact N-O 2.95Å; I1198-W1206 PolarHBondContact O-N 3.15Å; W1206-I1208 HydrophobicContact CH2-CB 3.51Å; W1206-I1208 VanDerWaalsContact CH2-CB 3.46Å; W1206-I1208 HydrophobicContact CH2-CD1 3.82Å; W1206-I1208 HydrophobicContact CH2-CG1 4.26Å; W1206-I1208 HydrophobicContact CH2-CG2 3.68Å; W1206-I1208 HydrophobicContact CZ2-CB 4.18Å; W1206-I1208 HydrophobicContact CZ2-CD1 4.26Å; W1206-I1208 HydrophobicContact CZ3-CB 3.78Å; W1206-I1208 HydrophobicContact CZ3-CG2 3.62Å; W1206-P1219 HydrophobicContact CZ2-CB 4.05Å; W1206-S1220 CarbonylContact C-O 3.53Å; W1206-S1220 WeakPolarHBondContact CA-O 3.35Å; W1206-M1257 HydrophobicContact CD2-CE 3.91Å; W1206-M1257 HydrophobicContact CE3-CE 3.66Å; W1206-M1257 HydrophobicContact CH2-CE 3.34Å; W1206-M1257 VanDerWaalsContact CH2-CE 3.42Å; W1206-M1257 HydrophobicContact CZ2-CE 3.64Å; W1206-M1257 VanDerWaalsContact CZ2-CE 3.47Å; W1206-M1257 HydrophobicContact CZ3-CE 3.38Å; W1206-M1257 VanDerWaalsContact CZ3-CE 3.48Å; W1206-L1259 HydrophobicContact CH2-CD1 4.33Å; W1206-Y1270 HydrophobicContact CH2-CD2 4.26Å; W1206-Y1270 HydrophobicContact CH2-CE2 4.46Å; W1206-Y1270 HydrophobicContact CH2-CG 4.28Å; W1206-Y1270 AromaticContact CZ2-CD1 3.81Å; W1206-Y1270 HydrophobicContact CZ2-CD1 4.15Å; W1206-Y1270 AromaticContact CZ2-CD2 3.69Å; W1206-Y1270 HydrophobicContact CZ2-CD2 3.69Å; W1206-Y1270 HydrophobicContact CZ2-CE1 4.4Å; W1206-Y1270 HydrophobicContact CZ2-CE2 4.2Å; W1206-Y1270 AromaticContact CZ2-CG 3.76Å; W1206-Y1270 HydrophobicContact CZ2-CG 3.76Å; W1206-Y1270 VanDerWaalsContact CZ2-CG 3.41Å; W1206-L1272 HydrophobicContact CB-CD2 3.96Å; W1206-L1272 HydrophobicContact CD2-CD2 4.18Å; W1206-L1272 HydrophobicContact CE3-CD2 4.39Å; W1206-L1272 HydrophobicContact CG-CD2 3.95Å; W1206-P1273 HydrophobicContact CB-CG 4.35Å
1207	K	90.3	Very high	84.7	Confident	35.6 Å²	35.6	40.6 Å²	40.6	16%	0.155	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	147.2	-178.2	176.1	176.9	-178.3	-171.7	0	109.2	E963 Y1195 M1196 I1197 N1209 P1219 S1220 W1227	E963-K1207 WeakPolarHBondContact OE1-CE 3.49Å; E963-K1207 IonicContact OE1-NZ 3.53Å; E963-K1207 PolarHBondContact OE1-NZ 3.41Å; E963-K1207 IonicContact OE2-NZ 2.84Å; E963-K1207 PolarHBondContact OE2-NZ 3.35Å; Y1195-K1207 VanDerWaalsContact CG-CE 3.49Å; M1196-K1207 CarbonylContact O-C 3.51Å; M1196-K1207 VanDerWaalsContact O-CA 3.27Å; M1196-K1207 WeakPolarHBondContact O-CA 3.21Å; I1197-K1207 HydrophobicContact CD1-CD 4.25Å; I1197-K1207 HydrophobicContact CD1-CG 4.46Å; I1197-K1207 HydrophobicContact CG1-CB 4.1Å; I1197-K1207 HydrophobicContact CG1-CD 4.14Å; I1197-K1207 HydrophobicContact CG1-CG 3.89Å; K1207-N1209 VanDerWaalsContact CE-OD1 3.25Å; K1207-N1209 WeakPolarHBondContact CE-OD1 3.28Å; K1207-N1209 PolarHBondContact NZ-OD1 3.18Å; K1207-P1219 CarbonylContact O-C 3.58Å; K1207-P1219 WeakPolarHBondContact O-CA 3.38Å; K1207-S1220 WeakPolarHBondContact CB-OG 3.32Å; K1207-S1220 PolarHBondContact N-O 3.01Å; K1207-S1220 PolarHBondContact O-N 2.97Å; K1207-S1220 VanDerWaalsContact O-O 3.1Å; K1207-S1220 PolarHBondContact O-OG 2.85Å; K1207-W1227 HydrophobicContact CB-CE3 3.99Å; K1207-W1227 HydrophobicContact CB-CH2 3.53Å; K1207-W1227 VanDerWaalsContact CB-CH2 3.41Å; K1207-W1227 HydrophobicContact CB-CZ2 4.34Å; K1207-W1227 HydrophobicContact CB-CZ3 3.32Å; K1207-W1227 VanDerWaalsContact CB-CZ3 3.41Å; K1207-W1227 HydrophobicContact CD-CD2 4.03Å; K1207-W1227 HydrophobicContact CD-CE3 4.03Å; K1207-W1227 HydrophobicContact CD-CH2 3.99Å; K1207-W1227 HydrophobicContact CD-CZ2 4.01Å; K1207-W1227 HydrophobicContact CD-CZ3 4.08Å; K1207-W1227 HydrophobicContact CG-CH2 4.37Å; K1207-W1227 HydrophobicContact CG-CZ3 4.33Å
1208	I	90.2	Very high	84.7	Confident	0.8 Å²	0.8	41.3 Å²	41.3	0%	0.004	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	121.4	162.3	-168.9	156.6	0	0	0	109.1	Y1195 M1196 W1206 W1217 T1218 F1234 L1259 Y1270	Y1195-I1208 CarbonylContact C-O 3.54Å; Y1195-I1208 WeakPolarHBondContact CA-O 3.28Å; Y1195-I1208 WeakPolarHBondContact CB-O 3.38Å; M1196-I1208 HydrophobicContact CB-CG2 4.1Å; M1196-I1208 HydrophobicContact CE-CG2 4.23Å; M1196-I1208 PolarHBondContact N-O 2.77Å; M1196-I1208 VanDerWaalsContact N-O 3.08Å; M1196-I1208 PolarHBondContact O-N 3.02Å; W1206-I1208 HydrophobicContact CH2-CB 3.51Å; W1206-I1208 VanDerWaalsContact CH2-CB 3.46Å; W1206-I1208 HydrophobicContact CH2-CD1 3.82Å; W1206-I1208 HydrophobicContact CH2-CG1 4.26Å; W1206-I1208 HydrophobicContact CH2-CG2 3.68Å; W1206-I1208 HydrophobicContact CZ2-CB 4.18Å; W1206-I1208 HydrophobicContact CZ2-CD1 4.26Å; W1206-I1208 HydrophobicContact CZ3-CB 3.78Å; W1206-I1208 HydrophobicContact CZ3-CG2 3.62Å; I1208-W1217 HydrophobicContact CD1-CB 4.28Å; I1208-W1217 HydrophobicContact CD1-CE3 3.78Å; I1208-W1217 HydrophobicContact CD1-CZ3 4.38Å; I1208-W1217 HydrophobicContact CG1-CB 4.5Å; I1208-W1217 HydrophobicContact CG1-CE3 4.11Å; I1208-T1218 WeakPolarHBondContact CA-O 3.39Å; I1208-F1234 HydrophobicContact CD1-CE1 4.32Å; I1208-L1259 HydrophobicContact CD1-CD1 3.96Å; I1208-Y1270 HydrophobicContact CD1-CE2 4.29Å
1209	N	89.8	Confident	84.7	Confident	37.8 Å²	37.8	41.3 Å²	41.3	20%	0.202	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	146.5	170.9	-117.8	9.8	0	0	0	109	E1193 F1194 Y1195 K1207 W1217 T1218	E1193-N1209 PolarHBondContact OE2-ND2 3.09Å; E1193-N1209 VanDerWaalsContact OE2-ND2 3.16Å; F1194-N1209 CarbonylContact O-C 3.58Å; Y1195-N1209 WeakPolarHBondContact CB-OD1 3.23Å; K1207-N1209 VanDerWaalsContact CE-OD1 3.25Å; K1207-N1209 WeakPolarHBondContact CE-OD1 3.28Å; K1207-N1209 PolarHBondContact NZ-OD1 3.18Å; N1209-W1217 CarbonylContact O-C 3.46Å; N1209-W1217 WeakPolarHBondContact O-CA 3.41Å; N1209-T1218 WeakPolarHBondContact CB-OG1 3.44Å; N1209-T1218 PolarHBondContact N-O 2.85Å; N1209-T1218 PolarHBondContact O-N 2.92Å
1210	V	90.4	Very high	84.8	Confident	0.8 Å²	0.8	38.8 Å²	38.8	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	110.5	-176	-174.5	0	0	0	0	109.1	E1193 F1194 L1212 E1216 W1217 L1240	E1193-V1210 CarbonylContact C-O 3.46Å; E1193-V1210 WeakPolarHBondContact CA-O 3.3Å; E1193-V1210 WeakPolarHBondContact CB-O 3.44Å; F1194-V1210 HydrophobicContact CD1-CB 3.86Å; F1194-V1210 HydrophobicContact CD1-CG1 4.1Å; F1194-V1210 HydrophobicContact CD1-CG2 4.41Å; F1194-V1210 HydrophobicContact CD2-CB 4.44Å; F1194-V1210 HydrophobicContact CD2-CG2 4.37Å; F1194-V1210 HydrophobicContact CE1-CB 3.6Å; F1194-V1210 HydrophobicContact CE1-CG1 3.5Å; F1194-V1210 VanDerWaalsContact CE1-CG1 3.48Å; F1194-V1210 HydrophobicContact CE1-CG2 3.97Å; F1194-V1210 HydrophobicContact CE2-CB 4.27Å; F1194-V1210 HydrophobicContact CE2-CG2 3.84Å; F1194-V1210 HydrophobicContact CG-CB 4.31Å; F1194-V1210 HydrophobicContact CZ-CB 3.81Å; F1194-V1210 HydrophobicContact CZ-CG1 3.93Å; F1194-V1210 HydrophobicContact CZ-CG2 3.61Å; F1194-V1210 PolarHBondContact N-O 3.14Å; F1194-V1210 WeakPolarHBondContact O-CA 3.23Å; F1194-V1210 WeakPolarHBondContact O-CB 3.29Å; F1194-V1210 PolarHBondContact O-N 3.07Å; V1210-L1212 HydrophobicContact CG1-CD2 4.32Å; V1210-E1216 CarbonylContact C-O 3.55Å; V1210-E1216 WeakPolarHBondContact CA-O 3.24Å; V1210-W1217 HydrophobicContact CB-CD2 4.27Å; V1210-W1217 HydrophobicContact CB-CE3 4.43Å; V1210-W1217 HydrophobicContact CG1-CD2 3.8Å; V1210-W1217 VanDerWaalsContact CG1-CE2 3.44Å; V1210-W1217 HydrophobicContact CG1-CE3 4.4Å; V1210-W1217 HydrophobicContact CG1-CG 4.15Å; V1210-W1217 HydrophobicContact CG1-CH2 4.33Å; V1210-W1217 HydrophobicContact CG1-CZ2 3.73Å; V1210-W1217 HydrophobicContact CG2-CD2 3.55Å; V1210-W1217 HydrophobicContact CG2-CE3 3.34Å; V1210-W1217 HydrophobicContact CG2-CG 4.21Å; V1210-W1217 HydrophobicContact CG2-CH2 3.96Å; V1210-W1217 HydrophobicContact CG2-CZ2 4.15Å; V1210-W1217 HydrophobicContact CG2-CZ3 3.55Å; V1210-W1217 VanDerWaalsContact CG2-CZ3 3.49Å; V1210-L1240 HydrophobicContact CG1-CD1 4.22Å
1211	N	89.4	Confident	84.7	Confident	50.2 Å²	50.2	39.2 Å²	39.2	27%	0.268	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	116	174.9	-175.2	-40.6	0	0	0	109.2	K1213 T1214 K1215 E1216	N1211-K1213 VanDerWaalsContact C-N 3.32Å; N1211-K1213 PolarHBondContact O-N 3.02Å; N1211-K1213 WeakPolarHBondContact OD1-CA 3.26Å; N1211-K1213 WeakPolarHBondContact OD1-CB 3.34Å; N1211-K1213 PolarHBondContact OD1-N 2.86Å; N1211-T1214 VanDerWaalsContact CB-OG1 3.31Å; N1211-T1214 WeakPolarHBondContact CB-OG1 3.41Å; N1211-T1214 VanDerWaalsContact CG-OG1 3.26Å; N1211-T1214 PolarHBondContact ND2-OG1 2.84Å; N1211-T1214 VanDerWaalsContact ND2-OG1 3.07Å; N1211-T1214 PolarHBondContact OD1-N 2.82Å; N1211-T1214 VanDerWaalsContact OD1-N 3.1Å; N1211-T1214 PolarHBondContact OD1-OG1 3.03Å; N1211-K1215 CarbonylContact O-C 3.53Å; N1211-K1215 WeakPolarHBondContact O-CA 3.21Å; N1211-K1215 PolarHBondContact O-N 2.95Å; N1211-E1216 HydrophobicContact CB-CB 4.39Å; N1211-E1216 PolarHBondContact N-O 3.04Å; N1211-E1216 PolarHBondContact O-N 2.84Å
1212	L	85.6	Confident	84.8	Confident	6.4 Å²	6.4	39.4 Å²	39.4	3%	0.034	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-19.3	-175.6	-62	168.7	0	0	0	112.6	L1187 A1191 S1192 F1194 V1210 L1240 N1241	L1187-L1212 HydrophobicContact CD1-CD1 3.85Å; L1187-L1212 HydrophobicContact CD1-CD2 4.18Å; L1187-L1212 HydrophobicContact CD2-CD1 4.24Å; A1191-L1212 VanDerWaalsContact C-CD1 3.5Å; A1191-L1212 HydrophobicContact CB-CD1 3.5Å; A1191-L1212 VanDerWaalsContact CB-CD1 3.48Å; A1191-L1212 VanDerWaalsContact O-CD1 3.31Å; A1191-L1212 WeakPolarHBondContact O-CD1 3.38Å; S1192-L1212 VanDerWaalsContact O-CB 3.32Å; S1192-L1212 WeakPolarHBondContact O-CB 3.21Å; S1192-L1212 PolarHBondContact O-N 2.93Å; F1194-L1212 HydrophobicContact CD1-CD1 4.38Å; F1194-L1212 HydrophobicContact CD1-CD2 4.17Å; F1194-L1212 HydrophobicContact CD1-CG 4.43Å; F1194-L1212 HydrophobicContact CE1-CD2 4.08Å; V1210-L1212 HydrophobicContact CG1-CD2 4.32Å; L1212-L1240 HydrophobicContact CD2-CB 3.84Å; L1212-L1240 HydrophobicContact CD2-CD1 3.49Å; L1212-L1240 VanDerWaalsContact CD2-CD1 3.46Å; L1212-L1240 HydrophobicContact CD2-CD2 4.38Å; L1212-L1240 HydrophobicContact CD2-CG 4.24Å; L1212-N1241 PolarHBondContact O-ND2 3.23Å; L1212-N1241 PolarHBondContact O-OD1 3.3Å; L1212-N1241 VanDerWaalsContact O-OD1 3.1Å
1213	K	83.4	Confident	84.5	Confident	163.4 Å²	163.4	36.2 Å²	36.2	71%	0.71	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-52.4	176.3	-63.7	177.6	177.7	175	0	111.1	N1211 K1215	N1211-K1213 VanDerWaalsContact C-N 3.32Å; N1211-K1213 PolarHBondContact O-N 3.02Å; N1211-K1213 WeakPolarHBondContact OD1-CA 3.26Å; N1211-K1213 WeakPolarHBondContact OD1-CB 3.34Å; N1211-K1213 PolarHBondContact OD1-N 2.86Å; K1213-K1215 VanDerWaalsContact C-N 3.33Å
1214	T	86	Confident	84	Confident	58.4 Å²	58.4	36.2 Å²	36.2	36%	0.358	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-13.9	-179.6	66.4	0	0	0	0	113.6	N1211 E1216	N1211-T1214 VanDerWaalsContact CB-OG1 3.31Å; N1211-T1214 WeakPolarHBondContact CB-OG1 3.41Å; N1211-T1214 VanDerWaalsContact CG-OG1 3.26Å; N1211-T1214 PolarHBondContact ND2-OG1 2.84Å; N1211-T1214 VanDerWaalsContact ND2-OG1 3.07Å; N1211-T1214 PolarHBondContact OD1-N 2.82Å; N1211-T1214 VanDerWaalsContact OD1-N 3.1Å; N1211-T1214 PolarHBondContact OD1-OG1 3.03Å; T1214-E1216 VanDerWaalsContact CB-CD 3.47Å; T1214-E1216 WeakPolarHBondContact CB-OE2 3.32Å; T1214-E1216 WeakPolarHBondContact CG2-OE2 3.19Å; T1214-E1216 PolarHBondContact O-N 3.1Å; T1214-E1216 WeakPolarHBondContact OG1-CB 3.31Å; T1214-E1216 VanDerWaalsContact OG1-CD 3.25Å; T1214-E1216 WeakPolarHBondContact OG1-CG 3.26Å; T1214-E1216 PolarHBondContact OG1-N 3.11Å; T1214-E1216 PolarHBondContact OG1-OE2 3.02Å
1215	K	85.8	Confident	83.2	Confident	84 Å²	84	38.6 Å²	38.6	37%	0.365	20%	0.195	S	C	.	.			trans	63.2	18.6	-173.2	-50.5	174.6	-171.2	148.6	0	113.8	N1211 K1213 K1235 S1236	N1211-K1215 CarbonylContact O-C 3.53Å; N1211-K1215 WeakPolarHBondContact O-CA 3.21Å; N1211-K1215 PolarHBondContact O-N 2.95Å; K1213-K1215 VanDerWaalsContact C-N 3.33Å; K1215-K1235 WeakPolarHBondContact O-CA 3.25Å; K1215-S1236 WeakPolarHBondContact CB-O 3.23Å; K1215-S1236 VanDerWaalsContact CD-O 3.29Å; K1215-S1236 WeakPolarHBondContact CD-O 3.15Å; K1215-S1236 PolarHBondContact O-N 2.92Å
1216	E	87.3	Confident	82.1	Confident	59.2 Å²	59.2	41.9 Å²	41.9	28%	0.277	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	136	177.9	-71.7	158.5	165.7	0	0	111.2	V1210 N1211 T1214 F1234 K1235	V1210-E1216 CarbonylContact C-O 3.55Å; V1210-E1216 WeakPolarHBondContact CA-O 3.24Å; N1211-E1216 HydrophobicContact CB-CB 4.39Å; N1211-E1216 PolarHBondContact N-O 3.04Å; N1211-E1216 PolarHBondContact O-N 2.84Å; T1214-E1216 VanDerWaalsContact CB-CD 3.47Å; T1214-E1216 WeakPolarHBondContact CB-OE2 3.32Å; T1214-E1216 WeakPolarHBondContact CG2-OE2 3.19Å; T1214-E1216 PolarHBondContact O-N 3.1Å; T1214-E1216 WeakPolarHBondContact OG1-CB 3.31Å; T1214-E1216 VanDerWaalsContact OG1-CD 3.25Å; T1214-E1216 WeakPolarHBondContact OG1-CG 3.26Å; T1214-E1216 PolarHBondContact OG1-N 3.11Å; T1214-E1216 PolarHBondContact OG1-OE2 3.02Å; E1216-F1234 CarbonylContact C-O 3.47Å; E1216-F1234 WeakPolarHBondContact CA-O 3.18Å; E1216-K1235 VanDerWaalsContact CD-CE 3.45Å; E1216-K1235 HydrophobicContact CG-CD 4.22Å; E1216-K1235 VanDerWaalsContact CG-CE 3.41Å; E1216-K1235 HydrophobicContact CG-CG 3.68Å; E1216-K1235 WeakPolarHBondContact OE1-CE 3.4Å; E1216-K1235 IonicContact OE1-NZ 3Å; E1216-K1235 PolarHBondContact OE1-NZ 3.02Å
1217	W	90.4	Very high	81.3	Confident	1.8 Å²	1.8	46.2 Å²	46.2	1%	0.007	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	111.5	174.3	-72.4	65.1	0	0	0	107.4	F1194 I1208 N1209 V1210 P1219 T1233 F1234 S1236 L1240 L1248 L1259 L1261 L1266	F1194-W1217 HydrophobicContact CE1-CH2 4.44Å; F1194-W1217 HydrophobicContact CE2-CH2 4.48Å; F1194-W1217 AromaticContact CZ-CH2 3.79Å; F1194-W1217 HydrophobicContact CZ-CH2 3.79Å; F1194-W1217 HydrophobicContact CZ-CZ2 4.24Å; F1194-W1217 HydrophobicContact CZ-CZ3 4.35Å; I1208-W1217 HydrophobicContact CD1-CB 4.28Å; I1208-W1217 HydrophobicContact CD1-CE3 3.78Å; I1208-W1217 HydrophobicContact CD1-CZ3 4.38Å; I1208-W1217 HydrophobicContact CG1-CB 4.5Å; I1208-W1217 HydrophobicContact CG1-CE3 4.11Å; N1209-W1217 CarbonylContact O-C 3.46Å; N1209-W1217 WeakPolarHBondContact O-CA 3.41Å; V1210-W1217 HydrophobicContact CB-CD2 4.27Å; V1210-W1217 HydrophobicContact CB-CE3 4.43Å; V1210-W1217 HydrophobicContact CG1-CD2 3.8Å; V1210-W1217 VanDerWaalsContact CG1-CE2 3.44Å; V1210-W1217 HydrophobicContact CG1-CE3 4.4Å; V1210-W1217 HydrophobicContact CG1-CG 4.15Å; V1210-W1217 HydrophobicContact CG1-CH2 4.33Å; V1210-W1217 HydrophobicContact CG1-CZ2 3.73Å; V1210-W1217 HydrophobicContact CG2-CD2 3.55Å; V1210-W1217 HydrophobicContact CG2-CE3 3.34Å; V1210-W1217 HydrophobicContact CG2-CG 4.21Å; V1210-W1217 HydrophobicContact CG2-CH2 3.96Å; V1210-W1217 HydrophobicContact CG2-CZ2 4.15Å; V1210-W1217 HydrophobicContact CG2-CZ3 3.55Å; V1210-W1217 VanDerWaalsContact CG2-CZ3 3.49Å; W1217-P1219 VanDerWaalsContact O-CD 3.28Å; W1217-P1219 WeakPolarHBondContact O-CD 3.32Å; W1217-T1233 WeakPolarHBondContact O-CA 3.46Å; W1217-F1234 HydrophobicContact CB-CD1 3.8Å; W1217-F1234 HydrophobicContact CB-CD2 4.33Å; W1217-F1234 HydrophobicContact CB-CE1 3.28Å; W1217-F1234 HydrophobicContact CB-CE2 3.97Å; W1217-F1234 HydrophobicContact CB-CG 4.35Å; W1217-F1234 HydrophobicContact CB-CZ 3.38Å; W1217-F1234 VanDerWaalsContact CB-CZ 3.49Å; W1217-F1234 HydrophobicContact CD2-CE1 4.29Å; W1217-F1234 HydrophobicContact CD2-CE2 4.39Å; W1217-F1234 AromaticContact CD2-CZ 3.91Å; W1217-F1234 HydrophobicContact CD2-CZ 3.91Å; W1217-F1234 HydrophobicContact CE3-CE1 4.49Å; W1217-F1234 HydrophobicContact CE3-CZ 4.25Å; W1217-F1234 AromaticContact CG-CE1 3.88Å; W1217-F1234 HydrophobicContact CG-CE1 4Å; W1217-F1234 AromaticContact CG-CE2 3.88Å; W1217-F1234 HydrophobicContact CG-CE2 3.96Å; W1217-F1234 AromaticContact CG-CZ 3.54Å; W1217-F1234 HydrophobicContact CG-CZ 3.54Å; W1217-F1234 VanDerWaalsContact CG-CZ 3.48Å; W1217-F1234 PolarHBondContact N-O 2.93Å; W1217-F1234 PolarHBondContact O-N 3.2Å; W1217-F1234 VanDerWaalsContact O-N 3.13Å; W1217-S1236 VanDerWaalsContact NE1-CB 3.32Å; W1217-L1240 HydrophobicContact CZ2-CD1 4.01Å; W1217-L1240 HydrophobicContact CZ2-CD2 4.48Å; W1217-L1248 HydrophobicContact CH2-CD1 4.24Å; W1217-L1248 HydrophobicContact CZ3-CD1 4.33Å; W1217-L1259 HydrophobicContact CE3-CD1 4.44Å; W1217-L1259 HydrophobicContact CZ3-CD1 4.38Å; W1217-L1261 HydrophobicContact CH2-CD1 4.36Å; W1217-L1261 HydrophobicContact CH2-CD2 4.29Å; W1217-L1261 HydrophobicContact CZ2-CD2 4.16Å; W1217-L1266 HydrophobicContact CD2-CD2 3.93Å; W1217-L1266 HydrophobicContact CE3-CD1 4.24Å; W1217-L1266 HydrophobicContact CE3-CD2 3.71Å; W1217-L1266 HydrophobicContact CH2-CD1 3.87Å; W1217-L1266 HydrophobicContact CH2-CD2 3.4Å; W1217-L1266 VanDerWaalsContact CH2-CD2 3.44Å; W1217-L1266 HydrophobicContact CZ2-CD1 4.15Å; W1217-L1266 HydrophobicContact CZ2-CD2 3.8Å; W1217-L1266 HydrophobicContact CZ2-CG 4.43Å; W1217-L1266 HydrophobicContact CZ3-CD1 3.81Å; W1217-L1266 HydrophobicContact CZ3-CD2 3.46Å; W1217-L1266 VanDerWaalsContact CZ3-CD2 3.44Å
1218	T	87.9	Confident	80.5	Confident	30.8 Å²	30.8	48.5 Å²	48.5	19%	0.189	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	100.6	-170.9	-39.8	0	0	0	0	110.2	I1208 N1209 Q1229 T1233	I1208-T1218 WeakPolarHBondContact CA-O 3.39Å; N1209-T1218 WeakPolarHBondContact CB-OG1 3.44Å; N1209-T1218 PolarHBondContact N-O 2.85Å; N1209-T1218 PolarHBondContact O-N 2.92Å; T1218-Q1229 VanDerWaalsContact CG2-CD 3.46Å; T1218-Q1229 HydrophobicContact CG2-CG 3.81Å; T1218-T1233 HydrophobicContact CG2-CG2 4.06Å; T1218-T1233 VanDerWaalsContact CG2-CG2 3.43Å
1219	P	89.1	Confident	79.8	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	147.5	174.3	31.1	-36.4	0	0	0	112	W1206 K1207 W1217 Q1230 D1232 Y1270	W1206-P1219 HydrophobicContact CZ2-CB 4.05Å; K1207-P1219 CarbonylContact O-C 3.58Å; K1207-P1219 WeakPolarHBondContact O-CA 3.38Å; W1217-P1219 VanDerWaalsContact O-CD 3.28Å; W1217-P1219 WeakPolarHBondContact O-CD 3.32Å; P1219-Q1230 HydrophobicContact CB-CB 4.17Å; P1219-Q1230 HydrophobicContact CB-CG 4.41Å; P1219-Q1230 HydrophobicContact CG-CB 3.9Å; P1219-Q1230 PolarHBondContact O-N 2.9Å; P1219-D1232 WeakPolarHBondContact CD-O 3.25Å; P1219-D1232 HydrophobicContact CG-CB 4.41Å; P1219-D1232 VanDerWaalsContact CG-O 3.32Å; P1219-D1232 WeakPolarHBondContact CG-O 3.03Å; P1219-Y1270 HydrophobicContact CB-CD1 4.17Å; P1219-Y1270 HydrophobicContact CB-CE1 3.77Å; P1219-Y1270 HydrophobicContact CG-CD1 4.37Å; P1219-Y1270 HydrophobicContact CG-CE1 3.61Å; P1219-Y1270 VanDerWaalsContact CG-CE1 3.49Å
1220	S	86.3	Confident	78.7	Confident	12.6 Å²	12.6	54.6 Å²	54.6	9%	0.088	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	149.3	176.7	-12.2	0	0	0	0	111.5	W1206 K1207 E1228	W1206-S1220 CarbonylContact C-O 3.53Å; W1206-S1220 WeakPolarHBondContact CA-O 3.35Å; K1207-S1220 WeakPolarHBondContact CB-OG 3.32Å; K1207-S1220 PolarHBondContact N-O 3.01Å; K1207-S1220 PolarHBondContact O-N 2.97Å; K1207-S1220 VanDerWaalsContact O-O 3.1Å; K1207-S1220 PolarHBondContact O-OG 2.85Å; S1220-E1228 CarbonylContact C-O 3.52Å; S1220-E1228 VanDerWaalsContact CA-O 3.24Å; S1220-E1228 WeakPolarHBondContact CA-O 3.4Å; S1220-E1228 VanDerWaalsContact CB-O 3.29Å; S1220-E1228 WeakPolarHBondContact CB-O 3.38Å
1221	T	84	Confident	77.2	Confident	10.4 Å²	10.4	63.5 Å²	63.5	6%	0.064	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	135.9	178.4	-48.7	0	0	0	0	109.8	I1204 A1205 I1223 W1227 E1228 Q1230 P1273	I1204-T1221 HydrophobicContact CG2-CG2 4.08Å; A1205-T1221 CarbonylContact O-C 3.48Å; A1205-T1221 WeakPolarHBondContact O-CA 3.46Å; T1221-I1223 HydrophobicContact CG2-CD1 4.13Å; T1221-I1223 HydrophobicContact CG2-CG1 3.84Å; T1221-I1223 PolarHBondContact O-N 3.05Å; T1221-W1227 WeakPolarHBondContact O-CA 3.42Å; T1221-E1228 PolarHBondContact N-O 2.98Å; T1221-E1228 PolarHBondContact O-N 2.94Å; T1221-Q1230 PolarHBondContact OG1-NE2 3.01Å; T1221-P1273 HydrophobicContact CG2-CB 3.91Å; T1221-P1273 HydrophobicContact CG2-CG 3.87Å
1222	L	78	Confident	76.2	Confident	22 Å²	22	64.8 Å²	64.8	12%	0.115	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	103.7	171.2	-171.4	75.8	0	0	0	108.8	P966 I1204 A1205 N1225 V1226 W1227	P966-L1222 HydrophobicContact CG-CD1 4.28Å; I1204-L1222 WeakPolarHBondContact CA-O 3.38Å; I1204-L1222 WeakPolarHBondContact CB-O 3.35Å; I1204-L1222 WeakPolarHBondContact CG2-O 3.39Å; A1205-L1222 HydrophobicContact CB-CB 3.89Å; A1205-L1222 HydrophobicContact CB-CD2 4.12Å; A1205-L1222 PolarHBondContact N-O 2.99Å; A1205-L1222 PolarHBondContact O-N 3.02Å; L1222-N1225 VanDerWaalsContact CD1-C 3.47Å; L1222-N1225 WeakPolarHBondContact CD1-O 3.3Å; L1222-V1226 CarbonylContact C-O 3.43Å; L1222-V1226 VanDerWaalsContact CA-O 3.28Å; L1222-V1226 WeakPolarHBondContact CA-O 3.39Å; L1222-W1227 HydrophobicContact CB-CD2 4.24Å; L1222-W1227 HydrophobicContact CB-CE3 3.95Å; L1222-W1227 HydrophobicContact CB-CH2 3.91Å; L1222-W1227 HydrophobicContact CB-CZ2 4.2Å; L1222-W1227 HydrophobicContact CB-CZ3 3.77Å; L1222-W1227 HydrophobicContact CD1-CD2 3.93Å; L1222-W1227 HydrophobicContact CD1-CE3 4.4Å; L1222-W1227 HydrophobicContact CD1-CG 4.13Å; L1222-W1227 HydrophobicContact CD1-CZ2 4.22Å; L1222-W1227 HydrophobicContact CD2-CZ2 4.37Å
1223	I	63.1	Low	75.9	Confident	52 Å²	52	67.1 Å²	67.1	27%	0.267	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	128.6	176.1	-65	175.8	0	0	0	107.2	T1221 N1225 V1226 E1228 I1539	T1221-I1223 HydrophobicContact CG2-CD1 4.13Å; T1221-I1223 HydrophobicContact CG2-CG1 3.84Å; T1221-I1223 PolarHBondContact O-N 3.05Å; I1223-N1225 VanDerWaalsContact C-N 3.28Å; I1223-N1225 PolarHBondContact O-N 2.88Å; I1223-N1225 VanDerWaalsContact O-N 3.17Å; I1223-V1226 PolarHBondContact N-O 2.99Å; I1223-V1226 VanDerWaalsContact N-O 3.09Å; I1223-V1226 WeakPolarHBondContact O-CA 3.41Å; I1223-V1226 VanDerWaalsContact O-CB 3.27Å; I1223-V1226 WeakPolarHBondContact O-CB 3.33Å; I1223-V1226 WeakPolarHBondContact O-CG2 3.08Å; I1223-V1226 PolarHBondContact O-N 2.82Å; I1223-V1226 VanDerWaalsContact O-O 3.1Å; I1223-E1228 WeakPolarHBondContact CB-OE1 3.24Å; I1223-E1228 HydrophobicContact CD1-CB 4.48Å; I1223-E1228 WeakPolarHBondContact CD1-OE1 3.28Å; I1223-E1228 VanDerWaalsContact CD1-OE2 3.23Å; I1223-E1228 WeakPolarHBondContact CD1-OE2 3.23Å; I1223-E1228 WeakPolarHBondContact CG2-OE1 3.48Å; I1223-I1539 HydrophobicContact CD1-CD1 4.11Å
1224	N	55.7	Low	76	Confident	102.6 Å²	102.6	60.7 Å²	60.7	55%	0.549	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.6	36.2	-179	-59.9	-18.6	0	0	0	114.4	P969 V1226 N1545 L1564 N1567	P969-N1224 WeakPolarHBondContact CD-O 3.34Å; P969-N1224 HydrophobicContact CG-CB 4.04Å; N1224-V1226 VanDerWaalsContact C-N 3.27Å; N1224-V1226 PolarHBondContact O-N 2.98Å; N1224-N1545 PolarHBondContact ND2-O 3.25Å; N1224-N1545 VanDerWaalsContact ND2-O 3.08Å; N1224-L1564 HydrophobicContact CB-CD2 3.86Å; N1224-L1564 WeakPolarHBondContact ND2-CD2 3.26Å; N1224-N1567 WeakPolarHBondContact CB-OD1 3.45Å; N1224-N1567 PolarHBondContact O-ND2 2.9Å; N1224-N1567 PolarHBondContact O-OD1 2.88Å
1225	N	61	Low	75.7	Confident	81.2 Å²	81.2	64.6 Å²	64.6	43%	0.434	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.1	11.7	-173.3	-62.4	-26.2	0	0	0	116.2	P966 P967 K1160 L1222 I1223	P966-N1225 HydrophobicContact CB-CB 3.58Å; P966-N1225 WeakPolarHBondContact CD-O 3.26Å; P966-N1225 HydrophobicContact CG-CB 3.57Å; P966-N1225 VanDerWaalsContact CG-O 3.23Å; P966-N1225 WeakPolarHBondContact CG-O 3.46Å; P967-N1225 WeakPolarHBondContact O-CB 3.35Å; P967-N1225 PolarHBondContact O-ND2 2.86Å; K1160-N1225 PolarHBondContact O-ND2 3.33Å; L1222-N1225 VanDerWaalsContact CD1-C 3.47Å; L1222-N1225 WeakPolarHBondContact CD1-O 3.3Å; I1223-N1225 VanDerWaalsContact C-N 3.28Å; I1223-N1225 PolarHBondContact O-N 2.88Å; I1223-N1225 VanDerWaalsContact O-N 3.17Å
1226	V	60	Low	75.2	Confident	70.6 Å²	70.6	61 Å²	61	43%	0.428	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	138.9	173.5	-175.3	0	0	0	0	109.5	L1222 I1223 N1224 E1228 N1567	L1222-V1226 CarbonylContact C-O 3.43Å; L1222-V1226 VanDerWaalsContact CA-O 3.28Å; L1222-V1226 WeakPolarHBondContact CA-O 3.39Å; I1223-V1226 PolarHBondContact N-O 2.99Å; I1223-V1226 VanDerWaalsContact N-O 3.09Å; I1223-V1226 WeakPolarHBondContact O-CA 3.41Å; I1223-V1226 VanDerWaalsContact O-CB 3.27Å; I1223-V1226 WeakPolarHBondContact O-CB 3.33Å; I1223-V1226 WeakPolarHBondContact O-CG2 3.08Å; I1223-V1226 PolarHBondContact O-N 2.82Å; I1223-V1226 VanDerWaalsContact O-O 3.1Å; N1224-V1226 VanDerWaalsContact C-N 3.27Å; N1224-V1226 PolarHBondContact O-N 2.98Å; V1226-E1228 PolarHBondContact O-N 2.99Å; V1226-N1567 WeakPolarHBondContact CG1-O 3.38Å; V1226-N1567 HydrophobicContact CG2-CB 3.33Å; V1226-N1567 WeakPolarHBondContact CG2-O 3.39Å; V1226-N1567 WeakPolarHBondContact CG2-OD1 3.36Å
1227	W	74.1	Confident	74.3	Confident	88.8 Å²	88.8	63.9 Å²	63.9	34%	0.336	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	106.1	172.6	-75.2	107.9	0	0	0	110.3	D1162 I1197 A1205 K1207 T1221 L1222	D1162-W1227 VanDerWaalsContact OD2-CE2 3.26Å; D1162-W1227 WeakPolarHBondContact OD2-CZ2 3.16Å; D1162-W1227 PolarHBondContact OD2-NE1 3.31Å; I1197-W1227 HydrophobicContact CD1-CZ2 4.39Å; I1197-W1227 HydrophobicContact CG2-CH2 4.17Å; I1197-W1227 HydrophobicContact CG2-CZ2 4.48Å; A1205-W1227 HydrophobicContact CB-CH2 3.79Å; A1205-W1227 HydrophobicContact CB-CZ2 4.48Å; A1205-W1227 HydrophobicContact CB-CZ3 4.44Å; K1207-W1227 HydrophobicContact CB-CE3 3.99Å; K1207-W1227 HydrophobicContact CB-CH2 3.53Å; K1207-W1227 VanDerWaalsContact CB-CH2 3.41Å; K1207-W1227 HydrophobicContact CB-CZ2 4.34Å; K1207-W1227 HydrophobicContact CB-CZ3 3.32Å; K1207-W1227 VanDerWaalsContact CB-CZ3 3.41Å; K1207-W1227 HydrophobicContact CD-CD2 4.03Å; K1207-W1227 HydrophobicContact CD-CE3 4.03Å; K1207-W1227 HydrophobicContact CD-CH2 3.99Å; K1207-W1227 HydrophobicContact CD-CZ2 4.01Å; K1207-W1227 HydrophobicContact CD-CZ3 4.08Å; K1207-W1227 HydrophobicContact CG-CH2 4.37Å; K1207-W1227 HydrophobicContact CG-CZ3 4.33Å; T1221-W1227 WeakPolarHBondContact O-CA 3.42Å; L1222-W1227 HydrophobicContact CB-CD2 4.24Å; L1222-W1227 HydrophobicContact CB-CE3 3.95Å; L1222-W1227 HydrophobicContact CB-CH2 3.91Å; L1222-W1227 HydrophobicContact CB-CZ2 4.2Å; L1222-W1227 HydrophobicContact CB-CZ3 3.77Å; L1222-W1227 HydrophobicContact CD1-CD2 3.93Å; L1222-W1227 HydrophobicContact CD1-CE3 4.4Å; L1222-W1227 HydrophobicContact CD1-CG 4.13Å; L1222-W1227 HydrophobicContact CD1-CZ2 4.22Å; L1222-W1227 HydrophobicContact CD2-CZ2 4.37Å
1228	E	73.4	Confident	73	Confident	84.8 Å²	84.8	65.2 Å²	65.2	40%	0.396	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	124.2	171.2	-68.9	175.4	-156.6	0	0	109.5	S1220 T1221 I1223 V1226 R1549 W1569	S1220-E1228 CarbonylContact C-O 3.52Å; S1220-E1228 VanDerWaalsContact CA-O 3.24Å; S1220-E1228 WeakPolarHBondContact CA-O 3.4Å; S1220-E1228 VanDerWaalsContact CB-O 3.29Å; S1220-E1228 WeakPolarHBondContact CB-O 3.38Å; T1221-E1228 PolarHBondContact N-O 2.98Å; T1221-E1228 PolarHBondContact O-N 2.94Å; I1223-E1228 WeakPolarHBondContact CB-OE1 3.24Å; I1223-E1228 HydrophobicContact CD1-CB 4.48Å; I1223-E1228 WeakPolarHBondContact CD1-OE1 3.28Å; I1223-E1228 VanDerWaalsContact CD1-OE2 3.23Å; I1223-E1228 WeakPolarHBondContact CD1-OE2 3.23Å; I1223-E1228 WeakPolarHBondContact CG2-OE1 3.48Å; V1226-E1228 PolarHBondContact O-N 2.99Å; E1228-R1549 IonicContact OE2-CZ 2.75Å; E1228-R1549 IonicContact OE2-NH1 3.32Å; E1228-R1549 PolarHBondContact OE2-NH1 3.31Å; E1228-W1569 PolarHBondContact OE1-NE1 3.21Å; E1228-W1569 PolarHBondContact OE2-NE1 3.29Å; E1228-W1569 VanDerWaalsContact OE2-NE1 3.1Å
1229	Q	74.4	Confident	71.8	Confident	128 Å²	128	72.2 Å²	72.2	60%	0.598	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71	130.9	173.3	-178.8	170.4	-20.8	0	0	109.6	T1218 T1233	T1218-Q1229 VanDerWaalsContact CG2-CD 3.46Å; T1218-Q1229 HydrophobicContact CG2-CG 3.81Å; Q1229-T1233 PolarHBondContact NE2-OG1 2.96Å; Q1229-T1233 VanDerWaalsContact NE2-OG1 3.1Å
1230	Q	66.9	Low	70.6	Confident	39.6 Å²	39.6	72.7 Å²	72.7	19%	0.185	36%	0.357	C	S	.	.	P	Polyproline II helix	trans	-79.4	139.2	171.7	-65.6	-179.3	-23.9	0	0	108.8	P1219 T1221 D1232 T1233	P1219-Q1230 HydrophobicContact CB-CB 4.17Å; P1219-Q1230 HydrophobicContact CB-CG 4.41Å; P1219-Q1230 HydrophobicContact CG-CB 3.9Å; P1219-Q1230 PolarHBondContact O-N 2.9Å; T1221-Q1230 PolarHBondContact OG1-NE2 3.01Å; Q1230-D1232 PolarHBondContact O-N 3.03Å; Q1230-D1232 VanDerWaalsContact O-N 3.14Å; Q1230-T1233 PolarHBondContact O-OG1 3.43Å
1231	E	59.7	Low	69.1	Low	186 Å²	186	77.3 Å²	77.3	87%	0.869	38%	0.38	S	S	*	.	S	Bend	trans	-57.9	-25.9	-175.4	-61.4	177	155.3	0	0	113.2	T1233 K1535	E1231-T1233 PolarHBondContact O-N 3.1Å; E1231-K1535 WeakPolarHBondContact OE2-CD 3.49Å; E1231-K1535 IonicContact OE2-NZ 3.02Å
1232	D	68.2	Low	67.6	Low	78.8 Å²	78.8	82.1 Å²	82.1	42%	0.421	41%	0.406	S	S	.	.			trans	-70.8	45.5	-179.8	-72.9	-43.8	0	0	0	114.8	P1219 Q1230 F1234 P1268 Y1270 K1535	P1219-D1232 WeakPolarHBondContact CD-O 3.25Å; P1219-D1232 HydrophobicContact CG-CB 4.41Å; P1219-D1232 VanDerWaalsContact CG-O 3.32Å; P1219-D1232 WeakPolarHBondContact CG-O 3.03Å; Q1230-D1232 PolarHBondContact O-N 3.03Å; Q1230-D1232 VanDerWaalsContact O-N 3.14Å; D1232-F1234 PolarHBondContact O-N 2.95Å; D1232-P1268 HydrophobicContact CB-CG 3.93Å; D1232-Y1270 HydrophobicContact CB-CD1 4.37Å; D1232-Y1270 HydrophobicContact CB-CE1 3.84Å; D1232-Y1270 PolarHBondContact O-OH 2.9Å; D1232-Y1270 VanDerWaalsContact O-OH 3.13Å; D1232-K1535 IonicContact OD1-NZ 3.51Å; D1232-K1535 PolarHBondContact OD1-NZ 2.8Å; D1232-K1535 IonicContact OD2-NZ 3.38Å; D1232-K1535 PolarHBondContact OD2-NZ 2.8Å
1233	T	79.2	Confident	66.7	Low	53.4 Å²	53.4	86 Å²	86	33%	0.328	42%	0.422	S	S	.	.			trans	-74.7	126.4	171.1	-60.9	0	0	0	0	109.9	W1217 T1218 Q1229 Q1230 E1231	W1217-T1233 WeakPolarHBondContact O-CA 3.46Å; T1218-T1233 HydrophobicContact CG2-CG2 4.06Å; T1218-T1233 VanDerWaalsContact CG2-CG2 3.43Å; Q1229-T1233 PolarHBondContact NE2-OG1 2.96Å; Q1229-T1233 VanDerWaalsContact NE2-OG1 3.1Å; Q1230-T1233 PolarHBondContact O-OG1 3.43Å; E1231-T1233 PolarHBondContact O-N 3.1Å
1234	F	84.5	Confident	67.3	Low	29.4 Å²	29.4	89.6 Å²	89.6	13%	0.129	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	153.1	-173.8	74.2	-81.1	0	0	0	113.2	I1208 E1216 W1217 D1232 L1266 S1267 P1268 Y1270	I1208-F1234 HydrophobicContact CD1-CE1 4.32Å; E1216-F1234 CarbonylContact C-O 3.47Å; E1216-F1234 WeakPolarHBondContact CA-O 3.18Å; W1217-F1234 HydrophobicContact CB-CD1 3.8Å; W1217-F1234 HydrophobicContact CB-CD2 4.33Å; W1217-F1234 HydrophobicContact CB-CE1 3.28Å; W1217-F1234 HydrophobicContact CB-CE2 3.97Å; W1217-F1234 HydrophobicContact CB-CG 4.35Å; W1217-F1234 HydrophobicContact CB-CZ 3.38Å; W1217-F1234 VanDerWaalsContact CB-CZ 3.49Å; W1217-F1234 HydrophobicContact CD2-CE1 4.29Å; W1217-F1234 HydrophobicContact CD2-CE2 4.39Å; W1217-F1234 AromaticContact CD2-CZ 3.91Å; W1217-F1234 HydrophobicContact CD2-CZ 3.91Å; W1217-F1234 HydrophobicContact CE3-CE1 4.49Å; W1217-F1234 HydrophobicContact CE3-CZ 4.25Å; W1217-F1234 AromaticContact CG-CE1 3.88Å; W1217-F1234 HydrophobicContact CG-CE1 4Å; W1217-F1234 AromaticContact CG-CE2 3.88Å; W1217-F1234 HydrophobicContact CG-CE2 3.96Å; W1217-F1234 AromaticContact CG-CZ 3.54Å; W1217-F1234 HydrophobicContact CG-CZ 3.54Å; W1217-F1234 VanDerWaalsContact CG-CZ 3.48Å; W1217-F1234 PolarHBondContact N-O 2.93Å; W1217-F1234 PolarHBondContact O-N 3.2Å; W1217-F1234 VanDerWaalsContact O-N 3.13Å; D1232-F1234 PolarHBondContact O-N 2.95Å; F1234-L1266 HydrophobicContact CE2-CD1 3.9Å; F1234-L1266 HydrophobicContact CE2-CD2 4.28Å; F1234-L1266 HydrophobicContact CE2-CG 3.8Å; F1234-L1266 VanDerWaalsContact CE2-O 3.26Å; F1234-L1266 WeakPolarHBondContact CE2-O 3.35Å; F1234-L1266 HydrophobicContact CZ-CB 4.32Å; F1234-L1266 HydrophobicContact CZ-CD1 4.32Å; F1234-L1266 HydrophobicContact CZ-CD2 4.2Å; F1234-L1266 HydrophobicContact CZ-CG 3.81Å; F1234-S1267 VanDerWaalsContact CD2-O 3.24Å; F1234-S1267 WeakPolarHBondContact CD2-O 3.29Å; F1234-S1267 VanDerWaalsContact CE1-CB 3.48Å; F1234-S1267 WeakPolarHBondContact CE2-O 3.27Å; F1234-S1267 WeakPolarHBondContact CG-O 3.28Å; F1234-S1267 VanDerWaalsContact CZ-CB 3.46Å; F1234-P1268 HydrophobicContact CB-CG 4.29Å; F1234-P1268 VanDerWaalsContact CD1-CD 3.48Å; F1234-P1268 HydrophobicContact CD1-CG 4.39Å; F1234-P1268 HydrophobicContact CG-CG 4.39Å; F1234-Y1270 VanDerWaalsContact CD1-OH 3.3Å; F1234-Y1270 WeakPolarHBondContact CD1-OH 3.32Å; F1234-Y1270 HydrophobicContact CE1-CE2 4.35Å; F1234-Y1270 WeakPolarHBondContact CE1-OH 3.29Å
1235	K	81.5	Confident	68.4	Low	139.6 Å²	139.6	86.6 Å²	86.6	61%	0.607	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.4	125.1	172.9	-80.8	174.5	172.8	152.1	0	110.6	K1215 E1216	K1215-K1235 WeakPolarHBondContact O-CA 3.25Å; E1216-K1235 VanDerWaalsContact CD-CE 3.45Å; E1216-K1235 HydrophobicContact CG-CD 4.22Å; E1216-K1235 VanDerWaalsContact CG-CE 3.41Å; E1216-K1235 HydrophobicContact CG-CG 3.68Å; E1216-K1235 WeakPolarHBondContact OE1-CE 3.4Å; E1216-K1235 IonicContact OE1-NZ 3Å; E1216-K1235 PolarHBondContact OE1-NZ 3.02Å
1236	S	75.3	Confident	69.4	Low	8.4 Å²	8.4	82.8 Å²	82.8	6%	0.059	40%	0.397	C	S	.	.			trans	-82.1	129	178.2	-175.7	0	0	0	0	111.4	K1215 W1217 L1238 L1266	K1215-S1236 WeakPolarHBondContact CB-O 3.23Å; K1215-S1236 VanDerWaalsContact CD-O 3.29Å; K1215-S1236 WeakPolarHBondContact CD-O 3.15Å; K1215-S1236 PolarHBondContact O-N 2.92Å; W1217-S1236 VanDerWaalsContact NE1-CB 3.32Å; S1236-L1238 VanDerWaalsContact C-N 3.3Å; S1236-L1238 PolarHBondContact O-N 2.95Å; S1236-L1238 WeakPolarHBondContact OG-CB 3.43Å; S1236-L1238 PolarHBondContact OG-N 3.07Å; S1236-L1238 VanDerWaalsContact OG-N 3.08Å; S1236-L1238 PolarHBondContact OG-O 3.29Å; S1236-L1266 WeakPolarHBondContact OG-CD1 3.29Å; S1236-L1266 WeakPolarHBondContact OG-CD2 3.19Å
1237	T	67.1	Low	70.5	Confident	121.6 Å²	121.6	82.2 Å²	82.2	75%	0.746	39%	0.391	S	S	*	.			trans	-72.7	-15.2	169.3	55.7	0	0	0	0	112.4	R1239	T1237-R1239 PolarHBondContact O-N 2.97Å
1238	L	63.8	Low	71.1	Confident	28.4 Å²	28.4	78.2 Å²	78.2	15%	0.149	38%	0.377	C	S	.	.	S	Bend	trans	-80	116.6	-176.3	-56.7	177	0	0	0	110.6	S1236 L1240 L1261 K1264 L1266	S1236-L1238 VanDerWaalsContact C-N 3.3Å; S1236-L1238 PolarHBondContact O-N 2.95Å; S1236-L1238 WeakPolarHBondContact OG-CB 3.43Å; S1236-L1238 PolarHBondContact OG-N 3.07Å; S1236-L1238 VanDerWaalsContact OG-N 3.08Å; S1236-L1238 PolarHBondContact OG-O 3.29Å; L1238-L1240 PolarHBondContact O-N 2.95Å; L1238-L1240 VanDerWaalsContact O-N 3.1Å; L1238-L1261 HydrophobicContact CB-CD2 4.01Å; L1238-L1261 HydrophobicContact CD1-CB 3.96Å; L1238-L1261 HydrophobicContact CD1-CD2 3.95Å; L1238-L1261 HydrophobicContact CD1-CG 4.34Å; L1238-K1264 HydrophobicContact CD1-CB 3.89Å; L1238-K1264 HydrophobicContact CD1-CD 4.14Å; L1238-K1264 HydrophobicContact CD1-CG 4.47Å; L1238-K1264 HydrophobicContact CD2-CB 4.17Å; L1238-K1264 HydrophobicContact CD2-CD 3.59Å; L1238-K1264 VanDerWaalsContact CD2-CD 3.49Å; L1238-K1264 HydrophobicContact CD2-CG 4.35Å; L1238-K1264 HydrophobicContact CG-CB 4.47Å; L1238-K1264 HydrophobicContact CG-CD 4.26Å; L1238-L1266 HydrophobicContact CD1-CB 4.48Å; L1238-L1266 HydrophobicContact CD1-CD1 4.12Å; L1238-L1266 HydrophobicContact CD1-CD2 3.78Å; L1238-L1266 HydrophobicContact CD1-CG 4.46Å; L1238-L1266 HydrophobicContact CG-CD2 4.47Å
1239	R	61.5	Low	71.7	Confident	178.6 Å²	178.6	75.7 Å²	75.7	67%	0.674	37%	0.366	S	S	*	.			trans	-70.5	112.7	173.7	-62.3	-178.1	-175.9	-172.9	0.6	109.7	T1237 N1241 D1242	T1237-R1239 PolarHBondContact O-N 2.97Å; R1239-N1241 VanDerWaalsContact C-N 3.29Å; R1239-D1242 VanDerWaalsContact CB-OD2 3.31Å; R1239-D1242 WeakPolarHBondContact CB-OD2 3.33Å; R1239-D1242 WeakPolarHBondContact CD-OD2 3.28Å
1240	L	65.5	Low	72.4	Confident	10 Å²	10	69.7 Å²	69.7	5%	0.052	34%	0.338	C	S	.	.	S	Bend	trans	-81.1	-31.7	171	-77	157.1	0	0	0	111.5	L1187 F1194 V1210 L1212 W1217 L1238 D1242 K1243 F1246 L1261	L1187-L1240 HydrophobicContact CD1-CB 4.38Å; F1194-L1240 HydrophobicContact CE1-CD1 4.34Å; F1194-L1240 HydrophobicContact CE1-CD2 4.5Å; V1210-L1240 HydrophobicContact CG1-CD1 4.22Å; L1212-L1240 HydrophobicContact CD2-CB 3.84Å; L1212-L1240 HydrophobicContact CD2-CD1 3.49Å; L1212-L1240 VanDerWaalsContact CD2-CD1 3.46Å; L1212-L1240 HydrophobicContact CD2-CD2 4.38Å; L1212-L1240 HydrophobicContact CD2-CG 4.24Å; W1217-L1240 HydrophobicContact CZ2-CD1 4.01Å; W1217-L1240 HydrophobicContact CZ2-CD2 4.48Å; L1238-L1240 PolarHBondContact O-N 2.95Å; L1238-L1240 VanDerWaalsContact O-N 3.1Å; L1240-D1242 PolarHBondContact O-N 2.95Å; L1240-D1242 VanDerWaalsContact O-N 3.11Å; L1240-K1243 CarbonylContact O-C 3.48Å; L1240-K1243 PolarHBondContact O-N 2.97Å; L1240-K1243 VanDerWaalsContact O-O 3.07Å; L1240-F1246 HydrophobicContact CD2-CB 4.13Å; L1240-F1246 HydrophobicContact CD2-CD1 3.63Å; L1240-F1246 VanDerWaalsContact CD2-CD1 3.49Å; L1240-F1246 HydrophobicContact CD2-CD2 4.4Å; L1240-F1246 HydrophobicContact CD2-CE1 3.83Å; L1240-F1246 VanDerWaalsContact CD2-CE1 3.47Å; L1240-F1246 HydrophobicContact CD2-CE2 4.45Å; L1240-F1246 HydrophobicContact CD2-CG 3.97Å; L1240-F1246 HydrophobicContact CD2-CZ 4.22Å; L1240-L1261 HydrophobicContact CD1-CD2 4.31Å; L1240-L1261 HydrophobicContact CD2-CD1 3.98Å; L1240-L1261 HydrophobicContact CD2-CD2 3.71Å; L1240-L1261 HydrophobicContact CD2-CG 4.35Å; L1240-L1261 HydrophobicContact CG-CD2 4.04Å
1241	N	54.6	Low	73.4	Confident	108.2 Å²	108.2	71.7 Å²	71.7	58%	0.579	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-27.2	-169.8	-51.7	26.1	0	0	0	112.9	L1212 R1239 K1243	L1212-N1241 PolarHBondContact O-ND2 3.23Å; L1212-N1241 PolarHBondContact O-OD1 3.3Å; L1212-N1241 VanDerWaalsContact O-OD1 3.1Å; R1239-N1241 VanDerWaalsContact C-N 3.29Å; N1241-K1243 PolarHBondContact O-N 3.33Å; N1241-K1243 VanDerWaalsContact O-N 3.16Å
1242	D	53	Low	74.8	Confident	112.4 Å²	112.4	63.2 Å²	63.2	60%	0.601	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-15	179.7	-51.9	-18.4	0	0	0	112.6	R1239 L1240	R1239-D1242 VanDerWaalsContact CB-OD2 3.31Å; R1239-D1242 WeakPolarHBondContact CB-OD2 3.33Å; R1239-D1242 WeakPolarHBondContact CD-OD2 3.28Å; L1240-D1242 PolarHBondContact O-N 2.95Å; L1240-D1242 VanDerWaalsContact O-N 3.11Å
1243	K	59.1	Low	75.5	Confident	104.2 Å²	104.2	65.9 Å²	65.9	45%	0.453	32%	0.315	S	S	.	.			trans	-136.1	109.4	-175.8	-65.5	-174	-178	-163.4	0	112.1	L1240 N1241 T1245 D1461	L1240-K1243 CarbonylContact O-C 3.48Å; L1240-K1243 PolarHBondContact O-N 2.97Å; L1240-K1243 VanDerWaalsContact O-O 3.07Å; N1241-K1243 PolarHBondContact O-N 3.33Å; N1241-K1243 VanDerWaalsContact O-N 3.16Å; K1243-T1245 PolarHBondContact O-N 2.92Å; K1243-D1461 PolarHBondContact NZ-O 2.93Å; K1243-D1461 IonicContact NZ-OD1 3.42Å
1244	R	75.3	Confident	75.6	Confident	126.4 Å²	126.4	69 Å²	69	48%	0.477	33%	0.33	S	S	.	.	S	Bend	trans	-60.3	-15.6	171.9	-73.3	-168.7	-178	-176.9	2.2	114.4	Q1186 L1187 P1189	Q1186-R1244 CarbonylContact C-O 3.31Å; Q1186-R1244 VanDerWaalsContact CA-O 3.31Å; Q1186-R1244 WeakPolarHBondContact CA-O 3.37Å; Q1186-R1244 VanDerWaalsContact CB-O 3.27Å; Q1186-R1244 WeakPolarHBondContact CB-O 3.28Å; Q1186-R1244 WeakPolarHBondContact CG-O 3.46Å; L1187-R1244 PolarHBondContact N-O 3.12Å; P1189-R1244 VanDerWaalsContact CA-CZ 3.46Å; P1189-R1244 VanDerWaalsContact CA-NH2 3.28Å; P1189-R1244 VanDerWaalsContact CG-NH2 3.31Å
1245	T	79.3	Confident	75.7	Confident	40.8 Å²	40.8	72 Å²	72	25%	0.25	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	132	176.2	-48.4	0	0	0	0	110.5	T1184 V1185 Q1186 K1243 R1413 S1462	T1184-T1245 HydrophobicContact CG2-CG2 3.96Å; V1185-T1245 CarbonylContact O-C 3.55Å; V1185-T1245 VanDerWaalsContact O-CA 3.29Å; V1185-T1245 WeakPolarHBondContact O-CA 3.26Å; V1185-T1245 WeakPolarHBondContact O-CG2 3.42Å; Q1186-T1245 HydrophobicContact CB-CG2 4.46Å; Q1186-T1245 HydrophobicContact CG-CG2 3.74Å; Q1186-T1245 WeakPolarHBondContact CG-OG1 3.46Å; Q1186-T1245 PolarHBondContact NE2-OG1 2.72Å; K1243-T1245 PolarHBondContact O-N 2.92Å; T1245-R1413 PolarHBondContact OG1-NH1 3.21Å; T1245-S1462 WeakPolarHBondContact O-CB 3.48Å
1246	F	81.2	Confident	75.9	Confident	1.6 Å²	1.6	69.8 Å²	69.8	1%	0.007	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	157.8	175.6	64.2	-98.7	0	0	0	112.7	T1184 V1185 L1187 F1194 L1240 L1248 L1261 N1262	T1184-F1246 WeakPolarHBondContact CA-O 3.37Å; V1185-F1246 HydrophobicContact CB-CD1 4.42Å; V1185-F1246 HydrophobicContact CB-CD2 4.08Å; V1185-F1246 HydrophobicContact CB-CE1 4.05Å; V1185-F1246 HydrophobicContact CB-CE2 3.58Å; V1185-F1246 VanDerWaalsContact CB-CE2 3.47Å; V1185-F1246 HydrophobicContact CB-CG 4.45Å; V1185-F1246 HydrophobicContact CB-CZ 3.55Å; V1185-F1246 VanDerWaalsContact CB-CZ 3.5Å; V1185-F1246 HydrophobicContact CG1-CE1 4.03Å; V1185-F1246 HydrophobicContact CG1-CE2 4.15Å; V1185-F1246 HydrophobicContact CG1-CZ 3.62Å; V1185-F1246 HydrophobicContact CG2-CD2 4.35Å; V1185-F1246 HydrophobicContact CG2-CE2 3.78Å; V1185-F1246 HydrophobicContact CG2-CZ 4.09Å; V1185-F1246 PolarHBondContact N-O 3.07Å; V1185-F1246 PolarHBondContact O-N 3.08Å; V1185-F1246 VanDerWaalsContact O-O 3.09Å; L1187-F1246 HydrophobicContact CD1-CD1 4.18Å; L1187-F1246 HydrophobicContact CD1-CE1 3.89Å; L1187-F1246 HydrophobicContact CD2-CE1 3.99Å; L1187-F1246 HydrophobicContact CG-CD1 4.14Å; L1187-F1246 HydrophobicContact CG-CE1 3.74Å; L1187-F1246 VanDerWaalsContact CG-CE1 3.47Å; F1194-F1246 HydrophobicContact CD1-CZ 4.32Å; F1194-F1246 HydrophobicContact CD2-CZ 4.46Å; F1194-F1246 AromaticContact CE1-CE1 3.91Å; F1194-F1246 HydrophobicContact CE1-CE1 4.15Å; F1194-F1246 AromaticContact CE1-CZ 3.7Å; F1194-F1246 HydrophobicContact CE1-CZ 3.7Å; F1194-F1246 HydrophobicContact CE2-CE2 4.39Å; F1194-F1246 AromaticContact CE2-CZ 3.86Å; F1194-F1246 HydrophobicContact CE2-CZ 3.9Å; F1194-F1246 HydrophobicContact CZ-CE1 4.29Å; F1194-F1246 AromaticContact CZ-CE2 3.92Å; F1194-F1246 HydrophobicContact CZ-CE2 4.04Å; F1194-F1246 AromaticContact CZ-CZ 3.4Å; F1194-F1246 HydrophobicContact CZ-CZ 3.4Å; F1194-F1246 VanDerWaalsContact CZ-CZ 3.47Å; L1240-F1246 HydrophobicContact CD2-CB 4.13Å; L1240-F1246 HydrophobicContact CD2-CD1 3.63Å; L1240-F1246 VanDerWaalsContact CD2-CD1 3.49Å; L1240-F1246 HydrophobicContact CD2-CD2 4.4Å; L1240-F1246 HydrophobicContact CD2-CE1 3.83Å; L1240-F1246 VanDerWaalsContact CD2-CE1 3.47Å; L1240-F1246 HydrophobicContact CD2-CE2 4.45Å; L1240-F1246 HydrophobicContact CD2-CG 3.97Å; L1240-F1246 HydrophobicContact CD2-CZ 4.22Å; F1246-L1248 HydrophobicContact CD2-CB 4.35Å; F1246-L1248 HydrophobicContact CE2-CB 4.16Å; F1246-L1261 HydrophobicContact CB-CD1 4Å; F1246-L1261 HydrophobicContact CD1-CD1 4.33Å; F1246-L1261 HydrophobicContact CD2-CD1 3.33Å; F1246-L1261 HydrophobicContact CE2-CD1 3.92Å; F1246-L1261 HydrophobicContact CG-CD1 3.81Å; F1246-N1262 VanDerWaalsContact CA-OD1 3.3Å; F1246-N1262 WeakPolarHBondContact CA-OD1 3.4Å; F1246-N1262 WeakPolarHBondContact CB-ND2 3.38Å; F1246-N1262 WeakPolarHBondContact CB-OD1 3.42Å
1247	N	81.9	Confident	76.5	Confident	56.2 Å²	56.2	69.4 Å²	69.4	30%	0.301	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	122.5	173.3	-64.2	-54.5	0	0	0	109.5	A1183 T1184 L1261 N1262 R1337 F1341 Y1463 S1464	A1183-N1247 CarbonylContact O-C 3.52Å; A1183-N1247 WeakPolarHBondContact O-CA 3.24Å; T1184-N1247 WeakPolarHBondContact CB-OD1 3.33Å; T1184-N1247 WeakPolarHBondContact CG2-OD1 3.23Å; T1184-N1247 PolarHBondContact OG1-OD1 3.21Å; N1247-L1261 WeakPolarHBondContact O-CA 3.07Å; N1247-N1262 PolarHBondContact N-OD1 2.87Å; N1247-N1262 PolarHBondContact ND2-OD1 3.25Å; N1247-N1262 PolarHBondContact O-N 2.94Å; N1247-R1337 PolarHBondContact ND2-NE 3.32Å; N1247-R1337 PolarHBondContact OD1-NH2 3.13Å; N1247-F1341 HydrophobicContact CB-CE1 4.38Å; N1247-Y1463 PolarHBondContact ND2-O 2.8Å; N1247-S1464 WeakPolarHBondContact OD1-CB 3.23Å
1248	L	86.7	Confident	77.7	Confident	5.2 Å²	5.2	64.5 Å²	64.5	3%	0.027	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	125.8	171.6	-177.5	69.2	0	0	0	108.8	A1183 M1196 W1217 F1246 L1259 W1260 L1261 L1266	A1183-L1248 HydrophobicContact CB-CB 4.35Å; A1183-L1248 PolarHBondContact N-O 3.08Å; A1183-L1248 PolarHBondContact O-N 3.17Å; M1196-L1248 HydrophobicContact CE-CD2 3.99Å; M1196-L1248 HydrophobicContact SD-CD2 3.91Å; M1196-L1248 VanDerWaalsContact SD-CD2 3.57Å; W1217-L1248 HydrophobicContact CH2-CD1 4.24Å; W1217-L1248 HydrophobicContact CZ3-CD1 4.33Å; F1246-L1248 HydrophobicContact CD2-CB 4.35Å; F1246-L1248 HydrophobicContact CE2-CB 4.16Å; L1248-L1259 HydrophobicContact CD1-CB 4.32Å; L1248-L1259 HydrophobicContact CD1-CD2 4.45Å; L1248-L1259 HydrophobicContact CG-CD2 4.42Å; L1248-W1260 CarbonylContact C-O 3.59Å; L1248-W1260 WeakPolarHBondContact CA-O 3.22Å; L1248-L1261 HydrophobicContact CD1-CD1 4.14Å; L1248-L1266 HydrophobicContact CD1-CD1 4.36Å; L1248-L1266 HydrophobicContact CD1-CD2 4.32Å
1249	L	87.1	Confident	78.9	Confident	33.4 Å²	33.4	63.1 Å²	63.1	18%	0.175	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	127.9	179.6	-171.3	71.5	0	0	0	109.1	H1180 I1181 R1182 K1251 L1259 W1260 F1341	H1180-L1249 WeakPolarHBondContact CE1-CD1 3.47Å; H1180-L1249 WeakPolarHBondContact NE2-CD1 3.46Å; I1181-L1249 CarbonylContact O-C 3.54Å; I1181-L1249 WeakPolarHBondContact O-CA 3.49Å; R1182-L1249 HydrophobicContact CB-CD1 4.14Å; R1182-L1249 HydrophobicContact CG-CD1 4.11Å; L1249-K1251 HydrophobicContact CD1-CG 4.48Å; L1249-K1251 HydrophobicContact CD2-CD 4.45Å; L1249-K1251 HydrophobicContact CD2-CG 4.18Å; L1249-K1251 HydrophobicContact CG-CG 4.18Å; L1249-L1259 CarbonylContact O-C 3.55Å; L1249-L1259 VanDerWaalsContact O-CA 3.28Å; L1249-L1259 WeakPolarHBondContact O-CA 3.13Å; L1249-W1260 HydrophobicContact CB-CB 4.23Å; L1249-W1260 HydrophobicContact CB-CE3 4.39Å; L1249-W1260 HydrophobicContact CD2-CE3 4.29Å; L1249-W1260 PolarHBondContact N-O 3.1Å; L1249-W1260 PolarHBondContact O-N 2.88Å; L1249-F1341 HydrophobicContact CB-CE1 3.77Å; L1249-F1341 HydrophobicContact CB-CZ 3.72Å; L1249-F1341 HydrophobicContact CD1-CD1 3.96Å; L1249-F1341 HydrophobicContact CD1-CE1 3.5Å; L1249-F1341 HydrophobicContact CD1-CZ 4.15Å; L1249-F1341 HydrophobicContact CD2-CE1 4.01Å; L1249-F1341 HydrophobicContact CD2-CE2 4.23Å; L1249-F1341 HydrophobicContact CD2-CZ 3.79Å; L1249-F1341 HydrophobicContact CG-CE1 3.96Å; L1249-F1341 HydrophobicContact CG-CZ 4.1Å
1250	A	89.7	Confident	80.1	Confident	2 Å²	2	56.6 Å²	56.6	2%	0.017	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	126.2	167.5	0	0	0	0	0	109.4	H1180 I1181 M1257 Q1258 L1259	H1180-A1250 CarbonylContact C-O 3.51Å; H1180-A1250 WeakPolarHBondContact CA-O 3.33Å; H1180-A1250 VanDerWaalsContact CB-O 3.28Å; H1180-A1250 WeakPolarHBondContact CB-O 3.45Å; H1180-A1250 PolarHBondContact ND1-O 3.04Å; H1180-A1250 VanDerWaalsContact ND1-O 3.13Å; I1181-A1250 HydrophobicContact CB-CB 4.01Å; I1181-A1250 HydrophobicContact CD1-CB 4.22Å; I1181-A1250 HydrophobicContact CG1-CB 4.34Å; I1181-A1250 PolarHBondContact N-O 3Å; I1181-A1250 PolarHBondContact O-N 3.09Å; A1250-M1257 HydrophobicContact CB-CG 4.02Å; A1250-M1257 HydrophobicContact CB-SD 3.86Å; A1250-Q1258 CarbonylContact C-O 3.53Å; A1250-Q1258 VanDerWaalsContact CA-O 3.29Å; A1250-Q1258 WeakPolarHBondContact CA-O 3.38Å; A1250-L1259 HydrophobicContact CB-CD2 3.71Å
1251	K	88	Confident	81.1	Confident	81 Å²	81	56.2 Å²	56.2	35%	0.352	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	132.4	165.8	-57.5	179.8	-172.2	173.7	0	108	L1249 M1257 Q1258 W1260 S1326 E1340	L1249-K1251 HydrophobicContact CD1-CG 4.48Å; L1249-K1251 HydrophobicContact CD2-CD 4.45Å; L1249-K1251 HydrophobicContact CD2-CG 4.18Å; L1249-K1251 HydrophobicContact CG-CG 4.18Å; K1251-M1257 WeakPolarHBondContact O-CA 3.23Å; K1251-Q1258 PolarHBondContact N-O 2.95Å; K1251-Q1258 VanDerWaalsContact N-O 3.1Å; K1251-Q1258 PolarHBondContact O-N 2.92Å; K1251-W1260 HydrophobicContact CB-CE3 4.28Å; K1251-W1260 HydrophobicContact CB-CH2 3.87Å; K1251-W1260 HydrophobicContact CB-CZ3 3.51Å; K1251-W1260 VanDerWaalsContact CB-CZ3 3.43Å; K1251-W1260 HydrophobicContact CD-CD2 4.18Å; K1251-W1260 HydrophobicContact CD-CE3 4.05Å; K1251-W1260 HydrophobicContact CD-CH2 3.61Å; K1251-W1260 HydrophobicContact CD-CZ2 4.27Å; K1251-W1260 HydrophobicContact CD-CZ3 3.73Å; K1251-W1260 HydrophobicContact CG-CE3 4.06Å; K1251-W1260 HydrophobicContact CG-CH2 3.87Å; K1251-W1260 HydrophobicContact CG-CZ3 3.46Å; K1251-W1260 VanDerWaalsContact CG-CZ3 3.45Å; K1251-W1260 VanDerWaalsContact NZ-CE2 3.34Å; K1251-S1326 PolarHBondContact NZ-OG 3.5Å; K1251-E1340 WeakPolarHBondContact CE-OE2 3.27Å; K1251-E1340 IonicContact NZ-OE1 2.61Å; K1251-E1340 PolarHBondContact NZ-OE1 2.93Å; K1251-E1340 IonicContact NZ-OE2 2.87Å; K1251-E1340 PolarHBondContact NZ-OE2 3.28Å
1252	V	87.3	Confident	82.3	Confident	6.6 Å²	6.6	53.7 Å²	53.7	4%	0.04	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	122	-176.2	-175	0	0	0	0	108.9	L1178 H1179 K1256 M1257 L1272	L1178-V1252 HydrophobicContact CD2-CG2 3.95Å; L1178-V1252 HydrophobicContact CG-CB 4.41Å; L1178-V1252 HydrophobicContact CG-CG2 4.15Å; L1178-V1252 VanDerWaalsContact O-CB 3.3Å; L1178-V1252 WeakPolarHBondContact O-CB 3.17Å; L1178-V1252 VanDerWaalsContact O-CG1 3.25Å; L1178-V1252 WeakPolarHBondContact O-CG1 3.35Å; H1179-V1252 WeakPolarHBondContact CA-O 3.34Å; H1179-V1252 PolarHBondContact CD2-O 3.05Å; H1179-V1252 PolarHBondContact ND1-O 3.08Å; H1179-V1252 VanDerWaalsContact ND1-O 3.08Å; H1179-V1252 CarbonylContact O-C 3.59Å; H1179-V1252 WeakPolarHBondContact O-CA 3.25Å; H1179-V1252 WeakPolarHBondContact O-CB 3.03Å; H1179-V1252 PolarHBondContact O-N 2.88Å; H1179-V1252 VanDerWaalsContact O-O 3.09Å; V1252-K1256 CarbonylContact C-O 3.48Å; V1252-K1256 WeakPolarHBondContact CA-O 3.37Å; V1252-M1257 HydrophobicContact CG2-CB 4.08Å; V1252-M1257 HydrophobicContact CG2-CG 3.97Å; V1252-M1257 HydrophobicContact CG2-SD 4.35Å; V1252-L1272 HydrophobicContact CB-CD1 4.49Å; V1252-L1272 HydrophobicContact CG1-CD1 3.91Å; V1252-L1272 HydrophobicContact CG2-CD1 3.96Å
1253	K	83.5	Confident	83.3	Confident	136.2 Å²	136.2	49.8 Å²	49.8	59%	0.592	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-132.7	116.2	175.9	-176.7	-177.8	177.8	-172.5	0	107.9	R1255 K1256	K1253-R1255 VanDerWaalsContact C-N 3.26Å; K1253-R1255 PolarHBondContact O-N 2.78Å; K1253-K1256 PolarHBondContact N-O 3Å; K1253-K1256 WeakPolarHBondContact O-CA 3.31Å; K1253-K1256 VanDerWaalsContact O-CB 3.31Å; K1253-K1256 WeakPolarHBondContact O-CB 3.22Å; K1253-K1256 PolarHBondContact O-N 2.9Å; K1253-K1256 VanDerWaalsContact O-N 3.15Å
1254	N	82.3	Confident	84.1	Confident	119.2 Å²	119.2	48.8 Å²	48.8	64%	0.637	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.1	53.6	178.6	-53	9.4	0	0	0	111.6	K1256 Q1755 I1757	N1254-K1256 PolarHBondContact O-N 2.94Å; N1254-Q1755 PolarHBondContact ND2-OE1 3.36Å; N1254-I1757 HydrophobicContact CB-CB 3.59Å; N1254-I1757 HydrophobicContact CB-CD1 3.35Å; N1254-I1757 HydrophobicContact CB-CG1 3.24Å; N1254-I1757 HydrophobicContact CB-CG2 3.68Å; N1254-I1757 WeakPolarHBondContact ND2-CD1 3.25Å; N1254-I1757 WeakPolarHBondContact O-CG2 3.35Å
1255	R	85.1	Confident	84.5	Confident	92.2 Å²	92.2	47.4 Å²	47.4	35%	0.348	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	-11.8	-172.4	-59.5	-174.2	-58.9	169.4	-5.6	116.9	K1253 M1257 T1271 L1272 P1273 G1274 E1275 N1760	K1253-R1255 VanDerWaalsContact C-N 3.26Å; K1253-R1255 PolarHBondContact O-N 2.78Å; R1255-M1257 PolarHBondContact O-N 2.88Å; R1255-T1271 HydrophobicContact CB-CG2 4.48Å; R1255-L1272 HydrophobicContact CB-CB 4.45Å; R1255-L1272 PolarHBondContact NE-O 3.18Å; R1255-L1272 VanDerWaalsContact NE-O 3.07Å; R1255-L1272 PolarHBondContact NH2-O 3.19Å; R1255-L1272 WeakPolarHBondContact O-CB 3.35Å; R1255-L1272 PolarHBondContact O-N 3.17Å; R1255-P1273 PolarHBondContact NH1-O 3.09Å; R1255-P1273 VanDerWaalsContact NH1-O 3.13Å; R1255-P1273 VanDerWaalsContact NH2-C 3.34Å; R1255-P1273 PolarHBondContact NH2-O 3.01Å; R1255-P1273 VanDerWaalsContact NH2-O 3.13Å; R1255-G1274 VanDerWaalsContact CD-O 3.28Å; R1255-G1274 WeakPolarHBondContact CD-O 3.29Å; R1255-G1274 VanDerWaalsContact CG-O 3.29Å; R1255-G1274 WeakPolarHBondContact CG-O 3.15Å; R1255-G1274 PolarHBondContact NE-O 3.26Å; R1255-E1275 HydrophobicContact CG-CG 4.15Å; R1255-N1760 PolarHBondContact NH2-ND2 3.23Å
1256	K	85.9	Confident	84.7	Confident	93.2 Å²	93.2	46.1 Å²	46.1	41%	0.405	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	120.1	171.2	-63.5	-66.4	-173.7	176.8	0	109.7	V1252 K1253 N1254 I1269 Y1270 T1271	V1252-K1256 CarbonylContact C-O 3.48Å; V1252-K1256 WeakPolarHBondContact CA-O 3.37Å; K1253-K1256 PolarHBondContact N-O 3Å; K1253-K1256 WeakPolarHBondContact O-CA 3.31Å; K1253-K1256 VanDerWaalsContact O-CB 3.31Å; K1253-K1256 WeakPolarHBondContact O-CB 3.22Å; K1253-K1256 PolarHBondContact O-N 2.9Å; K1253-K1256 VanDerWaalsContact O-N 3.15Å; N1254-K1256 PolarHBondContact O-N 2.94Å; K1256-I1269 HydrophobicContact CB-CG2 3.79Å; K1256-I1269 HydrophobicContact CD-CG2 4.13Å; K1256-I1269 HydrophobicContact CG-CG2 4.39Å; K1256-Y1270 CarbonylContact C-O 3.56Å; K1256-Y1270 VanDerWaalsContact CA-O 3.29Å; K1256-Y1270 WeakPolarHBondContact CA-O 3.36Å; K1256-T1271 HydrophobicContact CD-CG2 4.41Å; K1256-T1271 WeakPolarHBondContact CD-OG1 3.29Å; K1256-T1271 PolarHBondContact NZ-OG1 2.85Å
1257	M	89.5	Confident	84.4	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	128.5	-178.7	179.4	172.7	68.3	0	0	110.5	I1198 W1206 A1250 K1251 V1252 R1255 L1259 I1269 Y1270 L1272	I1198-M1257 HydrophobicContact CD1-CE 4.26Å; I1198-M1257 HydrophobicContact CD1-SD 3.94Å; W1206-M1257 HydrophobicContact CD2-CE 3.91Å; W1206-M1257 HydrophobicContact CE3-CE 3.66Å; W1206-M1257 HydrophobicContact CH2-CE 3.34Å; W1206-M1257 VanDerWaalsContact CH2-CE 3.42Å; W1206-M1257 HydrophobicContact CZ2-CE 3.64Å; W1206-M1257 VanDerWaalsContact CZ2-CE 3.47Å; W1206-M1257 HydrophobicContact CZ3-CE 3.38Å; W1206-M1257 VanDerWaalsContact CZ3-CE 3.48Å; A1250-M1257 HydrophobicContact CB-CG 4.02Å; A1250-M1257 HydrophobicContact CB-SD 3.86Å; K1251-M1257 WeakPolarHBondContact O-CA 3.23Å; V1252-M1257 HydrophobicContact CG2-CB 4.08Å; V1252-M1257 HydrophobicContact CG2-CG 3.97Å; V1252-M1257 HydrophobicContact CG2-SD 4.35Å; R1255-M1257 PolarHBondContact O-N 2.88Å; M1257-L1259 HydrophobicContact CE-CD1 4.25Å; M1257-L1259 HydrophobicContact CE-CD2 4.26Å; M1257-L1259 HydrophobicContact CE-CG 4.2Å; M1257-L1259 HydrophobicContact CG-CD2 4.34Å; M1257-L1259 HydrophobicContact CG-CG 4.46Å; M1257-L1259 HydrophobicContact SD-CD2 4.22Å; M1257-I1269 CarbonylContact O-C 3.53Å; M1257-I1269 WeakPolarHBondContact O-CA 3.34Å; M1257-Y1270 HydrophobicContact CE-CD2 4.39Å; M1257-Y1270 PolarHBondContact N-O 2.93Å; M1257-Y1270 PolarHBondContact O-N 3.21Å; M1257-L1272 HydrophobicContact CB-CD1 4.14Å; M1257-L1272 HydrophobicContact CB-CD2 4.4Å; M1257-L1272 HydrophobicContact CB-CG 4Å; M1257-L1272 HydrophobicContact CE-CD2 3.7Å; M1257-L1272 HydrophobicContact CE-CG 4.23Å; M1257-L1272 HydrophobicContact SD-CD1 4.14Å; M1257-L1272 HydrophobicContact SD-CD2 4.01Å; M1257-L1272 HydrophobicContact SD-CG 4.28Å
1258	Q	90.6	Very high	84.4	Confident	17.8 Å²	17.8	46.8 Å²	46.8	8%	0.083	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	138.1	171.8	175.9	76.2	73.4	0	0	109.1	A1250 K1251 W1260 K1265 L1266 S1267 P1268 I1269	A1250-Q1258 CarbonylContact C-O 3.53Å; A1250-Q1258 VanDerWaalsContact CA-O 3.29Å; A1250-Q1258 WeakPolarHBondContact CA-O 3.38Å; K1251-Q1258 PolarHBondContact N-O 2.95Å; K1251-Q1258 VanDerWaalsContact N-O 3.1Å; K1251-Q1258 PolarHBondContact O-N 2.92Å; Q1258-W1260 VanDerWaalsContact C-CZ3 3.45Å; Q1258-W1260 HydrophobicContact CB-CE3 4.39Å; Q1258-W1260 HydrophobicContact CB-CH2 3.58Å; Q1258-W1260 HydrophobicContact CB-CZ2 4.4Å; Q1258-W1260 HydrophobicContact CB-CZ3 3.58Å; Q1258-W1260 VanDerWaalsContact CB-CZ3 3.45Å; Q1258-W1260 HydrophobicContact CG-CD2 4.26Å; Q1258-W1260 HydrophobicContact CG-CE3 4.01Å; Q1258-W1260 HydrophobicContact CG-CH2 3.28Å; Q1258-W1260 HydrophobicContact CG-CZ2 3.65Å; Q1258-W1260 VanDerWaalsContact CG-CZ2 3.43Å; Q1258-W1260 HydrophobicContact CG-CZ3 3.47Å; Q1258-W1260 VanDerWaalsContact CG-CZ3 3.44Å; Q1258-W1260 VanDerWaalsContact O-CE3 3.27Å; Q1258-W1260 WeakPolarHBondContact O-CZ3 3.44Å; Q1258-K1265 HydrophobicContact CG-CG 4.39Å; Q1258-K1265 VanDerWaalsContact NE2-CG 3.28Å; Q1258-L1266 PolarHBondContact NE2-O 2.8Å; Q1258-S1267 PolarHBondContact NE2-O 2.89Å; Q1258-S1267 PolarHBondContact NE2-OG 2.82Å; Q1258-S1267 PolarHBondContact OE1-O 2.83Å; Q1258-P1268 PolarHBondContact NE2-O 2.83Å; Q1258-P1268 PolarHBondContact OE1-O 2.88Å; Q1258-I1269 HydrophobicContact CB-CG1 4.45Å; Q1258-I1269 VanDerWaalsContact OE1-CG1 3.28Å
1259	L	89.7	Confident	84.2	Confident	0.2 Å²	0.2	50.6 Å²	50.6	0%	0.001	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	145.8	176.6	-59.5	177.7	0	0	0	112	M1196 W1206 I1208 W1217 L1248 L1249 A1250 M1257 L1266 S1267 Y1270	M1196-L1259 HydrophobicContact CE-CD2 4.48Å; W1206-L1259 HydrophobicContact CH2-CD1 4.33Å; I1208-L1259 HydrophobicContact CD1-CD1 3.96Å; W1217-L1259 HydrophobicContact CE3-CD1 4.44Å; W1217-L1259 HydrophobicContact CZ3-CD1 4.38Å; L1248-L1259 HydrophobicContact CD1-CB 4.32Å; L1248-L1259 HydrophobicContact CD1-CD2 4.45Å; L1248-L1259 HydrophobicContact CG-CD2 4.42Å; L1249-L1259 CarbonylContact O-C 3.55Å; L1249-L1259 VanDerWaalsContact O-CA 3.28Å; L1249-L1259 WeakPolarHBondContact O-CA 3.13Å; A1250-L1259 HydrophobicContact CB-CD2 3.71Å; M1257-L1259 HydrophobicContact CE-CD1 4.25Å; M1257-L1259 HydrophobicContact CE-CD2 4.26Å; M1257-L1259 HydrophobicContact CE-CG 4.2Å; M1257-L1259 HydrophobicContact CG-CD2 4.34Å; M1257-L1259 HydrophobicContact CG-CG 4.46Å; M1257-L1259 HydrophobicContact SD-CD2 4.22Å; L1259-L1266 HydrophobicContact CB-CB 4.26Å; L1259-L1266 HydrophobicContact CB-CD1 4.06Å; L1259-L1266 HydrophobicContact CB-CD2 4.06Å; L1259-L1266 HydrophobicContact CD1-CD2 4.4Å; L1259-L1266 WeakPolarHBondContact O-CB 3.37Å; L1259-L1266 PolarHBondContact O-N 3.01Å; L1259-S1267 WeakPolarHBondContact CB-OG 3.28Å; L1259-S1267 PolarHBondContact N-OG 2.98Å; L1259-S1267 PolarHBondContact O-N 3.48Å; L1259-Y1270 HydrophobicContact CD1-CD2 4.26Å; L1259-Y1270 HydrophobicContact CD1-CE2 4.25Å
1260	W	87.9	Confident	84	Confident	41 Å²	41	49.1 Å²	49.1	16%	0.155	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	136.9	168	-65.9	-106.3	0	0	0	109.8	L1248 L1249 K1251 Q1258 G1263 K1264 K1265	L1248-W1260 CarbonylContact C-O 3.59Å; L1248-W1260 WeakPolarHBondContact CA-O 3.22Å; L1249-W1260 HydrophobicContact CB-CB 4.23Å; L1249-W1260 HydrophobicContact CB-CE3 4.39Å; L1249-W1260 HydrophobicContact CD2-CE3 4.29Å; L1249-W1260 PolarHBondContact N-O 3.1Å; L1249-W1260 PolarHBondContact O-N 2.88Å; K1251-W1260 HydrophobicContact CB-CE3 4.28Å; K1251-W1260 HydrophobicContact CB-CH2 3.87Å; K1251-W1260 HydrophobicContact CB-CZ3 3.51Å; K1251-W1260 VanDerWaalsContact CB-CZ3 3.43Å; K1251-W1260 HydrophobicContact CD-CD2 4.18Å; K1251-W1260 HydrophobicContact CD-CE3 4.05Å; K1251-W1260 HydrophobicContact CD-CH2 3.61Å; K1251-W1260 HydrophobicContact CD-CZ2 4.27Å; K1251-W1260 HydrophobicContact CD-CZ3 3.73Å; K1251-W1260 HydrophobicContact CG-CE3 4.06Å; K1251-W1260 HydrophobicContact CG-CH2 3.87Å; K1251-W1260 HydrophobicContact CG-CZ3 3.46Å; K1251-W1260 VanDerWaalsContact CG-CZ3 3.45Å; K1251-W1260 VanDerWaalsContact NZ-CE2 3.34Å; Q1258-W1260 VanDerWaalsContact C-CZ3 3.45Å; Q1258-W1260 HydrophobicContact CB-CE3 4.39Å; Q1258-W1260 HydrophobicContact CB-CH2 3.58Å; Q1258-W1260 HydrophobicContact CB-CZ2 4.4Å; Q1258-W1260 HydrophobicContact CB-CZ3 3.58Å; Q1258-W1260 VanDerWaalsContact CB-CZ3 3.45Å; Q1258-W1260 HydrophobicContact CG-CD2 4.26Å; Q1258-W1260 HydrophobicContact CG-CE3 4.01Å; Q1258-W1260 HydrophobicContact CG-CH2 3.28Å; Q1258-W1260 HydrophobicContact CG-CZ2 3.65Å; Q1258-W1260 VanDerWaalsContact CG-CZ2 3.43Å; Q1258-W1260 HydrophobicContact CG-CZ3 3.47Å; Q1258-W1260 VanDerWaalsContact CG-CZ3 3.44Å; Q1258-W1260 VanDerWaalsContact O-CE3 3.27Å; Q1258-W1260 WeakPolarHBondContact O-CZ3 3.44Å; W1260-G1263 VanDerWaalsContact CD1-O 3.25Å; W1260-K1264 CarbonylContact C-O 3.56Å; W1260-K1264 VanDerWaalsContact CA-O 3.26Å; W1260-K1264 WeakPolarHBondContact CA-O 3.34Å; W1260-K1264 WeakPolarHBondContact CB-O 3.32Å; W1260-K1265 VanDerWaalsContact CD1-CA 3.45Å; W1260-K1265 VanDerWaalsContact CD1-N 3.31Å; W1260-K1265 HydrophobicContact CG-CB 4.5Å
1261	L	85.2	Confident	83.8	Confident	3 Å²	3	51.7 Å²	51.7	2%	0.016	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	120.3	176.9	178.6	68.6	0	0	0	109.3	W1217 L1238 L1240 F1246 N1247 L1248 G1263 K1264 L1266	W1217-L1261 HydrophobicContact CH2-CD1 4.36Å; W1217-L1261 HydrophobicContact CH2-CD2 4.29Å; W1217-L1261 HydrophobicContact CZ2-CD2 4.16Å; L1238-L1261 HydrophobicContact CB-CD2 4.01Å; L1238-L1261 HydrophobicContact CD1-CB 3.96Å; L1238-L1261 HydrophobicContact CD1-CD2 3.95Å; L1238-L1261 HydrophobicContact CD1-CG 4.34Å; L1240-L1261 HydrophobicContact CD1-CD2 4.31Å; L1240-L1261 HydrophobicContact CD2-CD1 3.98Å; L1240-L1261 HydrophobicContact CD2-CD2 3.71Å; L1240-L1261 HydrophobicContact CD2-CG 4.35Å; L1240-L1261 HydrophobicContact CG-CD2 4.04Å; F1246-L1261 HydrophobicContact CB-CD1 4Å; F1246-L1261 HydrophobicContact CD1-CD1 4.33Å; F1246-L1261 HydrophobicContact CD2-CD1 3.33Å; F1246-L1261 HydrophobicContact CE2-CD1 3.92Å; F1246-L1261 HydrophobicContact CG-CD1 3.81Å; N1247-L1261 WeakPolarHBondContact O-CA 3.07Å; L1248-L1261 HydrophobicContact CD1-CD1 4.14Å; L1261-G1263 VanDerWaalsContact C-N 3.25Å; L1261-G1263 PolarHBondContact O-N 2.97Å; L1261-G1263 VanDerWaalsContact O-N 3.14Å; L1261-K1264 PolarHBondContact N-O 3.05Å; L1261-K1264 VanDerWaalsContact O-CB 3.28Å; L1261-K1264 WeakPolarHBondContact O-CB 3.44Å; L1261-K1264 WeakPolarHBondContact O-CG 3.25Å; L1261-K1264 PolarHBondContact O-N 3Å; L1261-L1266 HydrophobicContact CB-CB 4.24Å; L1261-L1266 HydrophobicContact CB-CD1 4.17Å; L1261-L1266 HydrophobicContact CB-CD2 4.22Å; L1261-L1266 HydrophobicContact CB-CG 4.32Å; L1261-L1266 HydrophobicContact CD2-CD1 4.33Å
1262	N	80.7	Confident	83.6	Confident	55.2 Å²	55.2	47.9 Å²	47.9	30%	0.295	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.3	40.2	-173.7	-66.5	-36.6	0	0	0	112.6	F1246 N1247 K1264 K1325	F1246-N1262 VanDerWaalsContact CA-OD1 3.3Å; F1246-N1262 WeakPolarHBondContact CA-OD1 3.4Å; F1246-N1262 WeakPolarHBondContact CB-ND2 3.38Å; F1246-N1262 WeakPolarHBondContact CB-OD1 3.42Å; N1247-N1262 PolarHBondContact N-OD1 2.87Å; N1247-N1262 PolarHBondContact ND2-OD1 3.25Å; N1247-N1262 PolarHBondContact O-N 2.94Å; N1262-K1264 VanDerWaalsContact C-N 3.27Å; N1262-K1264 PolarHBondContact O-N 2.93Å; N1262-K1264 VanDerWaalsContact O-N 3.12Å; N1262-K1325 WeakPolarHBondContact O-CD 3.41Å
1263	G	72.7	Confident	83.4	Confident	30.8 Å²	30.8	48.9 Å²	48.9	32%	0.318	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.2	-14.7	-177.3	0	0	0	0	0	115.5	W1260 L1261 K1325	W1260-G1263 VanDerWaalsContact CD1-O 3.25Å; L1261-G1263 VanDerWaalsContact C-N 3.25Å; L1261-G1263 PolarHBondContact O-N 2.97Å; L1261-G1263 VanDerWaalsContact O-N 3.14Å; G1263-K1325 WeakPolarHBondContact O-CE 3.45Å
1264	K	77.5	Confident	83.3	Confident	82.8 Å²	82.8	42.6 Å²	42.6	36%	0.36	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	132.4	177.2	-74.3	-177.5	177.6	-150.1	0	110.5	L1238 W1260 L1261 N1262 L1266 K1325 E1327	L1238-K1264 HydrophobicContact CD1-CB 3.89Å; L1238-K1264 HydrophobicContact CD1-CD 4.14Å; L1238-K1264 HydrophobicContact CD1-CG 4.47Å; L1238-K1264 HydrophobicContact CD2-CB 4.17Å; L1238-K1264 HydrophobicContact CD2-CD 3.59Å; L1238-K1264 VanDerWaalsContact CD2-CD 3.49Å; L1238-K1264 HydrophobicContact CD2-CG 4.35Å; L1238-K1264 HydrophobicContact CG-CB 4.47Å; L1238-K1264 HydrophobicContact CG-CD 4.26Å; W1260-K1264 CarbonylContact C-O 3.56Å; W1260-K1264 VanDerWaalsContact CA-O 3.26Å; W1260-K1264 WeakPolarHBondContact CA-O 3.34Å; W1260-K1264 WeakPolarHBondContact CB-O 3.32Å; L1261-K1264 PolarHBondContact N-O 3.05Å; L1261-K1264 VanDerWaalsContact O-CB 3.28Å; L1261-K1264 WeakPolarHBondContact O-CB 3.44Å; L1261-K1264 WeakPolarHBondContact O-CG 3.25Å; L1261-K1264 PolarHBondContact O-N 3Å; N1262-K1264 VanDerWaalsContact C-N 3.27Å; N1262-K1264 PolarHBondContact O-N 2.93Å; N1262-K1264 VanDerWaalsContact O-N 3.12Å; K1264-L1266 PolarHBondContact O-N 2.91Å; K1264-K1325 HydrophobicContact CG-CD 3.76Å; K1264-E1327 WeakPolarHBondContact CE-OE1 3.49Å; K1264-E1327 IonicContact NZ-OE1 3.73Å; K1264-E1327 PolarHBondContact NZ-OE1 3.05Å
1265	K	83.1	Confident	83.2	Confident	96.2 Å²	96.2	42 Å²	42	42%	0.418	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	129	177.6	-172.1	-178.5	177.4	-175	0	110	Q1258 W1260 E1629	Q1258-K1265 HydrophobicContact CG-CG 4.39Å; Q1258-K1265 VanDerWaalsContact NE2-CG 3.28Å; W1260-K1265 VanDerWaalsContact CD1-CA 3.45Å; W1260-K1265 VanDerWaalsContact CD1-N 3.31Å; W1260-K1265 HydrophobicContact CG-CB 4.5Å; K1265-E1629 IonicContact NZ-OE1 3.29Å; K1265-E1629 PolarHBondContact NZ-OE1 2.88Å; K1265-E1629 IonicContact NZ-OE2 2.65Å; K1265-E1629 PolarHBondContact NZ-OE2 2.85Å
1266	L	83	Confident	83	Confident	13.6 Å²	13.6	41.8 Å²	41.8	7%	0.071	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	-52.5	-177.9	-145.8	108.9	0	0	0	111.1	W1217 F1234 S1236 L1238 L1248 Q1258 L1259 L1261 K1264	W1217-L1266 HydrophobicContact CD2-CD2 3.93Å; W1217-L1266 HydrophobicContact CE3-CD1 4.24Å; W1217-L1266 HydrophobicContact CE3-CD2 3.71Å; W1217-L1266 HydrophobicContact CH2-CD1 3.87Å; W1217-L1266 HydrophobicContact CH2-CD2 3.4Å; W1217-L1266 VanDerWaalsContact CH2-CD2 3.44Å; W1217-L1266 HydrophobicContact CZ2-CD1 4.15Å; W1217-L1266 HydrophobicContact CZ2-CD2 3.8Å; W1217-L1266 HydrophobicContact CZ2-CG 4.43Å; W1217-L1266 HydrophobicContact CZ3-CD1 3.81Å; W1217-L1266 HydrophobicContact CZ3-CD2 3.46Å; W1217-L1266 VanDerWaalsContact CZ3-CD2 3.44Å; F1234-L1266 HydrophobicContact CE2-CD1 3.9Å; F1234-L1266 HydrophobicContact CE2-CD2 4.28Å; F1234-L1266 HydrophobicContact CE2-CG 3.8Å; F1234-L1266 VanDerWaalsContact CE2-O 3.26Å; F1234-L1266 WeakPolarHBondContact CE2-O 3.35Å; F1234-L1266 HydrophobicContact CZ-CB 4.32Å; F1234-L1266 HydrophobicContact CZ-CD1 4.32Å; F1234-L1266 HydrophobicContact CZ-CD2 4.2Å; F1234-L1266 HydrophobicContact CZ-CG 3.81Å; S1236-L1266 WeakPolarHBondContact OG-CD1 3.29Å; S1236-L1266 WeakPolarHBondContact OG-CD2 3.19Å; L1238-L1266 HydrophobicContact CD1-CB 4.48Å; L1238-L1266 HydrophobicContact CD1-CD1 4.12Å; L1238-L1266 HydrophobicContact CD1-CD2 3.78Å; L1238-L1266 HydrophobicContact CD1-CG 4.46Å; L1238-L1266 HydrophobicContact CG-CD2 4.47Å; L1248-L1266 HydrophobicContact CD1-CD1 4.36Å; L1248-L1266 HydrophobicContact CD1-CD2 4.32Å; Q1258-L1266 PolarHBondContact NE2-O 2.8Å; L1259-L1266 HydrophobicContact CB-CB 4.26Å; L1259-L1266 HydrophobicContact CB-CD1 4.06Å; L1259-L1266 HydrophobicContact CB-CD2 4.06Å; L1259-L1266 HydrophobicContact CD1-CD2 4.4Å; L1259-L1266 WeakPolarHBondContact O-CB 3.37Å; L1259-L1266 PolarHBondContact O-N 3.01Å; L1261-L1266 HydrophobicContact CB-CB 4.24Å; L1261-L1266 HydrophobicContact CB-CD1 4.17Å; L1261-L1266 HydrophobicContact CB-CD2 4.22Å; L1261-L1266 HydrophobicContact CB-CG 4.32Å; L1261-L1266 HydrophobicContact CD2-CD1 4.33Å; K1264-L1266 PolarHBondContact O-N 2.91Å
1267	S	75.4	Confident	82.8	Confident	29.8 Å²	29.8	37.6 Å²	37.6	21%	0.208	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	160.9	-173.8	27.7	0	0	0	0	112.1	F1234 Q1258 L1259 R1586	F1234-S1267 VanDerWaalsContact CD2-O 3.24Å; F1234-S1267 WeakPolarHBondContact CD2-O 3.29Å; F1234-S1267 VanDerWaalsContact CE1-CB 3.48Å; F1234-S1267 WeakPolarHBondContact CE2-O 3.27Å; F1234-S1267 WeakPolarHBondContact CG-O 3.28Å; F1234-S1267 VanDerWaalsContact CZ-CB 3.46Å; Q1258-S1267 PolarHBondContact NE2-O 2.89Å; Q1258-S1267 PolarHBondContact NE2-OG 2.82Å; Q1258-S1267 PolarHBondContact OE1-O 2.83Å; L1259-S1267 WeakPolarHBondContact CB-OG 3.28Å; L1259-S1267 PolarHBondContact N-OG 2.98Å; L1259-S1267 PolarHBondContact O-N 3.48Å; S1267-R1586 PolarHBondContact OG-NH2 3.49Å
1268	P	81.9	Confident	82.2	Confident	42.4 Å²	42.4	42.8 Å²	42.8	28%	0.275	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)		-66.9	179.9	109.2	-2.5	8.8	0	0	0	114.7	D1232 F1234 Q1258 Y1270	D1232-P1268 HydrophobicContact CB-CG 3.93Å; F1234-P1268 HydrophobicContact CB-CG 4.29Å; F1234-P1268 VanDerWaalsContact CD1-CD 3.48Å; F1234-P1268 HydrophobicContact CD1-CG 4.39Å; F1234-P1268 HydrophobicContact CG-CG 4.39Å; Q1258-P1268 PolarHBondContact NE2-O 2.83Å; Q1258-P1268 PolarHBondContact OE1-O 2.88Å; P1268-Y1270 HydrophobicContact CB-CE1 4.45Å; P1268-Y1270 WeakPolarHBondContact CD-OH 3.29Å; P1268-Y1270 HydrophobicContact CG-CE1 4.05Å; P1268-Y1270 WeakPolarHBondContact O-CE2 3.27Å
1269	I	83	Confident	81.7	Confident	86.4 Å²	86.4	46.2 Å²	46.2	44%	0.443	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	111.9	175.1	-61.7	171.4	0	0	0	109.3	K1256 M1257 Q1258 E1629	K1256-I1269 HydrophobicContact CB-CG2 3.79Å; K1256-I1269 HydrophobicContact CD-CG2 4.13Å; K1256-I1269 HydrophobicContact CG-CG2 4.39Å; M1257-I1269 CarbonylContact O-C 3.53Å; M1257-I1269 WeakPolarHBondContact O-CA 3.34Å; Q1258-I1269 HydrophobicContact CB-CG1 4.45Å; Q1258-I1269 VanDerWaalsContact OE1-CG1 3.28Å; I1269-E1629 HydrophobicContact CD1-CG 4.13Å
1270	Y	83	Confident	81.4	Confident	2.4 Å²	2.4	46.6 Å²	46.6	1%	0.009	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	151.9	179.6	-61	-65.5	0	0	0	112.4	W1206 I1208 P1219 D1232 F1234 K1256 M1257 L1259 P1268	W1206-Y1270 HydrophobicContact CH2-CD2 4.26Å; W1206-Y1270 HydrophobicContact CH2-CE2 4.46Å; W1206-Y1270 HydrophobicContact CH2-CG 4.28Å; W1206-Y1270 AromaticContact CZ2-CD1 3.81Å; W1206-Y1270 HydrophobicContact CZ2-CD1 4.15Å; W1206-Y1270 AromaticContact CZ2-CD2 3.69Å; W1206-Y1270 HydrophobicContact CZ2-CD2 3.69Å; W1206-Y1270 HydrophobicContact CZ2-CE1 4.4Å; W1206-Y1270 HydrophobicContact CZ2-CE2 4.2Å; W1206-Y1270 AromaticContact CZ2-CG 3.76Å; W1206-Y1270 HydrophobicContact CZ2-CG 3.76Å; W1206-Y1270 VanDerWaalsContact CZ2-CG 3.41Å; I1208-Y1270 HydrophobicContact CD1-CE2 4.29Å; P1219-Y1270 HydrophobicContact CB-CD1 4.17Å; P1219-Y1270 HydrophobicContact CB-CE1 3.77Å; P1219-Y1270 HydrophobicContact CG-CD1 4.37Å; P1219-Y1270 HydrophobicContact CG-CE1 3.61Å; P1219-Y1270 VanDerWaalsContact CG-CE1 3.49Å; D1232-Y1270 HydrophobicContact CB-CD1 4.37Å; D1232-Y1270 HydrophobicContact CB-CE1 3.84Å; D1232-Y1270 PolarHBondContact O-OH 2.9Å; D1232-Y1270 VanDerWaalsContact O-OH 3.13Å; F1234-Y1270 VanDerWaalsContact CD1-OH 3.3Å; F1234-Y1270 WeakPolarHBondContact CD1-OH 3.32Å; F1234-Y1270 HydrophobicContact CE1-CE2 4.35Å; F1234-Y1270 WeakPolarHBondContact CE1-OH 3.29Å; K1256-Y1270 CarbonylContact C-O 3.56Å; K1256-Y1270 VanDerWaalsContact CA-O 3.29Å; K1256-Y1270 WeakPolarHBondContact CA-O 3.36Å; M1257-Y1270 HydrophobicContact CE-CD2 4.39Å; M1257-Y1270 PolarHBondContact N-O 2.93Å; M1257-Y1270 PolarHBondContact O-N 3.21Å; L1259-Y1270 HydrophobicContact CD1-CD2 4.26Å; L1259-Y1270 HydrophobicContact CD1-CE2 4.25Å; P1268-Y1270 HydrophobicContact CB-CE1 4.45Å; P1268-Y1270 WeakPolarHBondContact CD-OH 3.29Å; P1268-Y1270 HydrophobicContact CG-CE1 4.05Å; P1268-Y1270 WeakPolarHBondContact O-CE2 3.27Å
1271	T	83.8	Confident	81.1	Confident	55.2 Å²	55.2	45.4 Å²	45.4	34%	0.339	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	116.3	167.3	-44.8	0	0	0	0	108.4	R1255 K1256	R1255-T1271 HydrophobicContact CB-CG2 4.48Å; K1256-T1271 HydrophobicContact CD-CG2 4.41Å; K1256-T1271 WeakPolarHBondContact CD-OG1 3.29Å; K1256-T1271 PolarHBondContact NZ-OG1 2.85Å
1272	L	85.4	Confident	81.1	Confident	0.8 Å²	0.8	45.3 Å²	45.3	0%	0.004	23%	0.231	C	C	.	.			trans	-69.2	138.5	171.8	-71.3	175.5	0	0	0	109.9	L1178 I1198 M1200 W1206 V1252 R1255 M1257 G1274	L1178-L1272 HydrophobicContact CD2-CD1 3.9Å; I1198-L1272 HydrophobicContact CD1-CD2 4.21Å; M1200-L1272 HydrophobicContact CE-CB 4.04Å; M1200-L1272 HydrophobicContact CE-CD1 4.05Å; M1200-L1272 HydrophobicContact CE-CG 4.28Å; M1200-L1272 HydrophobicContact SD-CB 3.9Å; M1200-L1272 HydrophobicContact SD-CD1 4.45Å; M1200-L1272 HydrophobicContact SD-CD2 4.16Å; M1200-L1272 HydrophobicContact SD-CG 4.36Å; W1206-L1272 HydrophobicContact CB-CD2 3.96Å; W1206-L1272 HydrophobicContact CD2-CD2 4.18Å; W1206-L1272 HydrophobicContact CE3-CD2 4.39Å; W1206-L1272 HydrophobicContact CG-CD2 3.95Å; V1252-L1272 HydrophobicContact CB-CD1 4.49Å; V1252-L1272 HydrophobicContact CG1-CD1 3.91Å; V1252-L1272 HydrophobicContact CG2-CD1 3.96Å; R1255-L1272 HydrophobicContact CB-CB 4.45Å; R1255-L1272 PolarHBondContact NE-O 3.18Å; R1255-L1272 VanDerWaalsContact NE-O 3.07Å; R1255-L1272 PolarHBondContact NH2-O 3.19Å; R1255-L1272 WeakPolarHBondContact O-CB 3.35Å; R1255-L1272 PolarHBondContact O-N 3.17Å; M1257-L1272 HydrophobicContact CB-CD1 4.14Å; M1257-L1272 HydrophobicContact CB-CD2 4.4Å; M1257-L1272 HydrophobicContact CB-CG 4Å; M1257-L1272 HydrophobicContact CE-CD2 3.7Å; M1257-L1272 HydrophobicContact CE-CG 4.23Å; M1257-L1272 HydrophobicContact SD-CD1 4.14Å; M1257-L1272 HydrophobicContact SD-CD2 4.01Å; M1257-L1272 HydrophobicContact SD-CG 4.28Å; L1272-G1274 VanDerWaalsContact C-N 3.28Å; L1272-G1274 PolarHBondContact O-N 2.87Å
1273	P	82.2	Confident	81.1	Confident	28.6 Å²	28.6	44.1 Å²	44.1	19%	0.186	23%	0.225	C	C	.	.	S	Bend	trans	-69.2	-33.1	-176.2	29.1	-37.4	0	0	0	112.5	M1200 I1204 W1206 T1221 R1255 K1621	M1200-P1273 HydrophobicContact SD-CG 3.92Å; I1204-P1273 HydrophobicContact CB-CB 4.24Å; I1204-P1273 HydrophobicContact CB-CG 4.2Å; I1204-P1273 HydrophobicContact CD1-CB 3.81Å; I1204-P1273 HydrophobicContact CD1-CG 4.07Å; I1204-P1273 WeakPolarHBondContact CD1-O 3.37Å; I1204-P1273 HydrophobicContact CG1-CB 4.26Å; I1204-P1273 HydrophobicContact CG1-CG 4.23Å; I1204-P1273 HydrophobicContact CG2-CB 3.59Å; I1204-P1273 HydrophobicContact CG2-CG 3.69Å; W1206-P1273 HydrophobicContact CB-CG 4.35Å; T1221-P1273 HydrophobicContact CG2-CB 3.91Å; T1221-P1273 HydrophobicContact CG2-CG 3.87Å; R1255-P1273 PolarHBondContact NH1-O 3.09Å; R1255-P1273 VanDerWaalsContact NH1-O 3.13Å; R1255-P1273 VanDerWaalsContact NH2-C 3.34Å; R1255-P1273 PolarHBondContact NH2-O 3.01Å; R1255-P1273 VanDerWaalsContact NH2-O 3.13Å; P1273-K1621 PolarHBondContact O-NZ 2.75Å; P1273-K1621 VanDerWaalsContact O-NZ 3.13Å
1274	G	82.3	Confident	81.7	Confident	4.8 Å²	4.8	43.6 Å²	43.6	5%	0.049	22%	0.219	C	C	.	.	S	Bend	trans	-113.4	-173.8	-179.6	0	0	0	0	0	113.2	M1200 D1201 I1204 R1255 L1272	M1200-G1274 VanDerWaalsContact CE-C 3.41Å; M1200-G1274 VanDerWaalsContact CE-O 3.26Å; M1200-G1274 WeakPolarHBondContact CE-O 3.35Å; M1200-G1274 PolarHBondContact SD-N 2.93Å; D1201-G1274 VanDerWaalsContact OD1-CA 3.3Å; D1201-G1274 WeakPolarHBondContact OD1-CA 3.31Å; I1204-G1274 VanDerWaalsContact CD1-N 3.28Å; R1255-G1274 VanDerWaalsContact CD-O 3.28Å; R1255-G1274 WeakPolarHBondContact CD-O 3.29Å; R1255-G1274 VanDerWaalsContact CG-O 3.29Å; R1255-G1274 WeakPolarHBondContact CG-O 3.15Å; R1255-G1274 PolarHBondContact NE-O 3.26Å; L1272-G1274 VanDerWaalsContact C-N 3.28Å; L1272-G1274 PolarHBondContact O-N 2.87Å
1275	E	80.4	Confident	82.1	Confident	104.6 Å²	104.6	41.2 Å²	41.2	49%	0.489	21%	0.21	S	C	.	.	S	Bend	trans	-106.4	-37.8	178.4	-66.5	-165.7	168.2	0	0	112.8	P1177 L1178 D1201 R1255	P1177-E1275 CarbonylContact C-O 3.51Å; P1177-E1275 VanDerWaalsContact CA-O 3.29Å; P1177-E1275 WeakPolarHBondContact CA-O 3.35Å; P1177-E1275 HydrophobicContact CB-CB 4.36Å; L1178-E1275 WeakPolarHBondContact CB-O 3.29Å; L1178-E1275 PolarHBondContact N-O 3.05Å; D1201-E1275 PolarHBondContact OD1-N 3.03Å; D1201-E1275 PolarHBondContact OD2-N 2.92Å; R1255-E1275 HydrophobicContact CG-CG 4.15Å
1276	R	80.4	Confident	82.1	Confident	88.8 Å²	88.8	37.1 Å²	37.1	34%	0.335	19%	0.193	S	C	.	.	S	Bend	trans	-112	122.6	-172.9	-58.2	-178.2	-19.7	-172.8	2.1	110.7	E1175 G1176 M1200 D1201 K1278	E1175-R1276 WeakPolarHBondContact O-CD 3.48Å; E1175-R1276 IonicContact OE1-NH2 2.75Å; E1175-R1276 IonicContact OE2-CZ 3.5Å; E1175-R1276 IonicContact OE2-NE 3.1Å; E1175-R1276 PolarHBondContact OE2-NE 2.77Å; E1175-R1276 IonicContact OE2-NH2 3.03Å; E1175-R1276 PolarHBondContact OE2-NH2 2.81Å; G1176-R1276 WeakPolarHBondContact O-CG 3.37Å; M1200-R1276 CarbonylContact C-O 3.39Å; M1200-R1276 VanDerWaalsContact C-O 3.31Å; M1200-R1276 WeakPolarHBondContact CA-O 3.25Å; M1200-R1276 VanDerWaalsContact CB-O 3.31Å; M1200-R1276 WeakPolarHBondContact CB-O 3.37Å; D1201-R1276 HydrophobicContact CB-CB 4.21Å; D1201-R1276 PolarHBondContact N-O 2.99Å; D1201-R1276 PolarHBondContact OD1-N 3.16Å; D1201-R1276 WeakPolarHBondContact OD2-CB 3.27Å; D1201-R1276 WeakPolarHBondContact OD2-CG 3.47Å; D1201-R1276 IonicContact OD2-CZ 3.44Å; D1201-R1276 VanDerWaalsContact OD2-CZ 3.26Å; D1201-R1276 PolarHBondContact OD2-N 2.87Å; D1201-R1276 IonicContact OD2-NE 3.13Å; D1201-R1276 PolarHBondContact OD2-NE 3.25Å; D1201-R1276 IonicContact OD2-NH2 2.89Å; D1201-R1276 PolarHBondContact OD2-NH2 2.88Å; R1276-K1278 PolarHBondContact O-N 2.9Å
1277	A	81.1	Confident	81.7	Confident	5.4 Å²	5.4	40.3 Å²	40.3	5%	0.045	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	124.3	165.9	0	0	0	0	0	109.7	F1173 L1178 I1198 H1199 I1280 H1295	F1173-A1277 WeakPolarHBondContact CG-O 3.37Å; L1178-A1277 HydrophobicContact CD1-CB 4.09Å; L1178-A1277 HydrophobicContact CD2-CB 4.19Å; L1178-A1277 HydrophobicContact CG-CB 4.46Å; I1198-A1277 HydrophobicContact CG2-CB 3.85Å; H1199-A1277 CarbonylContact O-C 3.43Å; H1199-A1277 WeakPolarHBondContact O-CA 3.32Å; A1277-I1280 HydrophobicContact CB-CD1 4.3Å; A1277-I1280 HydrophobicContact CB-CG1 4.29Å; A1277-H1295 PolarHBondContact N-NE2 2.76Å; A1277-H1295 PolarHBondContact O-CE1 2.78Å; A1277-H1295 VanDerWaalsContact O-CE1 3.31Å; A1277-H1295 PolarHBondContact O-NE2 2.87Å
1278	K	78.1	Confident	81.4	Confident	110 Å²	110	40.2 Å²	40.2	48%	0.478	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	-33.1	172.9	-72.1	-175.2	178.2	167.6	0	112.6	F1173 H1199 M1200 D1201 N1203 R1276	F1173-K1278 VanDerWaalsContact CD2-O 3.23Å; F1173-K1278 WeakPolarHBondContact CD2-O 3.08Å; F1173-K1278 WeakPolarHBondContact CE2-O 3.21Å; H1199-K1278 PolarHBondContact O-N 3.21Å; M1200-K1278 VanDerWaalsContact O-CD 3.27Å; M1200-K1278 WeakPolarHBondContact O-CD 3.42Å; M1200-K1278 WeakPolarHBondContact O-CE 3.18Å; M1200-K1278 WeakPolarHBondContact O-CG 3.31Å; D1201-K1278 VanDerWaalsContact C-NZ 3.34Å; D1201-K1278 VanDerWaalsContact CA-NZ 3.25Å; N1203-K1278 PolarHBondContact OD1-NZ 3.24Å; R1276-K1278 PolarHBondContact O-N 2.9Å
1279	K	79.7	Confident	81.3	Confident	89.2 Å²	89.2	40.1 Å²	40.1	39%	0.388	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	141	-178.6	-179.8	177.2	177.9	176.3	0	109.3	S1166 H1199 V1281	S1166-K1279 WeakPolarHBondContact OG-CE 3.39Å; S1166-K1279 PolarHBondContact OG-NZ 3.49Å; S1166-K1279 VanDerWaalsContact OG-NZ 3.09Å; H1199-K1279 HydrophobicContact CB-CB 4.14Å; H1199-K1279 WeakPolarHBondContact CB-O 3.36Å; H1199-K1279 PolarHBondContact N-O 3Å; H1199-K1279 PolarHBondContact O-N 2.8Å; K1279-V1281 HydrophobicContact CD-CG2 4.25Å; K1279-V1281 VanDerWaalsContact CE-CG2 3.49Å; K1279-V1281 HydrophobicContact CG-CG2 4.12Å
1280	I	83.4	Confident	80.6	Confident	6.8 Å²	6.8	38.9 Å²	38.9	4%	0.035	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	135.7	172.3	-48.2	-178.1	0	0	0	108.4	F1173 I1181 M1196 I1197 I1198 A1277 I1291 A1293 I1324	F1173-I1280 HydrophobicContact CE1-CD1 4.34Å; F1173-I1280 HydrophobicContact CE1-CG1 4.3Å; F1173-I1280 HydrophobicContact CZ-CG1 4.38Å; I1181-I1280 HydrophobicContact CB-CD1 4.44Å; I1181-I1280 HydrophobicContact CD1-CD1 3.67Å; I1181-I1280 HydrophobicContact CG1-CD1 3.7Å; I1181-I1280 HydrophobicContact CG2-CD1 3.85Å; M1196-I1280 HydrophobicContact CG-CG2 4.19Å; M1196-I1280 HydrophobicContact SD-CG2 4.36Å; I1197-I1280 CarbonylContact O-C 3.49Å; I1197-I1280 VanDerWaalsContact O-CA 3.31Å; I1197-I1280 WeakPolarHBondContact O-CA 3.24Å; I1197-I1280 WeakPolarHBondContact O-CG2 3.36Å; I1198-I1280 HydrophobicContact CG1-CG1 4.34Å; I1198-I1280 HydrophobicContact CG1-CG2 4.22Å; I1198-I1280 HydrophobicContact CG2-CG1 4.32Å; A1277-I1280 HydrophobicContact CB-CD1 4.3Å; A1277-I1280 HydrophobicContact CB-CG1 4.29Å; I1280-I1291 HydrophobicContact CB-CD1 4.08Å; I1280-I1291 HydrophobicContact CB-CG2 4.36Å; I1280-I1291 HydrophobicContact CD1-CG2 4.26Å; I1280-I1291 HydrophobicContact CG2-CD1 3.87Å; I1280-I1291 VanDerWaalsContact CG2-CD1 3.48Å; I1280-I1291 HydrophobicContact CG2-CG2 4.32Å; I1280-A1293 HydrophobicContact CD1-CB 3.76Å; I1280-I1324 HydrophobicContact CB-CD1 3.94Å; I1280-I1324 HydrophobicContact CG1-CD1 4.45Å; I1280-I1324 VanDerWaalsContact O-CD1 3.25Å; I1280-I1324 WeakPolarHBondContact O-CD1 3.25Å
1281	V	80.2	Confident	80.3	Confident	16.4 Å²	16.4	39.3 Å²	39.3	10%	0.099	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	136	-179.4	-175.5	0	0	0	0	108.5	S1166 M1196 I1197 K1279 N1283	S1166-V1281 WeakPolarHBondContact OG-CG1 3.37Å; S1166-V1281 WeakPolarHBondContact OG-CG2 3.44Å; M1196-V1281 CarbonylContact C-O 3.52Å; M1196-V1281 WeakPolarHBondContact CA-O 3.37Å; M1196-V1281 WeakPolarHBondContact CG-O 3.4Å; I1197-V1281 HydrophobicContact CB-CB 4.18Å; I1197-V1281 PolarHBondContact N-O 2.82Å; I1197-V1281 PolarHBondContact O-N 3.08Å; K1279-V1281 HydrophobicContact CD-CG2 4.25Å; K1279-V1281 VanDerWaalsContact CE-CG2 3.49Å; K1279-V1281 HydrophobicContact CG-CG2 4.12Å; V1281-N1283 HydrophobicContact CG1-CB 4.33Å
1282	I	85	Confident	79.6	Confident	1.8 Å²	1.8	38.2 Å²	38.2	1%	0.009	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	135.8	164.7	-53.8	179.3	0	0	0	107.3	A1183 V1185 F1194 Y1195 M1196 V1286 Y1289 I1291	A1183-I1282 HydrophobicContact CB-CD1 3.77Å; V1185-I1282 HydrophobicContact CG1-CG2 4.27Å; V1185-I1282 HydrophobicContact CG2-CD1 3.7Å; V1185-I1282 HydrophobicContact CG2-CG2 4.43Å; F1194-I1282 HydrophobicContact CD2-CG2 4.32Å; Y1195-I1282 CarbonylContact O-C 3.38Å; Y1195-I1282 VanDerWaalsContact O-CA 3.27Å; Y1195-I1282 WeakPolarHBondContact O-CA 3.35Å; Y1195-I1282 VanDerWaalsContact O-CB 3.23Å; Y1195-I1282 WeakPolarHBondContact O-CB 3.46Å; M1196-I1282 HydrophobicContact CB-CB 4.33Å; M1196-I1282 HydrophobicContact CB-CG1 3.99Å; M1196-I1282 HydrophobicContact CG-CD1 4.35Å; M1196-I1282 HydrophobicContact CG-CG1 3.91Å; M1196-I1282 HydrophobicContact SD-CD1 4.31Å; M1196-I1282 HydrophobicContact SD-CG1 4.3Å; I1282-V1286 HydrophobicContact CG2-CB 4.32Å; I1282-V1286 HydrophobicContact CG2-CG1 4.26Å; I1282-V1286 HydrophobicContact CG2-CG2 4.04Å; I1282-Y1289 HydrophobicContact CB-CD1 3.99Å; I1282-Y1289 HydrophobicContact CB-CD2 4.29Å; I1282-Y1289 HydrophobicContact CB-CE1 4.05Å; I1282-Y1289 HydrophobicContact CB-CE2 3.93Å; I1282-Y1289 HydrophobicContact CB-CG 4.13Å; I1282-Y1289 HydrophobicContact CD1-CD2 4.13Å; I1282-Y1289 HydrophobicContact CD1-CE2 4.46Å; I1282-Y1289 HydrophobicContact CD1-CG 4.37Å; I1282-Y1289 HydrophobicContact CG1-CD1 3.94Å; I1282-Y1289 HydrophobicContact CG1-CD2 4.43Å; I1282-Y1289 HydrophobicContact CG1-CE1 4.27Å; I1282-Y1289 HydrophobicContact CG1-CE2 4.2Å; I1282-Y1289 HydrophobicContact CG1-CG 4.04Å; I1282-Y1289 HydrophobicContact CG2-CD1 4.2Å; I1282-Y1289 HydrophobicContact CG2-CE1 4.33Å; I1282-Y1289 HydrophobicContact CG2-CG 4.4Å; I1282-Y1289 PolarHBondContact N-OH 3.39Å; I1282-Y1289 WeakPolarHBondContact O-CE1 3.35Å; I1282-Y1289 PolarHBondContact O-OH 3.13Å; I1282-I1291 HydrophobicContact CB-CD1 4.16Å; I1282-I1291 HydrophobicContact CD1-CD1 3.82Å; I1282-I1291 HydrophobicContact CD1-CG1 4Å; I1282-I1291 HydrophobicContact CG1-CD1 3.87Å; I1282-I1291 HydrophobicContact CG1-CG1 4.44Å
1283	N	82.5	Confident	79.2	Confident	29.2 Å²	29.2	39.2 Å²	39.2	16%	0.156	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156	-177.4	-176.5	-145.7	-8.1	0	0	0	110.6	L961 D1164 A1165 F1194 Y1195 V1281 V1286	L961-N1283 WeakPolarHBondContact CB-ND2 3.23Å; L961-N1283 WeakPolarHBondContact CD1-ND2 3.15Å; D1164-N1283 PolarHBondContact OD2-ND2 3.49Å; A1165-N1283 PolarHBondContact O-ND2 2.03Å; F1194-N1283 CarbonylContact C-O 3.39Å; F1194-N1283 VanDerWaalsContact CA-O 3.27Å; F1194-N1283 WeakPolarHBondContact CA-O 3.37Å; F1194-N1283 WeakPolarHBondContact CB-O 3.28Å; Y1195-N1283 HydrophobicContact CD2-CB 4.28Å; Y1195-N1283 HydrophobicContact CE1-CB 4.03Å; Y1195-N1283 HydrophobicContact CE2-CB 3.62Å; Y1195-N1283 VanDerWaalsContact CZ-CB 3.43Å; Y1195-N1283 PolarHBondContact N-O 3.03Å; Y1195-N1283 PolarHBondContact O-N 2.98Å; Y1195-N1283 VanDerWaalsContact O-N 3.08Å; Y1195-N1283 WeakPolarHBondContact OH-CB 3.46Å; Y1195-N1283 PolarHBondContact OH-ND2 3.19Å; V1281-N1283 HydrophobicContact CG1-CB 4.33Å; N1283-V1286 WeakPolarHBondContact O-CG2 3.49Å
1284	G	84.5	Confident	79.1	Confident	20.2 Å²	20.2	40.1 Å²	40.1	21%	0.208	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	95.1	-148.7	-166.8	0	0	0	0	0	110.2	K918 W927 V1286	K918-G1284 VanDerWaalsContact NZ-CA 3.27Å; W927-G1284 WeakPolarHBondContact CZ2-O 3.44Å; W927-G1284 PolarHBondContact NE1-O 2.8Å; G1284-V1286 WeakPolarHBondContact O-CB 3.46Å; G1284-V1286 WeakPolarHBondContact O-CG2 3.4Å; G1284-V1286 PolarHBondContact O-N 3.11Å
1285	D	86.2	Confident	78.9	Confident	32.2 Å²	32.2	40.8 Å²	40.8	17%	0.172	20%	0.204	C	C	.	.	S	Bend	trans	-76.9	54.4	-172	-60.8	-35.9	0	0	0	113.2	Q925 W927 K932 L1187 Q1188 A1191 S1192 E1193	Q925-D1285 WeakPolarHBondContact CG-OD1 3.15Å; W927-D1285 VanDerWaalsContact CZ2-OD1 3.22Å; W927-D1285 WeakPolarHBondContact CZ2-OD1 3.41Å; K932-D1285 HydrophobicContact CB-CB 4.48Å; K932-D1285 HydrophobicContact CD-CB 4.38Å; K932-D1285 VanDerWaalsContact CD-OD2 3.26Å; K932-D1285 WeakPolarHBondContact CD-OD2 3.33Å; K932-D1285 WeakPolarHBondContact CE-OD1 3.29Å; K932-D1285 VanDerWaalsContact CE-OD2 3.29Å; K932-D1285 WeakPolarHBondContact CE-OD2 3.23Å; K932-D1285 HydrophobicContact CG-CB 4.27Å; K932-D1285 IonicContact NZ-OD1 2.68Å; K932-D1285 PolarHBondContact NZ-OD1 2.86Å; K932-D1285 IonicContact NZ-OD2 2.73Å; K932-D1285 PolarHBondContact NZ-OD2 2.82Å; L1187-D1285 CarbonylContact C-O 3.57Å; L1187-D1285 WeakPolarHBondContact CA-O 3.42Å; L1187-D1285 WeakPolarHBondContact CD2-O 3.42Å; Q1188-D1285 HydrophobicContact CB-CB 4.4Å; Q1188-D1285 WeakPolarHBondContact CB-O 3.15Å; Q1188-D1285 VanDerWaalsContact CG-O 3.23Å; Q1188-D1285 WeakPolarHBondContact CG-O 3.2Å; Q1188-D1285 PolarHBondContact N-O 3.07Å; Q1188-D1285 VanDerWaalsContact N-O 3.15Å; Q1188-D1285 PolarHBondContact NE2-OD1 3.32Å; Q1188-D1285 VanDerWaalsContact OE1-C 3.27Å; A1191-D1285 VanDerWaalsContact CA-CB 3.48Å; A1191-D1285 HydrophobicContact CB-CB 3.56Å; A1191-D1285 VanDerWaalsContact CB-CB 3.46Å; A1191-D1285 VanDerWaalsContact CB-O 3.31Å; A1191-D1285 WeakPolarHBondContact CB-O 3.33Å; S1192-D1285 WeakPolarHBondContact CA-OD2 3.24Å; S1192-D1285 WeakPolarHBondContact CB-OD2 3.33Å; S1192-D1285 PolarHBondContact N-OD2 2.54Å; S1192-D1285 PolarHBondContact OG-OD2 2.92Å; E1193-D1285 PolarHBondContact N-OD2 2.97Å; E1193-D1285 VanDerWaalsContact O-CB 3.25Å; E1193-D1285 WeakPolarHBondContact O-CB 3.38Å; E1193-D1285 PolarHBondContact O-N 3.03Å
1286	V	82.3	Confident	78.4	Confident	10 Å²	10	40.4 Å²	40.4	6%	0.061	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	125.4	-171.1	-179.4	0	0	0	0	109.5	K1167 V1185 Q1186 L1187 Q1188 F1194 I1282 N1283 G1284 A1288 Y1289	K1167-V1286 PolarHBondContact NZ-O 2.72Å; V1185-V1286 HydrophobicContact CG1-CB 4.15Å; V1185-V1286 HydrophobicContact CG1-CG1 3.74Å; V1185-V1286 HydrophobicContact CG1-CG2 3.93Å; V1185-V1286 VanDerWaalsContact CG1-CG2 3.43Å; Q1186-V1286 CarbonylContact O-C 3.47Å; Q1186-V1286 VanDerWaalsContact O-CA 3.31Å; Q1186-V1286 WeakPolarHBondContact O-CA 3.37Å; Q1186-V1286 WeakPolarHBondContact O-CG1 3.42Å; L1187-V1286 HydrophobicContact CD2-CG2 4.29Å; Q1188-V1286 WeakPolarHBondContact CG-O 3.37Å; Q1188-V1286 PolarHBondContact NE2-O 2.87Å; F1194-V1286 HydrophobicContact CB-CG2 3.64Å; F1194-V1286 VanDerWaalsContact CB-CG2 3.45Å; F1194-V1286 HydrophobicContact CG-CG2 4.35Å; I1282-V1286 HydrophobicContact CG2-CB 4.32Å; I1282-V1286 HydrophobicContact CG2-CG1 4.26Å; I1282-V1286 HydrophobicContact CG2-CG2 4.04Å; N1283-V1286 WeakPolarHBondContact O-CG2 3.49Å; G1284-V1286 WeakPolarHBondContact O-CB 3.46Å; G1284-V1286 WeakPolarHBondContact O-CG2 3.4Å; G1284-V1286 PolarHBondContact O-N 3.11Å; V1286-A1288 WeakPolarHBondContact CG1-O 3.34Å; V1286-A1288 PolarHBondContact O-N 3.26Å; V1286-Y1289 HydrophobicContact CG1-CD1 3.99Å; V1286-Y1289 HydrophobicContact CG1-CE1 4.43Å
1287	Q	74.4	Confident	77	Confident	81.6 Å²	81.6	43 Å²	43	38%	0.381	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	-39.3	176.2	-174.5	170	16.1	0	0	112.2	N929 G930 R931 K1167 Q1186 L1187 Q1188	N929-Q1287 PolarHBondContact O-NE2 2.63Å; G930-Q1287 WeakPolarHBondContact O-CA 3.43Å; G930-Q1287 WeakPolarHBondContact O-CB 3.38Å; G930-Q1287 WeakPolarHBondContact O-CG 3.31Å; R931-Q1287 HydrophobicContact CG-CG 4.48Å; R931-Q1287 VanDerWaalsContact CZ-OE1 3.28Å; R931-Q1287 VanDerWaalsContact NE-CD 3.34Å; K1167-Q1287 PolarHBondContact NZ-O 3.06Å; Q1186-Q1287 HydrophobicContact CB-CB 4.1Å; Q1186-Q1287 VanDerWaalsContact CD-OE1 3.29Å; Q1186-Q1287 HydrophobicContact CG-CB 4.06Å; Q1186-Q1287 HydrophobicContact CG-CG 4.31Å; Q1186-Q1287 VanDerWaalsContact NE2-CD 3.26Å; Q1186-Q1287 WeakPolarHBondContact O-CA 3.47Å; Q1186-Q1287 WeakPolarHBondContact O-CB 3.48Å; Q1186-Q1287 PolarHBondContact O-N 3.07Å; Q1186-Q1287 VanDerWaalsContact OE1-CD 3.31Å; Q1186-Q1287 VanDerWaalsContact OE1-CG 3.23Å; L1187-Q1287 WeakPolarHBondContact O-CB 3.32Å; Q1188-Q1287 HydrophobicContact CG-CB 4.36Å
1288	A	69.1	Low	75.3	Confident	28.4 Å²	28.4	46.8 Å²	46.8	24%	0.235	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	158.7	177	0	0	0	0	0	111.4	Q1186 V1286 S1326 E1327 L1329	Q1186-A1288 WeakPolarHBondContact CA-O 3.46Å; Q1186-A1288 HydrophobicContact CB-CB 4.12Å; Q1186-A1288 HydrophobicContact CG-CB 3.85Å; Q1186-A1288 PolarHBondContact N-O 3.2Å; Q1186-A1288 PolarHBondContact O-N 3.14Å; Q1186-A1288 VanDerWaalsContact O-N 3.14Å; V1286-A1288 WeakPolarHBondContact CG1-O 3.34Å; V1286-A1288 PolarHBondContact O-N 3.26Å; A1288-S1326 WeakPolarHBondContact CA-OG 3.3Å; A1288-E1327 HydrophobicContact CB-CB 4.06Å; A1288-L1329 HydrophobicContact CB-CD2 3.94Å; A1288-L1329 HydrophobicContact CB-CG 4.43Å
1289	Y	80.1	Confident	73.4	Confident	39.4 Å²	39.4	47.8 Å²	47.8	16%	0.155	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	157.5	154.5	64	-98.9	0	0	0	112.2	K1167 T1184 I1282 V1286 I1291 I1324 K1325 S1326 S1462	K1167-Y1289 HydrophobicContact CB-CD1 4.08Å; K1167-Y1289 HydrophobicContact CB-CE1 3.46Å; K1167-Y1289 VanDerWaalsContact CB-CE1 3.46Å; K1167-Y1289 HydrophobicContact CB-CE2 4.08Å; K1167-Y1289 VanDerWaalsContact CB-CZ 3.48Å; K1167-Y1289 HydrophobicContact CD-CD1 3.9Å; K1167-Y1289 HydrophobicContact CD-CE1 3.71Å; K1167-Y1289 HydrophobicContact CG-CD1 4.45Å; K1167-Y1289 HydrophobicContact CG-CE1 3.88Å; K1167-Y1289 PolarHBondContact N-OH 3.4Å; K1167-Y1289 WeakPolarHBondContact O-CE2 3.37Å; T1184-Y1289 CarbonylContact O-C 3.54Å; T1184-Y1289 WeakPolarHBondContact O-CA 3.37Å; T1184-Y1289 WeakPolarHBondContact O-CB 3.25Å; I1282-Y1289 HydrophobicContact CB-CD1 3.99Å; I1282-Y1289 HydrophobicContact CB-CD2 4.29Å; I1282-Y1289 HydrophobicContact CB-CE1 4.05Å; I1282-Y1289 HydrophobicContact CB-CE2 3.93Å; I1282-Y1289 HydrophobicContact CB-CG 4.13Å; I1282-Y1289 HydrophobicContact CD1-CD2 4.13Å; I1282-Y1289 HydrophobicContact CD1-CE2 4.46Å; I1282-Y1289 HydrophobicContact CD1-CG 4.37Å; I1282-Y1289 HydrophobicContact CG1-CD1 3.94Å; I1282-Y1289 HydrophobicContact CG1-CD2 4.43Å; I1282-Y1289 HydrophobicContact CG1-CE1 4.27Å; I1282-Y1289 HydrophobicContact CG1-CE2 4.2Å; I1282-Y1289 HydrophobicContact CG1-CG 4.04Å; I1282-Y1289 HydrophobicContact CG2-CD1 4.2Å; I1282-Y1289 HydrophobicContact CG2-CE1 4.33Å; I1282-Y1289 HydrophobicContact CG2-CG 4.4Å; I1282-Y1289 PolarHBondContact N-OH 3.39Å; I1282-Y1289 WeakPolarHBondContact O-CE1 3.35Å; I1282-Y1289 PolarHBondContact O-OH 3.13Å; V1286-Y1289 HydrophobicContact CG1-CD1 3.99Å; V1286-Y1289 HydrophobicContact CG1-CE1 4.43Å; Y1289-I1291 HydrophobicContact CD2-CB 4.37Å; Y1289-I1291 HydrophobicContact CD2-CD1 3.58Å; Y1289-I1291 VanDerWaalsContact CD2-CD1 3.43Å; Y1289-I1291 HydrophobicContact CD2-CG1 3.68Å; Y1289-I1291 HydrophobicContact CD2-CG2 4.18Å; Y1289-I1291 HydrophobicContact CE2-CD1 3.53Å; Y1289-I1291 VanDerWaalsContact CE2-CD1 3.43Å; Y1289-I1291 HydrophobicContact CE2-CG1 4.07Å; Y1289-I1291 HydrophobicContact CE2-CG2 4.06Å; Y1289-I1291 HydrophobicContact CG-CD1 4.38Å; Y1289-I1291 HydrophobicContact CG-CG1 4.47Å; Y1289-I1324 HydrophobicContact CD2-CG2 4.46Å; Y1289-I1324 HydrophobicContact CE2-CB 4Å; Y1289-I1324 HydrophobicContact CE2-CG2 3.76Å; Y1289-K1325 WeakPolarHBondContact O-CA 3.29Å; Y1289-S1326 WeakPolarHBondContact CD1-OG 3.47Å; Y1289-S1326 VanDerWaalsContact CE1-CB 3.43Å; Y1289-S1326 PolarHBondContact N-OG 3.36Å; Y1289-S1326 PolarHBondContact O-N 3.25Å; Y1289-S1326 VanDerWaalsContact O-N 3.11Å; Y1289-S1462 WeakPolarHBondContact OH-CB 3.4Å
1290	N	69	Low	71.3	Confident	61 Å²	61	47.7 Å²	47.7	33%	0.326	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	136.9	162.3	-175.6	22.7	0	0	0	108.6	A1183 T1184 I1324 K1325 L1329 D1466	A1183-N1290 CarbonylContact C-O 3.41Å; A1183-N1290 VanDerWaalsContact CA-O 3.27Å; A1183-N1290 WeakPolarHBondContact CA-O 3.28Å; T1184-N1290 PolarHBondContact N-O 2.89Å; T1184-N1290 PolarHBondContact O-N 3.22Å; N1290-I1324 CarbonylContact C-O 3.6Å; N1290-I1324 WeakPolarHBondContact CA-O 3.36Å; N1290-I1324 PolarHBondContact OD1-O 3.07Å; N1290-K1325 HydrophobicContact CB-CG 4.22Å; N1290-K1325 VanDerWaalsContact OD1-CE 3.29Å; N1290-K1325 WeakPolarHBondContact OD1-CE 3.03Å; N1290-K1325 VanDerWaalsContact OD1-CG 3.31Å; N1290-K1325 WeakPolarHBondContact OD1-CG 3.31Å; N1290-L1329 HydrophobicContact CB-CD1 4.05Å; N1290-D1466 PolarHBondContact ND2-OD2 2.67Å
1291	I	76.9	Confident	69.1	Low	11.4 Å²	11.4	56 Å²	56	6%	0.058	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	122.9	-179.2	-73.9	166.2	0	0	0	110.4	I1181 R1182 A1183 I1280 I1282 Y1289 T1323 I1324	I1181-I1291 HydrophobicContact CG2-CD1 3.73Å; I1181-I1291 HydrophobicContact CG2-CG1 3.79Å; I1181-I1291 HydrophobicContact CG2-CG2 3.81Å; R1182-I1291 CarbonylContact O-C 3.58Å; R1182-I1291 VanDerWaalsContact O-CA 3.25Å; R1182-I1291 WeakPolarHBondContact O-CA 3.43Å; A1183-I1291 HydrophobicContact CB-CB 4.43Å; A1183-I1291 HydrophobicContact CB-CD1 4.14Å; A1183-I1291 HydrophobicContact CB-CG1 4Å; I1280-I1291 HydrophobicContact CB-CD1 4.08Å; I1280-I1291 HydrophobicContact CB-CG2 4.36Å; I1280-I1291 HydrophobicContact CD1-CG2 4.26Å; I1280-I1291 HydrophobicContact CG2-CD1 3.87Å; I1280-I1291 VanDerWaalsContact CG2-CD1 3.48Å; I1280-I1291 HydrophobicContact CG2-CG2 4.32Å; I1282-I1291 HydrophobicContact CB-CD1 4.16Å; I1282-I1291 HydrophobicContact CD1-CD1 3.82Å; I1282-I1291 HydrophobicContact CD1-CG1 4Å; I1282-I1291 HydrophobicContact CG1-CD1 3.87Å; I1282-I1291 HydrophobicContact CG1-CG1 4.44Å; Y1289-I1291 HydrophobicContact CD2-CB 4.37Å; Y1289-I1291 HydrophobicContact CD2-CD1 3.58Å; Y1289-I1291 VanDerWaalsContact CD2-CD1 3.43Å; Y1289-I1291 HydrophobicContact CD2-CG1 3.68Å; Y1289-I1291 HydrophobicContact CD2-CG2 4.18Å; Y1289-I1291 HydrophobicContact CE2-CD1 3.53Å; Y1289-I1291 VanDerWaalsContact CE2-CD1 3.43Å; Y1289-I1291 HydrophobicContact CE2-CG1 4.07Å; Y1289-I1291 HydrophobicContact CE2-CG2 4.06Å; Y1289-I1291 HydrophobicContact CG-CD1 4.38Å; Y1289-I1291 HydrophobicContact CG-CG1 4.47Å; I1291-T1323 CarbonylContact O-C 3.49Å; I1291-T1323 WeakPolarHBondContact O-CA 3.33Å; I1291-I1324 HydrophobicContact CB-CB 4.36Å; I1291-I1324 PolarHBondContact N-O 2.95Å; I1291-I1324 VanDerWaalsContact N-O 3.15Å; I1291-I1324 PolarHBondContact O-N 2.9Å
1292	D	68.7	Low	66.9	Low	31.8 Å²	31.8	60.8 Å²	60.8	17%	0.17	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	125.4	165.1	-64.1	-60.8	0	0	0	109.4	R1171 I1181 R1182 F1294 R1321 T1322 T1323	R1171-D1292 IonicContact NE-OD1 2.69Å; I1181-D1292 CarbonylContact C-O 3.53Å; I1181-D1292 WeakPolarHBondContact CA-O 3.46Å; R1182-D1292 HydrophobicContact CB-CB 4.39Å; R1182-D1292 PolarHBondContact N-O 3.17Å; R1182-D1292 PolarHBondContact O-N 2.91Å; D1292-F1294 HydrophobicContact CB-CD2 4.38Å; D1292-F1294 HydrophobicContact CB-CE2 3.46Å; D1292-F1294 VanDerWaalsContact CB-CE2 3.45Å; D1292-F1294 HydrophobicContact CB-CZ 3.79Å; D1292-R1321 IonicContact OD1-CZ 3.73Å; D1292-R1321 VanDerWaalsContact OD1-CZ 3.29Å; D1292-R1321 IonicContact OD1-NE 3.38Å; D1292-R1321 PolarHBondContact OD1-NE 3.27Å; D1292-R1321 VanDerWaalsContact OD1-NE 3.09Å; D1292-R1321 IonicContact OD1-NH2 3.72Å; D1292-R1321 PolarHBondContact OD1-NH2 2.89Å; D1292-R1321 IonicContact OD2-CZ 2.73Å; D1292-R1321 IonicContact OD2-NH1 3.25Å; D1292-R1321 PolarHBondContact OD2-NH1 2.84Å; D1292-R1321 IonicContact OD2-NH2 3.1Å; D1292-R1321 PolarHBondContact OD2-NH2 2.93Å; D1292-R1321 VanDerWaalsContact OD2-NH2 3.17Å; D1292-T1322 WeakPolarHBondContact CA-O 3.38Å; D1292-T1323 WeakPolarHBondContact OD1-CG2 3.4Å; D1292-T1323 PolarHBondContact OD1-OG1 3Å
1293	A	77.4	Confident	64.6	Low	20.8 Å²	20.8	66.9 Å²	66.9	17%	0.172	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	137.1	170.5	0	0	0	0	0	110.2	F1173 L1178 H1180 I1280 R1321 T1322	F1173-A1293 HydrophobicContact CD1-CB 4.17Å; F1173-A1293 HydrophobicContact CE1-CB 3.8Å; L1178-A1293 HydrophobicContact CD1-CB 4.37Å; H1180-A1293 CarbonylContact O-C 3.49Å; H1180-A1293 WeakPolarHBondContact O-CA 3.22Å; I1280-A1293 HydrophobicContact CD1-CB 3.76Å; A1293-R1321 CarbonylContact O-C 3.52Å; A1293-R1321 WeakPolarHBondContact O-CA 3.21Å; A1293-T1322 PolarHBondContact N-O 3.12Å; A1293-T1322 PolarHBondContact O-N 3.08Å
1294	F	79.2	Confident	62.3	Low	48 Å²	48	68.9 Å²	68.9	21%	0.211	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	124.2	-177.5	-57	-98.2	0	0	0	110.3	H1179 H1180 D1292 L1319 V1320 R1321	H1179-F1294 WeakPolarHBondContact CA-O 3.16Å; H1179-F1294 VanDerWaalsContact CB-O 3.28Å; H1179-F1294 WeakPolarHBondContact CB-O 3.27Å; H1179-F1294 PolarHBondContact N-O 2.89Å; H1180-F1294 HydrophobicContact CB-CB 4.12Å; H1180-F1294 HydrophobicContact CB-CD2 3.99Å; H1180-F1294 HydrophobicContact CB-CG 4.43Å; H1180-F1294 AromaticContact CD2-CD2 3.52Å; H1180-F1294 VanDerWaalsContact CD2-CD2 3.45Å; H1180-F1294 WeakPolarHBondContact CD2-CD2 3.4Å; H1180-F1294 AromaticContact CD2-CE2 3.84Å; H1180-F1294 AromaticContact CD2-CG 3.84Å; H1180-F1294 AromaticContact CE1-CD2 3.81Å; H1180-F1294 AromaticContact CE1-CG 3.67Å; H1180-F1294 PolarHBondContact N-O 3.08Å; H1180-F1294 VanDerWaalsContact N-O 3.16Å; H1180-F1294 AromaticContact NE2-CD2 3.14Å; H1180-F1294 WeakPolarHBondContact NE2-CD2 3.33Å; H1180-F1294 AromaticContact NE2-CE2 3.53Å; H1180-F1294 WeakPolarHBondContact NE2-CE2 3.34Å; H1180-F1294 AromaticContact NE2-CG 3.48Å; H1180-F1294 WeakPolarHBondContact NE2-CG 2.98Å; H1180-F1294 PolarHBondContact O-N 2.86Å; D1292-F1294 HydrophobicContact CB-CD2 4.38Å; D1292-F1294 HydrophobicContact CB-CE2 3.46Å; D1292-F1294 VanDerWaalsContact CB-CE2 3.45Å; D1292-F1294 HydrophobicContact CB-CZ 3.79Å; F1294-L1319 HydrophobicContact CD1-CD1 4.19Å; F1294-L1319 HydrophobicContact CD1-CD2 4.27Å; F1294-V1320 CarbonylContact C-O 3.54Å; F1294-V1320 VanDerWaalsContact CA-O 3.29Å; F1294-V1320 WeakPolarHBondContact CA-O 3.39Å; F1294-R1321 HydrophobicContact CD1-CB 3.91Å; F1294-R1321 HydrophobicContact CD1-CG 4.02Å; F1294-R1321 HydrophobicContact CE1-CB 4.14Å; F1294-R1321 HydrophobicContact CE1-CG 3.97Å; F1294-R1321 HydrophobicContact CZ-CG 4.26Å
1295	H	78.4	Confident	59.9	Low	19.6 Å²	19.6	72.2 Å²	72.2	9%	0.091	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	147.8	175.9	-60	49	0	0	0	109.2	F1173 K1174 E1175 G1176 P1177 A1277 R1297 L1319 V1320	F1173-H1295 AromaticContact CD1-CE1 3.57Å; K1174-H1295 WeakPolarHBondContact O-CB 3.29Å; K1174-H1295 PolarHBondContact O-CD2 3.41Å; E1175-H1295 IonicContact OE2-CD2 3.15Å; E1175-H1295 IonicContact OE2-NE2 3.61Å; G1176-H1295 WeakPolarHBondContact O-CB 3.35Å; G1176-H1295 PolarHBondContact O-CD2 3.06Å; G1176-H1295 VanDerWaalsContact O-CD2 3.25Å; P1177-H1295 CarbonylContact O-C 3.54Å; P1177-H1295 WeakPolarHBondContact O-CA 3.32Å; A1277-H1295 PolarHBondContact N-NE2 2.76Å; A1277-H1295 PolarHBondContact O-CE1 2.78Å; A1277-H1295 VanDerWaalsContact O-CE1 3.31Å; A1277-H1295 PolarHBondContact O-NE2 2.87Å; H1295-R1297 PolarHBondContact O-N 3.21Å; H1295-L1319 CarbonylContact O-C 3.49Å; H1295-L1319 WeakPolarHBondContact O-CA 3.28Å; H1295-L1319 WeakPolarHBondContact O-CD2 3.43Å; H1295-V1320 PolarHBondContact N-O 3.13Å; H1295-V1320 PolarHBondContact O-N 3.04Å
1296	K	69.6	Low	57.5	Low	97.4 Å²	97.4	78.1 Å²	78.1	42%	0.423	44%	0.44	S	S	.	.			trans	-70	132.2	173.1	-77.6	-174.1	178.1	-170.6	0	109.8	G1176 P1177 H1179 T1298 D1317 P1318 L1319	G1176-K1296 CarbonylContact C-O 3.53Å; G1176-K1296 VanDerWaalsContact CA-O 3.31Å; G1176-K1296 WeakPolarHBondContact CA-O 3.46Å; G1176-K1296 PolarHBondContact N-O 2.94Å; G1176-K1296 VanDerWaalsContact N-O 3.16Å; P1177-K1296 HydrophobicContact CG-CB 4.35Å; P1177-K1296 HydrophobicContact CG-CD 4.32Å; P1177-K1296 PolarHBondContact O-N 3.05Å; H1179-K1296 HydrophobicContact CB-CB 4.43Å; H1179-K1296 HydrophobicContact CB-CD 4.46Å; H1179-K1296 HydrophobicContact CB-CG 4.1Å; H1179-K1296 VanDerWaalsContact CD2-CE 3.42Å; H1179-K1296 WeakPolarHBondContact CD2-CE 3.1Å; H1179-K1296 VanDerWaalsContact NE2-CE 3.33Å; H1179-K1296 WeakPolarHBondContact NE2-CE 3.33Å; K1296-T1298 PolarHBondContact O-N 3.18Å; K1296-T1298 VanDerWaalsContact O-N 3.15Å; K1296-D1317 WeakPolarHBondContact CE-OD2 3.46Å; K1296-D1317 IonicContact NZ-OD2 3.94Å; K1296-D1317 PolarHBondContact NZ-OD2 2.67Å; K1296-P1318 CarbonylContact C-O 3.46Å; K1296-P1318 WeakPolarHBondContact CA-O 3.34Å; K1296-L1319 HydrophobicContact CB-CD2 4.5Å; K1296-L1319 HydrophobicContact CG-CD2 3.93Å
1297	R	52.3	Low	55.3	Low	141.4 Å²	141.4	83.1 Å²	83.1	53%	0.534	48%	0.476	S	S	.	.			trans	-70.7	113.4	169.2	-134.8	-179.6	-174.6	147.7	0.5	108.7	H1295 L1299 V1316 D1317 P1318 L1319 V1320 E1471 Q1474	H1295-R1297 PolarHBondContact O-N 3.21Å; R1297-L1299 PolarHBondContact O-N 3.13Å; R1297-L1299 VanDerWaalsContact O-N 3.16Å; R1297-V1316 VanDerWaalsContact NH1-CG1 3.34Å; R1297-D1317 WeakPolarHBondContact CD-O 3.4Å; R1297-D1317 IonicContact CZ-OD2 2.73Å; R1297-D1317 IonicContact NH1-OD2 3.67Å; R1297-D1317 PolarHBondContact NH1-OD2 2.94Å; R1297-D1317 IonicContact NH2-OD2 3.33Å; R1297-D1317 PolarHBondContact NH2-OD2 2.82Å; R1297-P1318 HydrophobicContact CB-CB 3.92Å; R1297-P1318 HydrophobicContact CB-CG 4.29Å; R1297-P1318 WeakPolarHBondContact CB-O 3.37Å; R1297-P1318 HydrophobicContact CG-CB 4.25Å; R1297-P1318 WeakPolarHBondContact CG-O 3.29Å; R1297-P1318 PolarHBondContact N-O 3.06Å; R1297-L1319 PolarHBondContact NE-O 2.72Å; R1297-L1319 VanDerWaalsContact NE-O 3.08Å; R1297-L1319 VanDerWaalsContact NH1-CD2 3.3Å; R1297-V1320 HydrophobicContact CB-CG2 4.39Å; R1297-V1320 HydrophobicContact CG-CG2 3.98Å; R1297-V1320 VanDerWaalsContact CG-CG2 3.5Å; R1297-E1471 IonicContact CZ-OE1 3.18Å; R1297-E1471 IonicContact NH1-OE1 2.75Å; R1297-E1471 PolarHBondContact NH1-OE1 2.78Å; R1297-E1471 IonicContact NH2-OE1 2.7Å; R1297-E1471 PolarHBondContact NH2-OE1 3.46Å; R1297-Q1474 VanDerWaalsContact CZ-OE1 3.28Å
1298	T	45.2	Very low	53.5	Low	85.4 Å²	85.4	85.5 Å²	85.5	52%	0.524	50%	0.496	S	S	.	.			trans	-82.7	115.2	169.7	-26.8	0	0	0	0	108.3	K1174 G1176 P1177 K1296	K1174-T1298 PolarHBondContact O-N 2.83Å; K1174-T1298 VanDerWaalsContact O-N 3.09Å; K1174-T1298 PolarHBondContact O-OG1 2.94Å; G1176-T1298 VanDerWaalsContact CA-OG1 3.31Å; G1176-T1298 WeakPolarHBondContact CA-OG1 3.34Å; G1176-T1298 PolarHBondContact N-OG1 2.88Å; P1177-T1298 WeakPolarHBondContact CD-OG1 3.26Å; K1296-T1298 PolarHBondContact O-N 3.18Å; K1296-T1298 VanDerWaalsContact O-N 3.15Å
1299	L	36.5	Very low	52	Low	131.4 Å²	131.4	89 Å²	89	69%	0.688	51%	0.511	S	S	*	.	P	Polyproline II helix	trans	-76.4	139.9	168.6	-75	166	0	0	0	108.9	F1173 R1297 K1301	F1173-L1299 HydrophobicContact CD1-CD2 4.32Å; F1173-L1299 HydrophobicContact CE1-CD2 3.91Å; R1297-L1299 PolarHBondContact O-N 3.13Å; R1297-L1299 VanDerWaalsContact O-N 3.16Å; L1299-K1301 PolarHBondContact O-N 3.06Å
1300	P	35.8	Very low	49.8	Very low	87.4 Å²	87.4	92.6 Å²	92.6	57%	0.568	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-58.3	134.9	166.9	-11.9	21.4	0	0	0	109.7	F1173 P1302 E1483	F1173-P1300 HydrophobicContact CD1-CG 4.17Å; F1173-P1300 HydrophobicContact CE1-CG 3.85Å; P1300-P1302 WeakPolarHBondContact O-CD 3.43Å; P1300-E1483 HydrophobicContact CB-CG 4.06Å; P1300-E1483 HydrophobicContact CG-CG 4.21Å
1301	K	37.2	Very low	48.2	Very low	180.2 Å²	180.2	97.6 Å²	97.6	78%	0.783	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-79.9	124.3	172.7	-127.4	-175.3	178.7	-170.2	0	108.1	L1299 T1303 F1487	L1299-K1301 PolarHBondContact O-N 3.06Å; K1301-T1303 PolarHBondContact O-N 2.84Å; K1301-T1303 PolarHBondContact O-OG1 3.11Å; K1301-F1487 HydrophobicContact CB-CE1 4.39Å; K1301-F1487 HydrophobicContact CD-CE1 4.28Å
1302	P	35.2	Very low	46.2	Very low	117.8 Å²	117.8	105.5 Å²	105.5	77%	0.765	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-66.6	140.5	172.9	11.8	-9.8	0	0	0	110	P1300 G1304	P1300-P1302 WeakPolarHBondContact O-CD 3.43Å; P1302-G1304 PolarHBondContact O-N 2.87Å
1303	T	35.3	Very low	44.5	Very low	130.2 Å²	130.2	113.2 Å²	113.2	80%	0.799	63%	0.626	S	S	*	*			trans	-123.6	125.8	176.1	-24.2	0	0	0	0	108	K1301	K1301-T1303 PolarHBondContact O-N 2.84Å; K1301-T1303 PolarHBondContact O-OG1 3.11Å
1304	G	35.2	Very low	42.4	Very low	71.8 Å²	71.8	122.1 Å²	122.1	74%	0.74	66%	0.655	S	S	*	*			trans	121.9	134.9	-170.6	0	0	0	0	0	111.3	P1302 D1306	P1302-G1304 PolarHBondContact O-N 2.87Å; G1304-D1306 VanDerWaalsContact C-N 3.28Å; G1304-D1306 PolarHBondContact O-N 2.76Å
1305	A	33.8	Very low	40.3	Very low	88 Å²	88	129.1 Å²	129.1	73%	0.727	69%	0.686	S	S	*	*			trans	-117.4	130.4	162.7	0	0	0	0	0	109.5	K1509	A1305-K1509 WeakPolarHBondContact O-CE 3.4Å; A1305-K1509 PolarHBondContact O-NZ 3.28Å
1306	D	36.3	Very low	38.1	Very low	156.2 Å²	156.2	134 Å²	134	84%	0.835	72%	0.717	S	S	*	*				-146.1	156.1	129.2	-79.7	-47.5	0	0	0	114.3	G1304 V1308 K1509	G1304-D1306 VanDerWaalsContact C-N 3.28Å; G1304-D1306 PolarHBondContact O-N 2.76Å; D1306-V1308 WeakPolarHBondContact O-CG2 3.37Å; D1306-V1308 PolarHBondContact O-N 2.89Å; D1306-K1509 IonicContact OD1-NZ 3.8Å; D1306-K1509 PolarHBondContact OD1-NZ 2.79Å; D1306-K1509 IonicContact OD2-NZ 3.71Å; D1306-K1509 PolarHBondContact OD2-NZ 2.77Å
1307	S	35.2	Very low	36.3	Very low	115.6 Å²	115.6	134.2 Å²	134.2	81%	0.808	72%	0.722	S	S	*	*			trans	-35.7	106.6	177.8	-167.2	0	0	0	0	117.1
1308	V	36.2	Very low	35.5	Very low	131.4 Å²	131.4	131.1 Å²	131.1	80%	0.796	72%	0.72	S	S	*	*			trans	-144.4	126.7	145.4	179.9	0	0	0	0	114.5	D1306	D1306-V1308 WeakPolarHBondContact O-CG2 3.37Å; D1306-V1308 PolarHBondContact O-N 2.89Å
1309	D	38.9	Very low	34.8	Very low	103.8 Å²	103.8	130.8 Å²	130.8	56%	0.555	72%	0.715	S	S	*	*			trans	-14.6	116.5	163.1	-174	-0.4	0	0	0	115.8	Q1311 K1312	D1309-Q1311 PolarHBondContact O-N 2.92Å; D1309-Q1311 WeakPolarHBondContact OD1-CB 3.48Å; D1309-Q1311 WeakPolarHBondContact OD1-CG 3.32Å; D1309-Q1311 PolarHBondContact OD1-N 2.96Å; D1309-Q1311 VanDerWaalsContact OD1-N 3.11Å; D1309-K1312 PolarHBondContact O-N 3.33Å
1310	P	32.8	Very low	34.8	Very low	113.8 Å²	113.8	127.9 Å²	127.9	74%	0.739	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.5	25.4	178.4	23.2	-19.4	0	0	0	115.8	K1312	P1310-K1312 PolarHBondContact O-N 2.81Å
1311	Q	37	Very low	34.6	Very low	166 Å²	166	129.9 Å²	129.9	78%	0.776	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	23.3	177.9	-65.9	-158.2	13.6	0	0	115.6	D1309 K1313	D1309-Q1311 PolarHBondContact O-N 2.92Å; D1309-Q1311 WeakPolarHBondContact OD1-CB 3.48Å; D1309-Q1311 WeakPolarHBondContact OD1-CG 3.32Å; D1309-Q1311 PolarHBondContact OD1-N 2.96Å; D1309-Q1311 VanDerWaalsContact OD1-N 3.11Å; Q1311-K1313 PolarHBondContact O-N 2.92Å; Q1311-K1313 VanDerWaalsContact O-N 3.16Å
1312	K	34.8	Very low	34.5	Very low	177.8 Å²	177.8	124.1 Å²	124.1	77%	0.773	68%	0.679	S	S	*	*			trans	-87.2	72	179.6	-70	171.2	-178.3	166.3	0	116.5	D1309 P1310 R1314	D1309-K1312 PolarHBondContact O-N 3.33Å; P1310-K1312 PolarHBondContact O-N 2.81Å; K1312-R1314 VanDerWaalsContact C-N 3.32Å; K1312-R1314 PolarHBondContact O-N 2.95Å
1313	K	33	Very low	34.3	Very low	193.6 Å²	193.6	121 Å²	121	84%	0.842	66%	0.657	S	S	*	*			trans	-119.5	92.6	164.1	-78.2	171.9	-177.7	170	0	115.3	Q1311 K1315	Q1311-K1313 PolarHBondContact O-N 2.92Å; Q1311-K1313 VanDerWaalsContact O-N 3.16Å; K1313-K1315 PolarHBondContact O-N 2.95Å
1314	R	33	Very low	34.4	Very low	207.2 Å²	207.2	117 Å²	117	78%	0.782	63%	0.631	S	S	*	*			trans	-61	122.6	158.4	-72.6	178.4	171.3	158	-2.5	111.8	K1312 V1316 N1347 E1348	K1312-R1314 VanDerWaalsContact C-N 3.32Å; K1312-R1314 PolarHBondContact O-N 2.95Å; R1314-V1316 VanDerWaalsContact C-N 3.34Å; R1314-V1316 PolarHBondContact O-N 2.87Å; R1314-N1347 PolarHBondContact NH1-O 2.9Å; R1314-E1348 PolarHBondContact NH1-O 2.97Å
1315	K	34	Very low	34.4	Very low	195.8 Å²	195.8	118.6 Å²	118.6	85%	0.851	62%	0.617	S	S	*	*			trans	-87.7	125.2	167.4	-76.9	-178.7	178.1	174	0	110.4	K1313	K1313-K1315 PolarHBondContact O-N 2.95Å
1316	V	32.6	Very low	34.5	Very low	122 Å²	122	116.7 Å²	116.7	74%	0.739	60%	0.599	S	S	*	*			trans	-91.8	139.7	176.1	179.7	0	0	0	0	109.7	R1297 R1314 P1318	R1297-V1316 VanDerWaalsContact NH1-CG1 3.34Å; R1314-V1316 VanDerWaalsContact C-N 3.34Å; R1314-V1316 PolarHBondContact O-N 2.87Å; V1316-P1318 VanDerWaalsContact O-CD 3.29Å; V1316-P1318 WeakPolarHBondContact O-CD 3.42Å
1317	D	32.4	Very low	34.5	Very low	102.2 Å²	102.2	112.9 Å²	112.9	55%	0.547	58%	0.576	S	S	.	*			trans	-77.5	112.8	-177.8	-172.3	-5.7	0	0	0	110.8	K1296 R1297 L1319 V1320	K1296-D1317 WeakPolarHBondContact CE-OD2 3.46Å; K1296-D1317 IonicContact NZ-OD2 3.94Å; K1296-D1317 PolarHBondContact NZ-OD2 2.67Å; R1297-D1317 WeakPolarHBondContact CD-O 3.4Å; R1297-D1317 IonicContact CZ-OD2 2.73Å; R1297-D1317 IonicContact NH1-OD2 3.67Å; R1297-D1317 PolarHBondContact NH1-OD2 2.94Å; R1297-D1317 IonicContact NH2-OD2 3.33Å; R1297-D1317 PolarHBondContact NH2-OD2 2.82Å; D1317-L1319 VanDerWaalsContact C-N 3.26Å; D1317-L1319 PolarHBondContact O-N 3.09Å; D1317-L1319 VanDerWaalsContact O-N 3.14Å; D1317-L1319 PolarHBondContact OD1-N 2.92Å; D1317-V1320 HydrophobicContact CB-CG2 3.69Å
1318	P	34.4	Very low	34.4	Very low	75.2 Å²	75.2	111.7 Å²	111.7	49%	0.488	56%	0.564	S	S	.	*			trans	-86.3	30.1	-167.1	15	-7.8	0	0	0	114	K1296 R1297 V1316 V1320	K1296-P1318 CarbonylContact C-O 3.46Å; K1296-P1318 WeakPolarHBondContact CA-O 3.34Å; R1297-P1318 HydrophobicContact CB-CB 3.92Å; R1297-P1318 HydrophobicContact CB-CG 4.29Å; R1297-P1318 WeakPolarHBondContact CB-O 3.37Å; R1297-P1318 HydrophobicContact CG-CB 4.25Å; R1297-P1318 WeakPolarHBondContact CG-O 3.29Å; R1297-P1318 PolarHBondContact N-O 3.06Å; V1316-P1318 VanDerWaalsContact O-CD 3.29Å; V1316-P1318 WeakPolarHBondContact O-CD 3.42Å; P1318-V1320 PolarHBondContact O-N 3.5Å
1319	L	32.2	Very low	34.4	Very low	79.6 Å²	79.6	109.2 Å²	109.2	42%	0.417	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	91.7	-177.3	-115.5	117.7	0	0	0	113.6	H1179 F1294 H1295 K1296 R1297 D1317 R1321 W1344 E1471	H1179-L1319 HydrophobicContact CB-CD2 3.97Å; F1294-L1319 HydrophobicContact CD1-CD1 4.19Å; F1294-L1319 HydrophobicContact CD1-CD2 4.27Å; H1295-L1319 CarbonylContact O-C 3.49Å; H1295-L1319 WeakPolarHBondContact O-CA 3.28Å; H1295-L1319 WeakPolarHBondContact O-CD2 3.43Å; K1296-L1319 HydrophobicContact CB-CD2 4.5Å; K1296-L1319 HydrophobicContact CG-CD2 3.93Å; R1297-L1319 PolarHBondContact NE-O 2.72Å; R1297-L1319 VanDerWaalsContact NE-O 3.08Å; R1297-L1319 VanDerWaalsContact NH1-CD2 3.3Å; D1317-L1319 VanDerWaalsContact C-N 3.26Å; D1317-L1319 PolarHBondContact O-N 3.09Å; D1317-L1319 VanDerWaalsContact O-N 3.14Å; D1317-L1319 PolarHBondContact OD1-N 2.92Å; L1319-R1321 PolarHBondContact O-N 2.79Å; L1319-W1344 HydrophobicContact CD1-CH2 3.82Å; L1319-W1344 HydrophobicContact CD1-CZ3 3.46Å; L1319-W1344 VanDerWaalsContact CD1-CZ3 3.46Å; L1319-E1471 HydrophobicContact CD1-CG 3.91Å
1320	V	34.6	Very low	34.1	Very low	70.2 Å²	70.2	109.3 Å²	109.3	43%	0.425	55%	0.55	S	S	.	*			trans	-98.1	117.5	172.2	-174.2	0	0	0	0	109.5	E1175 F1294 H1295 R1297 D1317 P1318 T1322	E1175-V1320 HydrophobicContact CG-CG1 4.44Å; F1294-V1320 CarbonylContact C-O 3.54Å; F1294-V1320 VanDerWaalsContact CA-O 3.29Å; F1294-V1320 WeakPolarHBondContact CA-O 3.39Å; H1295-V1320 PolarHBondContact N-O 3.13Å; H1295-V1320 PolarHBondContact O-N 3.04Å; R1297-V1320 HydrophobicContact CB-CG2 4.39Å; R1297-V1320 HydrophobicContact CG-CG2 3.98Å; R1297-V1320 VanDerWaalsContact CG-CG2 3.5Å; D1317-V1320 HydrophobicContact CB-CG2 3.69Å; P1318-V1320 PolarHBondContact O-N 3.5Å; V1320-T1322 WeakPolarHBondContact CG1-OG1 3.41Å; V1320-T1322 PolarHBondContact O-N 3.06Å
1321	R	32.8	Very low	34.1	Very low	129.8 Å²	129.8	109.9 Å²	109.9	49%	0.49	55%	0.547	S	S	.	.			trans	-90.2	105.4	170.6	-131.4	-174.4	176.6	180	-0.7	109.9	D1133 D1292 A1293 F1294 L1319 T1323	D1133-R1321 IonicContact OD1-NH1 3.58Å; D1292-R1321 IonicContact OD1-CZ 3.73Å; D1292-R1321 VanDerWaalsContact OD1-CZ 3.29Å; D1292-R1321 IonicContact OD1-NE 3.38Å; D1292-R1321 PolarHBondContact OD1-NE 3.27Å; D1292-R1321 VanDerWaalsContact OD1-NE 3.09Å; D1292-R1321 IonicContact OD1-NH2 3.72Å; D1292-R1321 PolarHBondContact OD1-NH2 2.89Å; D1292-R1321 IonicContact OD2-CZ 2.73Å; D1292-R1321 IonicContact OD2-NH1 3.25Å; D1292-R1321 PolarHBondContact OD2-NH1 2.84Å; D1292-R1321 IonicContact OD2-NH2 3.1Å; D1292-R1321 PolarHBondContact OD2-NH2 2.93Å; D1292-R1321 VanDerWaalsContact OD2-NH2 3.17Å; A1293-R1321 CarbonylContact O-C 3.52Å; A1293-R1321 WeakPolarHBondContact O-CA 3.21Å; F1294-R1321 HydrophobicContact CD1-CB 3.91Å; F1294-R1321 HydrophobicContact CD1-CG 4.02Å; F1294-R1321 HydrophobicContact CE1-CB 4.14Å; F1294-R1321 HydrophobicContact CE1-CG 3.97Å; F1294-R1321 HydrophobicContact CZ-CG 4.26Å; L1319-R1321 PolarHBondContact O-N 2.79Å; R1321-T1323 PolarHBondContact NE-OG1 3.16Å; R1321-T1323 PolarHBondContact O-N 3.12Å; R1321-T1323 VanDerWaalsContact O-N 3.09Å
1322	T	34.4	Very low	33.9	Very low	58.6 Å²	58.6	110.8 Å²	110.8	36%	0.36	55%	0.549	S	S	.	.			trans	-91.4	110.9	174.5	-42.6	0	0	0	0	109.6	D1292 A1293 V1320 I1324	D1292-T1322 WeakPolarHBondContact CA-O 3.38Å; A1293-T1322 PolarHBondContact N-O 3.12Å; A1293-T1322 PolarHBondContact O-N 3.08Å; V1320-T1322 WeakPolarHBondContact CG1-OG1 3.41Å; V1320-T1322 PolarHBondContact O-N 3.06Å; T1322-I1324 VanDerWaalsContact C-N 3.34Å; T1322-I1324 HydrophobicContact CG2-CD1 4.16Å; T1322-I1324 HydrophobicContact CG2-CG1 3.6Å; T1322-I1324 PolarHBondContact O-N 2.83Å
1323	T	32.2	Very low	33.7	Very low	51.6 Å²	51.6	110.4 Å²	110.4	32%	0.317	55%	0.55	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	110.5	172.5	-55.2	0	0	0	0	109.1	H1179 H1180 I1291 D1292 R1321 K1325 V1465 D1466	H1179-T1323 PolarHBondContact CE1-O 3.04Å; H1179-T1323 VanDerWaalsContact CE1-O 3.24Å; H1180-T1323 PolarHBondContact CE1-OG1 2.73Å; I1291-T1323 CarbonylContact O-C 3.49Å; I1291-T1323 WeakPolarHBondContact O-CA 3.33Å; D1292-T1323 WeakPolarHBondContact OD1-CG2 3.4Å; D1292-T1323 PolarHBondContact OD1-OG1 3Å; R1321-T1323 PolarHBondContact NE-OG1 3.16Å; R1321-T1323 PolarHBondContact O-N 3.12Å; R1321-T1323 VanDerWaalsContact O-N 3.09Å; T1323-K1325 HydrophobicContact CG2-CG 4.33Å; T1323-K1325 PolarHBondContact O-N 3.04Å; T1323-V1465 WeakPolarHBondContact CA-O 3.38Å; T1323-D1466 PolarHBondContact OG1-OD1 3.08Å; T1323-D1466 VanDerWaalsContact OG1-OD1 3.14Å
1324	I	36.5	Very low	33.7	Very low	46 Å²	46	107.2 Å²	107.2	24%	0.236	54%	0.542	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	111.5	-179.8	-54.1	175.6	0	0	0	108.9	I1280 Y1289 N1290 I1291 T1322 F1341 P1343 K1453 Y1463 V1465 M1467	I1280-I1324 HydrophobicContact CB-CD1 3.94Å; I1280-I1324 HydrophobicContact CG1-CD1 4.45Å; I1280-I1324 VanDerWaalsContact O-CD1 3.25Å; I1280-I1324 WeakPolarHBondContact O-CD1 3.25Å; Y1289-I1324 HydrophobicContact CD2-CG2 4.46Å; Y1289-I1324 HydrophobicContact CE2-CB 4Å; Y1289-I1324 HydrophobicContact CE2-CG2 3.76Å; N1290-I1324 CarbonylContact C-O 3.6Å; N1290-I1324 WeakPolarHBondContact CA-O 3.36Å; N1290-I1324 PolarHBondContact OD1-O 3.07Å; I1291-I1324 HydrophobicContact CB-CB 4.36Å; I1291-I1324 PolarHBondContact N-O 2.95Å; I1291-I1324 VanDerWaalsContact N-O 3.15Å; I1291-I1324 PolarHBondContact O-N 2.9Å; T1322-I1324 VanDerWaalsContact C-N 3.34Å; T1322-I1324 HydrophobicContact CG2-CD1 4.16Å; T1322-I1324 HydrophobicContact CG2-CG1 3.6Å; T1322-I1324 PolarHBondContact O-N 2.83Å; I1324-F1341 HydrophobicContact CB-CE2 4.45Å; I1324-F1341 HydrophobicContact CB-CZ 3.85Å; I1324-F1341 HydrophobicContact CG2-CE2 3.82Å; I1324-F1341 HydrophobicContact CG2-CZ 3.49Å; I1324-F1341 VanDerWaalsContact CG2-CZ 3.49Å; I1324-P1343 HydrophobicContact CD1-CB 4.3Å; I1324-K1453 HydrophobicContact CD1-CD 3.89Å; I1324-K1453 HydrophobicContact CD1-CG 4.13Å; I1324-Y1463 WeakPolarHBondContact CA-O 3.33Å; I1324-Y1463 VanDerWaalsContact CG2-O 3.28Å; I1324-Y1463 WeakPolarHBondContact CG2-O 2.98Å; I1324-V1465 HydrophobicContact CB-CB 4.46Å; I1324-V1465 PolarHBondContact N-O 2.86Å; I1324-M1467 HydrophobicContact CD1-CE 3.9Å; I1324-M1467 HydrophobicContact CD1-SD 4.19Å
1325	K	36.3	Very low	33.7	Very low	106.6 Å²	106.6	102.9 Å²	102.9	46%	0.463	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	158.8	175.3	-52.1	-179.3	176.3	167.5	0	112.9	N1262 G1263 K1264 Y1289 N1290 T1323 E1327 Y1463	N1262-K1325 WeakPolarHBondContact O-CD 3.41Å; G1263-K1325 WeakPolarHBondContact O-CE 3.45Å; K1264-K1325 HydrophobicContact CG-CD 3.76Å; Y1289-K1325 WeakPolarHBondContact O-CA 3.29Å; N1290-K1325 HydrophobicContact CB-CG 4.22Å; N1290-K1325 VanDerWaalsContact OD1-CE 3.29Å; N1290-K1325 WeakPolarHBondContact OD1-CE 3.03Å; N1290-K1325 VanDerWaalsContact OD1-CG 3.31Å; N1290-K1325 WeakPolarHBondContact OD1-CG 3.31Å; T1323-K1325 HydrophobicContact CG2-CG 4.33Å; T1323-K1325 PolarHBondContact O-N 3.04Å; K1325-E1327 WeakPolarHBondContact CD-OE1 3.31Å; K1325-E1327 IonicContact NZ-OE1 3.23Å; K1325-E1327 PolarHBondContact NZ-OE1 2.88Å; K1325-E1327 IonicContact NZ-OE2 3.29Å; K1325-E1327 PolarHBondContact NZ-OE2 2.74Å; K1325-Y1463 HydrophobicContact CB-CE1 3.84Å; K1325-Y1463 WeakPolarHBondContact O-CD1 3.38Å
1326	S	35.1	Very low	33.4	Very low	48.4 Å²	48.4	101.7 Å²	101.7	34%	0.338	54%	0.538	S	S	.	.			trans	-127.8	123.8	164.4	-159.1	0	0	0	0	108.5	K1251 A1288 Y1289 S1462 Y1463	K1251-S1326 PolarHBondContact NZ-OG 3.5Å; A1288-S1326 WeakPolarHBondContact CA-OG 3.3Å; Y1289-S1326 WeakPolarHBondContact CD1-OG 3.47Å; Y1289-S1326 VanDerWaalsContact CE1-CB 3.43Å; Y1289-S1326 PolarHBondContact N-OG 3.36Å; Y1289-S1326 PolarHBondContact O-N 3.25Å; Y1289-S1326 VanDerWaalsContact O-N 3.11Å; S1326-S1462 WeakPolarHBondContact OG-CB 3.34Å; S1326-Y1463 WeakPolarHBondContact CA-O 3.32Å
1327	E	36.7	Very low	33.2	Very low	75.6 Å²	75.6	104.8 Å²	104.8	35%	0.353	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	148.4	-178.9	-121.7	153.5	-146.1	0	0	110.6	K1264 A1288 K1325 L1329 K1364 D1461 S1462 Y1463	K1264-E1327 WeakPolarHBondContact CE-OE1 3.49Å; K1264-E1327 IonicContact NZ-OE1 3.73Å; K1264-E1327 PolarHBondContact NZ-OE1 3.05Å; A1288-E1327 HydrophobicContact CB-CB 4.06Å; K1325-E1327 WeakPolarHBondContact CD-OE1 3.31Å; K1325-E1327 IonicContact NZ-OE1 3.23Å; K1325-E1327 PolarHBondContact NZ-OE1 2.88Å; K1325-E1327 IonicContact NZ-OE2 3.29Å; K1325-E1327 PolarHBondContact NZ-OE2 2.74Å; E1327-L1329 PolarHBondContact O-N 2.86Å; E1327-L1329 VanDerWaalsContact O-N 3.08Å; E1327-K1364 IonicContact OE1-NZ 3.73Å; E1327-K1364 PolarHBondContact OE1-NZ 2.92Å; E1327-D1461 CarbonylContact C-O 3.48Å; E1327-D1461 CarbonylContact O-C 3.56Å; E1327-S1462 VanDerWaalsContact O-CA 3.27Å; E1327-S1462 WeakPolarHBondContact O-CA 3.34Å; E1327-S1462 VanDerWaalsContact O-CB 3.28Å; E1327-S1462 WeakPolarHBondContact O-CB 3.45Å; E1327-Y1463 HydrophobicContact CB-CE1 3.92Å; E1327-Y1463 PolarHBondContact OE2-OH 2.93Å
1328	T	33.6	Very low	33.1	Very low	89.8 Å²	89.8	104.6 Å²	104.6	55%	0.551	54%	0.54	S	S	*	.			trans	-93.3	109	178.1	9.6	0	0	0	0	109.7	T1330 D1461 K1605	T1328-T1330 VanDerWaalsContact C-N 3.29Å; T1328-T1330 HydrophobicContact CG2-CG2 4.49Å; T1328-T1330 PolarHBondContact O-N 3.26Å; T1328-D1461 WeakPolarHBondContact CA-O 3.38Å; T1328-K1605 PolarHBondContact OG1-NZ 2.88Å
1329	L	36.2	Very low	32.8	Very low	79.4 Å²	79.4	103.6 Å²	103.6	42%	0.416	54%	0.539	S	S	.	.			trans	-81.9	87.7	-179.3	-68.3	167.8	0	0	0	111.4	T1184 Q1186 A1288 N1290 E1327 D1331 A1339 K1364 V1460 D1461	T1184-L1329 HydrophobicContact CG2-CD1 3.85Å; T1184-L1329 HydrophobicContact CG2-CD2 4.38Å; Q1186-L1329 HydrophobicContact CB-CD2 3.76Å; A1288-L1329 HydrophobicContact CB-CD2 3.94Å; A1288-L1329 HydrophobicContact CB-CG 4.43Å; N1290-L1329 HydrophobicContact CB-CD1 4.05Å; E1327-L1329 PolarHBondContact O-N 2.86Å; E1327-L1329 VanDerWaalsContact O-N 3.08Å; L1329-D1331 PolarHBondContact O-N 3.2Å; L1329-A1339 HydrophobicContact CD2-CB 3.9Å; L1329-K1364 WeakPolarHBondContact O-CE 3.12Å; L1329-K1364 PolarHBondContact O-NZ 2.84Å; L1329-V1460 WeakPolarHBondContact CB-O 3.23Å; L1329-V1460 HydrophobicContact CD1-CB 4.12Å; L1329-V1460 HydrophobicContact CD1-CG1 4.34Å; L1329-V1460 PolarHBondContact N-O 2.96Å; L1329-D1461 PolarHBondContact N-O 3.2Å; L1329-D1461 VanDerWaalsContact N-O 3.16Å
1330	T	32.6	Very low	32.6	Very low	107 Å²	107	106.2 Å²	106.2	66%	0.656	55%	0.549	S	S	*	.			trans	-81.6	113.4	174.6	49.2	0	0	0	0	111.5	T1082 T1328 K1332	T1082-T1330 WeakPolarHBondContact CG2-O 3.42Å; T1082-T1330 WeakPolarHBondContact CG2-OG1 3.47Å; T1328-T1330 VanDerWaalsContact C-N 3.29Å; T1328-T1330 HydrophobicContact CG2-CG2 4.49Å; T1328-T1330 PolarHBondContact O-N 3.26Å; T1330-K1332 PolarHBondContact O-N 3Å
1331	D	31.7	Very low	32.3	Very low	125.6 Å²	125.6	107.5 Å²	107.5	67%	0.672	55%	0.549	S	S	*	.			trans	-88.8	135.2	175.1	-68.2	-58.7	0	0	0	112	L1329 K1364 D1459	L1329-D1331 PolarHBondContact O-N 3.2Å; D1331-K1364 IonicContact OD1-NZ 3.21Å; D1331-K1364 PolarHBondContact OD1-NZ 2.86Å; D1331-K1364 WeakPolarHBondContact OD2-CD 3.04Å; D1331-K1364 WeakPolarHBondContact OD2-CE 3.36Å; D1331-K1364 IonicContact OD2-NZ 3.61Å; D1331-K1364 PolarHBondContact OD2-NZ 3.07Å; D1331-D1459 WeakPolarHBondContact OD2-CA 3.49Å; D1331-D1459 WeakPolarHBondContact OD2-CB 3.44Å
1332	K	32.5	Very low	32.1	Very low	185.2 Å²	185.2	105 Å²	105	81%	0.805	55%	0.551	S	S	*	*			trans	-132.8	140.2	149.9	-82.5	-167.6	169.2	-157.3	0	110.9	R1080 T1330	R1080-K1332 WeakPolarHBondContact CD-O 3.27Å; R1080-K1332 PolarHBondContact NH1-O 3.3Å; T1330-K1332 PolarHBondContact O-N 3Å
1333	E	31.6	Very low	31.8	Very low	169.4 Å²	169.4	105.9 Å²	105.9	79%	0.792	56%	0.558	S	S	*	*			trans	-53.8	126.2	-177.2	-62	126.3	175.8	0	0	114.9
1334	N	32.5	Very low	31.7	Very low	126.4 Å²	126.4	112.2 Å²	112.2	68%	0.676	58%	0.576	S	S	*	*			trans	171	123.9	132.5	-158.3	7.7	0	0	0	111.8	E1336	N1334-E1336 VanDerWaalsContact C-N 3.28Å; N1334-E1336 PolarHBondContact O-N 2.77Å; N1334-E1336 PolarHBondContact OD1-N 3.14Å; N1334-E1336 VanDerWaalsContact OD1-N 3.12Å
1335	P	32.6	Very low	31.2	Very low	116.8 Å²	116.8	114.1 Å²	114.1	76%	0.758	59%	0.594	S	S	*	*			trans	-82.3	65.1	-178.6	14.2	-6.2	0	0	0	114
1336	E	28.5	Very low	30.8	Very low	170.4 Å²	170.4	113.6 Å²	113.6	80%	0.796	60%	0.604	S	S	*	*			trans	-156.9	78.2	177	-80.1	-178.9	-168.5	0	0	113.9	R1105 N1334 P1338	R1105-E1336 PolarHBondContact NH1-O 3.15Å; R1105-E1336 PolarHBondContact NH2-O 2.74Å; N1334-E1336 VanDerWaalsContact C-N 3.28Å; N1334-E1336 PolarHBondContact O-N 2.77Å; N1334-E1336 PolarHBondContact OD1-N 3.14Å; N1334-E1336 VanDerWaalsContact OD1-N 3.12Å; E1336-P1338 WeakPolarHBondContact O-CD 3.27Å
1337	R	28.9	Very low	30.4	Very low	186.8 Å²	186.8	117.5 Å²	117.5	71%	0.705	62%	0.621	S	S	*	*			trans	-140.4	129.6	164	-107.8	177.7	-174.9	-178.6	0.2	112.3	R892 R1105 R1182 T1184 N1247 A1339 F1341	R892-R1337 HydrophobicContact CB-CB 4.4Å; R1105-R1337 PolarHBondContact NH1-O 2.74Å; R1105-R1337 PolarHBondContact NH2-O 2.94Å; R1182-R1337 VanDerWaalsContact NH2-CZ 3.35Å; R1182-R1337 VanDerWaalsContact NH2-NH1 3.11Å; T1184-R1337 PolarHBondContact OG1-NH2 2.91Å; N1247-R1337 PolarHBondContact ND2-NE 3.32Å; N1247-R1337 PolarHBondContact OD1-NH2 3.13Å; R1337-A1339 PolarHBondContact O-N 2.82Å; R1337-F1341 HydrophobicContact CG-CB 4.37Å
1338	P	28.5	Very low	30	Very low	97.8 Å²	97.8	122 Å²	122	64%	0.635	64%	0.642	S	S	*	*			trans	-82.7	148.7	176.6	21.3	-17.3	0	0	0	112	R1105 E1336 E1340 F1341	R1105-P1338 VanDerWaalsContact CB-O 3.27Å; R1105-P1338 WeakPolarHBondContact CB-O 3.5Å; R1105-P1338 VanDerWaalsContact CD-O 3.23Å; R1105-P1338 WeakPolarHBondContact CD-O 3.43Å; R1105-P1338 WeakPolarHBondContact CG-O 3.27Å; E1336-P1338 WeakPolarHBondContact O-CD 3.27Å; P1338-E1340 VanDerWaalsContact C-N 3.31Å; P1338-E1340 PolarHBondContact O-N 2.75Å; P1338-E1340 VanDerWaalsContact O-N 3.12Å; P1338-F1341 HydrophobicContact CG-CE2 4.26Å; P1338-F1341 VanDerWaalsContact O-CD2 3.28Å; P1338-F1341 WeakPolarHBondContact O-CD2 3.31Å
1339	A	29.3	Very low	29.7	Very low	55.4 Å²	55.4	120.9 Å²	120.9	46%	0.458	65%	0.648	S	S	.	*			trans	-75.5	108.7	174.3	0	0	0	0	0	112.7	N891 V893 G1104 R1105 L1329 R1337 F1341	N891-A1339 CarbonylContact C-O 3.41Å; N891-A1339 WeakPolarHBondContact CA-O 3.45Å; N891-A1339 HydrophobicContact CB-CB 3.71Å; N891-A1339 WeakPolarHBondContact CB-O 3.25Å; N891-A1339 PolarHBondContact ND2-O 3.36Å; N891-A1339 CarbonylContact O-C 3.56Å; N891-A1339 WeakPolarHBondContact O-CA 3.33Å; N891-A1339 PolarHBondContact OD1-O 3.19Å; V893-A1339 HydrophobicContact CB-CB 4.38Å; V893-A1339 HydrophobicContact CG2-CB 3.95Å; V893-A1339 VanDerWaalsContact CG2-N 3.28Å; G1104-A1339 VanDerWaalsContact C-C 3.44Å; G1104-A1339 CarbonylContact O-C 3.57Å; G1104-A1339 VanDerWaalsContact O-C 3.3Å; R1105-A1339 WeakPolarHBondContact CG-O 3.4Å; R1105-A1339 PolarHBondContact N-O 2.87Å; L1329-A1339 HydrophobicContact CD2-CB 3.9Å; R1337-A1339 PolarHBondContact O-N 2.82Å; A1339-F1341 PolarHBondContact O-N 3.06Å
1340	E	27.8	Very low	29.6	Very low	133.2 Å²	133.2	122.3 Å²	122.3	62%	0.622	67%	0.665	S	S	*	*			trans	-75	109.5	-179.5	-76.7	167.5	163.4	0	0	113.7	S1101 G1104 N1106 K1251 P1338 S1342	S1101-E1340 WeakPolarHBondContact CB-OE2 3.41Å; S1101-E1340 PolarHBondContact OG-OE2 2.64Å; G1104-E1340 WeakPolarHBondContact CA-O 3.27Å; G1104-E1340 WeakPolarHBondContact O-CA 3.49Å; G1104-E1340 WeakPolarHBondContact O-CB 3.42Å; G1104-E1340 WeakPolarHBondContact O-CG 2.99Å; G1104-E1340 PolarHBondContact O-N 3.38Å; N1106-E1340 WeakPolarHBondContact CB-OE1 3.42Å; N1106-E1340 PolarHBondContact N-OE1 2.7Å; N1106-E1340 PolarHBondContact ND2-OE1 3.4Å; N1106-E1340 PolarHBondContact ND2-OE2 2.83Å; K1251-E1340 WeakPolarHBondContact CE-OE2 3.27Å; K1251-E1340 IonicContact NZ-OE1 2.61Å; K1251-E1340 PolarHBondContact NZ-OE1 2.93Å; K1251-E1340 IonicContact NZ-OE2 2.87Å; K1251-E1340 PolarHBondContact NZ-OE2 3.28Å; P1338-E1340 VanDerWaalsContact C-N 3.31Å; P1338-E1340 PolarHBondContact O-N 2.75Å; P1338-E1340 VanDerWaalsContact O-N 3.12Å; E1340-S1342 PolarHBondContact O-N 2.9Å
1341	F	28.4	Very low	30.2	Very low	97.4 Å²	97.4	122.7 Å²	122.7	43%	0.427	66%	0.659	S	S	.	*			trans	-136.7	88.7	155.7	-110.9	-83.3	0	0	0	110.2	T1025 P1088 T1090 R1182 N1247 L1249 I1324 R1337 P1338 A1339 P1343 K1453	T1025-F1341 HydrophobicContact CG2-CE1 3.46Å; T1025-F1341 VanDerWaalsContact CG2-CE1 3.46Å; T1025-F1341 HydrophobicContact CG2-CZ 3.68Å; P1088-F1341 HydrophobicContact CB-CD2 4.42Å; P1088-F1341 HydrophobicContact CB-CE2 3.52Å; P1088-F1341 HydrophobicContact CB-CZ 3.75Å; P1088-F1341 HydrophobicContact CG-CD2 4.3Å; P1088-F1341 HydrophobicContact CG-CE2 3.72Å; P1088-F1341 HydrophobicContact CG-CZ 4.45Å; T1090-F1341 HydrophobicContact CG2-CD1 4.45Å; T1090-F1341 HydrophobicContact CG2-CE1 3.73Å; T1090-F1341 HydrophobicContact CG2-CZ 4.07Å; T1090-F1341 WeakPolarHBondContact OG1-CE1 3.25Å; T1090-F1341 WeakPolarHBondContact OG1-CE2 3.21Å; T1090-F1341 WeakPolarHBondContact OG1-CZ 3.07Å; R1182-F1341 PolarHBondContact NH1-O 2.9Å; R1182-F1341 PolarHBondContact NH2-O 3.27Å; N1247-F1341 HydrophobicContact CB-CE1 4.38Å; L1249-F1341 HydrophobicContact CB-CE1 3.77Å; L1249-F1341 HydrophobicContact CB-CZ 3.72Å; L1249-F1341 HydrophobicContact CD1-CD1 3.96Å; L1249-F1341 HydrophobicContact CD1-CE1 3.5Å; L1249-F1341 HydrophobicContact CD1-CZ 4.15Å; L1249-F1341 HydrophobicContact CD2-CE1 4.01Å; L1249-F1341 HydrophobicContact CD2-CE2 4.23Å; L1249-F1341 HydrophobicContact CD2-CZ 3.79Å; L1249-F1341 HydrophobicContact CG-CE1 3.96Å; L1249-F1341 HydrophobicContact CG-CZ 4.1Å; I1324-F1341 HydrophobicContact CB-CE2 4.45Å; I1324-F1341 HydrophobicContact CB-CZ 3.85Å; I1324-F1341 HydrophobicContact CG2-CE2 3.82Å; I1324-F1341 HydrophobicContact CG2-CZ 3.49Å; I1324-F1341 VanDerWaalsContact CG2-CZ 3.49Å; R1337-F1341 HydrophobicContact CG-CB 4.37Å; P1338-F1341 HydrophobicContact CG-CE2 4.26Å; P1338-F1341 VanDerWaalsContact O-CD2 3.28Å; P1338-F1341 WeakPolarHBondContact O-CD2 3.31Å; A1339-F1341 PolarHBondContact O-N 3.06Å; F1341-P1343 HydrophobicContact CE1-CB 4.18Å; F1341-P1343 HydrophobicContact CE1-CG 4.4Å; F1341-K1453 WeakPolarHBondContact O-CE 3.15Å
1342	S	29.3	Very low	31.5	Very low	77.8 Å²	77.8	120 Å²	120	54%	0.544	65%	0.647	S	S	.	*			trans	-80.4	138.5	-179.2	-142.3	0	0	0	0	112.3	N891 R892 E1340 W1344 E1452	N891-S1342 VanDerWaalsContact CA-CB 3.48Å; N891-S1342 WeakPolarHBondContact CA-OG 3.27Å; N891-S1342 PolarHBondContact N-OG 3.17Å; R892-S1342 PolarHBondContact N-OG 3.39Å; E1340-S1342 PolarHBondContact O-N 2.9Å; S1342-W1344 VanDerWaalsContact C-N 3.35Å; S1342-W1344 PolarHBondContact O-N 2.97Å; S1342-W1344 PolarHBondContact OG-N 2.89Å; S1342-W1344 PolarHBondContact OG-O 2.69Å; S1342-E1452 PolarHBondContact OG-O 2.61Å
1343	P	27.5	Very low	33.2	Very low	78 Å²	78	112.7 Å²	112.7	51%	0.506	62%	0.617	S	S	.	*			trans	-79.4	102.5	-179.7	26.5	-24.6	0	0	0	112.6	K1022 E1135 I1324 F1341 S1345	K1022-P1343 PolarHBondContact NZ-O 3.05Å; E1135-P1343 VanDerWaalsContact OE1-O 3.08Å; I1324-P1343 HydrophobicContact CD1-CB 4.3Å; F1341-P1343 HydrophobicContact CE1-CB 4.18Å; F1341-P1343 HydrophobicContact CE1-CG 4.4Å; P1343-S1345 PolarHBondContact O-N 3.16Å
1344	W	29.9	Very low	35.4	Very low	182.8 Å²	182.8	104.7 Å²	104.7	69%	0.692	58%	0.579	S	S	*	*			trans	-98.1	102.8	173.2	-79.6	-37.2	0	0	0	110.9	L1319 S1342 S1346 L1353 V1451 M1467	L1319-W1344 HydrophobicContact CD1-CH2 3.82Å; L1319-W1344 HydrophobicContact CD1-CZ3 3.46Å; L1319-W1344 VanDerWaalsContact CD1-CZ3 3.46Å; S1342-W1344 VanDerWaalsContact C-N 3.35Å; S1342-W1344 PolarHBondContact O-N 2.97Å; S1342-W1344 PolarHBondContact OG-N 2.89Å; S1342-W1344 PolarHBondContact OG-O 2.69Å; W1344-S1346 PolarHBondContact O-N 3.04Å; W1344-L1353 HydrophobicContact CH2-CD2 3.6Å; W1344-L1353 HydrophobicContact CZ2-CD2 3.51Å; W1344-L1353 HydrophobicContact CZ3-CD2 4.29Å; W1344-V1451 VanDerWaalsContact CZ3-O 3.29Å; W1344-V1451 WeakPolarHBondContact CZ3-O 3.04Å; W1344-M1467 HydrophobicContact CH2-CE 4.27Å; W1344-M1467 HydrophobicContact CH2-SD 4.16Å
1345	S	26.1	Very low	37.7	Very low	85.4 Å²	85.4	104.4 Å²	104.4	60%	0.597	57%	0.569	S	S	*	*			trans	-94	130.6	163.7	56.3	0	0	0	0	109.3	K1022 P1343 N1347	K1022-S1345 VanDerWaalsContact CD-OG 3.27Å; K1022-S1345 WeakPolarHBondContact CD-OG 3.08Å; K1022-S1345 WeakPolarHBondContact CE-OG 3.42Å; P1343-S1345 PolarHBondContact O-N 3.16Å; S1345-N1347 PolarHBondContact O-N 3.49Å
1346	S	27.1	Very low	40.1	Very low	97.2 Å²	97.2	99.9 Å²	99.9	68%	0.68	54%	0.539	S	S	*	.			trans	-110.2	128.3	176	48.3	0	0	0	0	112.3	W1344 E1348	W1344-S1346 PolarHBondContact O-N 3.04Å; S1346-E1348 PolarHBondContact O-N 2.88Å
1347	N	26.5	Very low	42.7	Very low	130.8 Å²	130.8	91.8 Å²	91.8	70%	0.699	50%	0.501	S	S	*	.			trans	-83.3	149.2	161.1	-63.7	-7.9	0	0	0	112.5	K1140 R1314 S1345 G1349	K1140-N1347 HydrophobicContact CD-CB 4.05Å; K1140-N1347 PolarHBondContact NZ-O 2.99Å; R1314-N1347 PolarHBondContact NH1-O 2.9Å; S1345-N1347 PolarHBondContact O-N 3.49Å; N1347-G1349 PolarHBondContact O-N 3.12Å
1348	E	29.1	Very low	45.4	Very low	169.2 Å²	169.2	84.3 Å²	84.3	79%	0.791	48%	0.476	S	S	*	.			trans	19.1	116.3	167	-60.5	156.7	158.8	0	0	116.7	R943 K1140 R1314 S1346	R943-E1348 WeakPolarHBondContact CD-OE2 3.39Å; R943-E1348 IonicContact CZ-OE2 2.74Å; R943-E1348 IonicContact NE-OE2 3.62Å; R943-E1348 VanDerWaalsContact NH1-CD 3.31Å; R943-E1348 IonicContact NH1-OE1 3.9Å; R943-E1348 PolarHBondContact NH1-OE1 3Å; R943-E1348 IonicContact NH1-OE2 2.83Å; R943-E1348 PolarHBondContact NH1-OE2 2.92Å; K1140-E1348 PolarHBondContact NZ-O 2.69Å; R1314-E1348 PolarHBondContact NH1-O 2.97Å; S1346-E1348 PolarHBondContact O-N 2.88Å
1349	G	28.1	Very low	47.9	Very low	66.2 Å²	66.2	79.6 Å²	79.6	68%	0.682	45%	0.446	S	S	*	.			trans	168.8	126.9	165.7	0	0	0	0	0	111.1	N1347 Q1351	N1347-G1349 PolarHBondContact O-N 3.12Å; G1349-Q1351 PolarHBondContact O-N 2.99Å; G1349-Q1351 VanDerWaalsContact O-N 3.13Å
1350	S	32.4	Very low	50.4	Low	108.6 Å²	108.6	78.7 Å²	78.7	76%	0.759	43%	0.433	S	S	*	.			trans	-58.1	99.2	-176.8	-95.4	0	0	0	0	112.4	V1352	S1350-V1352 PolarHBondContact O-N 3.06Å; S1350-V1352 VanDerWaalsContact O-N 3.07Å
1351	Q	46.3	Very low	53	Low	116.4 Å²	116.4	72.4 Å²	72.4	54%	0.544	40%	0.403	S	S	.	.			trans	-84.5	112.2	178.3	-117.2	-176	19.7	0	0	110.5	G1349 Y1469	G1349-Q1351 PolarHBondContact O-N 2.99Å; G1349-Q1351 VanDerWaalsContact O-N 3.13Å; Q1351-Y1469 HydrophobicContact CB-CE1 4.41Å; Q1351-Y1469 HydrophobicContact CG-CE1 3.88Å; Q1351-Y1469 PolarHBondContact NE2-OH 2.63Å; Q1351-Y1469 VanDerWaalsContact NE2-OH 3.14Å
1352	V	58.2	Low	55.5	Low	67.8 Å²	67.8	68.1 Å²	68.1	41%	0.411	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-64.2	138.5	176.6	-171.6	0	0	0	0	110.3	S1350 Y1469 P1470 A1472	S1350-V1352 PolarHBondContact O-N 3.06Å; S1350-V1352 VanDerWaalsContact O-N 3.07Å; V1352-Y1469 WeakPolarHBondContact O-CD1 3.36Å; V1352-Y1469 VanDerWaalsContact O-CE1 3.32Å; V1352-Y1469 WeakPolarHBondContact O-CE1 3.33Å; V1352-P1470 HydrophobicContact CB-CG 4.5Å; V1352-P1470 HydrophobicContact CG1-CB 4.28Å; V1352-P1470 HydrophobicContact CG1-CG 3.65Å; V1352-A1472 HydrophobicContact CG2-CB 4.49Å
1353	L	69.5	Low	58	Low	33.4 Å²	33.4	65.2 Å²	65.2	18%	0.175	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-65.2	135	173.9	-134.1	113.3	0	0	0	111	W1344 R1355 M1376 M1426 L1446 N1449 V1451 P1470	W1344-L1353 HydrophobicContact CH2-CD2 3.6Å; W1344-L1353 HydrophobicContact CZ2-CD2 3.51Å; W1344-L1353 HydrophobicContact CZ3-CD2 4.29Å; L1353-R1355 PolarHBondContact O-N 2.9Å; L1353-M1376 HydrophobicContact CD1-CE 3.48Å; L1353-M1376 VanDerWaalsContact CD1-CE 3.48Å; L1353-M1376 HydrophobicContact CD2-CE 3.52Å; L1353-M1426 HydrophobicContact CD1-SD 4.08Å; L1353-M1426 HydrophobicContact CD2-CB 3.84Å; L1353-M1426 HydrophobicContact CD2-SD 4.36Å; L1353-M1426 HydrophobicContact CG-CB 4.25Å; L1353-M1426 HydrophobicContact CG-SD 4.22Å; L1353-L1446 HydrophobicContact CD1-CD1 4.13Å; L1353-L1446 HydrophobicContact CD2-CD1 3.74Å; L1353-L1446 VanDerWaalsContact CD2-CD1 3.42Å; L1353-L1446 HydrophobicContact CG-CD1 4.43Å; L1353-N1449 WeakPolarHBondContact CB-O 3.4Å; L1353-N1449 WeakPolarHBondContact CD1-O 3.35Å; L1353-N1449 WeakPolarHBondContact CG-O 3.28Å; L1353-V1451 HydrophobicContact CD1-CG2 4.24Å; L1353-V1451 HydrophobicContact CD2-CG2 4.37Å; L1353-P1470 WeakPolarHBondContact O-CD 3.43Å; L1353-P1470 VanDerWaalsContact O-CG 3.27Å; L1353-P1470 WeakPolarHBondContact O-CG 3.3Å
1354	P	77.1	Confident	60.6	Low	0.6 Å²	0.6	64.8 Å²	64.8	0%	0.004	36%	0.355	C	S	.	.	P	Polyproline II helix	trans	-68.5	135.1	176.5	27.8	-32.8	0	0	0	111.1	T1356 M1426 V1451 M1467 E1468 Y1469	P1354-T1356 VanDerWaalsContact C-N 3.31Å; P1354-T1356 PolarHBondContact O-N 2.95Å; P1354-T1356 VanDerWaalsContact O-N 3.13Å; P1354-M1426 HydrophobicContact CG-SD 4.43Å; P1354-M1426 WeakPolarHBondContact O-CB 3.39Å; P1354-V1451 HydrophobicContact CG-CB 4.11Å; P1354-V1451 HydrophobicContact CG-CG2 3.7Å; P1354-M1467 HydrophobicContact CB-CB 4.28Å; P1354-M1467 HydrophobicContact CG-SD 4.43Å; P1354-E1468 CarbonylContact C-O 3.58Å; P1354-E1468 VanDerWaalsContact C-O 3.26Å; P1354-E1468 WeakPolarHBondContact CA-O 3.36Å; P1354-E1468 WeakPolarHBondContact CB-O 3.44Å; P1354-Y1469 HydrophobicContact CB-CD1 3.96Å; P1354-Y1469 HydrophobicContact CB-CD2 4.42Å; P1354-Y1469 HydrophobicContact CB-CE1 3.89Å; P1354-Y1469 HydrophobicContact CB-CE2 4.31Å; P1354-Y1469 HydrophobicContact CB-CG 4.28Å; P1354-Y1469 HydrophobicContact CG-CE1 4.27Å
1355	R	80.6	Confident	62.7	Low	121 Å²	121	65.3 Å²	65.3	46%	0.457	36%	0.362	S	S	.	.	S	Bend	trans	-64.7	-37.9	175.8	-158.2	-169.7	-175.2	-175.2	5.8	112.2	S1170 L1353 T1425 M1426 E1468 P1470	S1170-R1355 PolarHBondContact OG-NH1 2.65Å; S1170-R1355 VanDerWaalsContact OG-NH1 3.14Å; S1170-R1355 PolarHBondContact OG-NH2 3.38Å; L1353-R1355 PolarHBondContact O-N 2.9Å; R1355-T1425 CarbonylContact O-C 3.49Å; R1355-T1425 WeakPolarHBondContact O-CA 3.37Å; R1355-T1425 WeakPolarHBondContact O-CG2 3.48Å; R1355-M1426 PolarHBondContact O-N 2.97Å; R1355-E1468 WeakPolarHBondContact CA-O 3.25Å; R1355-E1468 WeakPolarHBondContact CB-O 3.34Å; R1355-E1468 VanDerWaalsContact CD-OE1 3.29Å; R1355-E1468 WeakPolarHBondContact CD-OE1 3.39Å; R1355-E1468 IonicContact CZ-OE1 2.76Å; R1355-E1468 PolarHBondContact N-O 3.06Å; R1355-E1468 IonicContact NE-OE1 3.21Å; R1355-E1468 IonicContact NH1-OE1 2.94Å; R1355-E1468 PolarHBondContact NH1-OE1 2.98Å; R1355-P1470 HydrophobicContact CB-CG 4.24Å
1356	T	82.5	Confident	65.2	Low	22.6 Å²	22.6	68.1 Å²	68.1	14%	0.139	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	141.5	172.1	58.2	0	0	0	0	111.3	P1354 T1423 F1424 T1425 M1467 E1468	P1354-T1356 VanDerWaalsContact C-N 3.31Å; P1354-T1356 PolarHBondContact O-N 2.95Å; P1354-T1356 VanDerWaalsContact O-N 3.13Å; T1356-T1423 HydrophobicContact CG2-CG2 4.26Å; T1356-F1424 CarbonylContact C-O 3.54Å; T1356-F1424 VanDerWaalsContact CA-O 3.3Å; T1356-F1424 WeakPolarHBondContact CA-O 3.32Å; T1356-T1425 HydrophobicContact CG2-CG2 4.38Å; T1356-M1467 CarbonylContact O-C 3.57Å; T1356-M1467 WeakPolarHBondContact O-CA 3.27Å; T1356-E1468 VanDerWaalsContact CG2-OE2 3.28Å; T1356-E1468 WeakPolarHBondContact CG2-OE2 3.34Å; T1356-E1468 PolarHBondContact N-O 3.14Å; T1356-E1468 VanDerWaalsContact N-O 3.1Å; T1356-E1468 PolarHBondContact O-N 3.04Å; T1356-E1468 VanDerWaalsContact OG1-CB 3.3Å; T1356-E1468 WeakPolarHBondContact OG1-CB 3.36Å; T1356-E1468 PolarHBondContact OG1-OE2 3.16Å
1357	A	83.9	Confident	67.8	Low	0 Å²	0	64.4 Å²	64.4	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	115.3	165.4	0	0	0	0	0	108.7	T1423 F1424 M1426 D1466 M1467	A1357-T1423 WeakPolarHBondContact O-CA 3.34Å; A1357-F1424 HydrophobicContact CB-CB 4.48Å; A1357-F1424 PolarHBondContact N-O 2.79Å; A1357-F1424 WeakPolarHBondContact O-CD2 3.09Å; A1357-F1424 PolarHBondContact O-N 3.15Å; A1357-M1426 HydrophobicContact CB-CE 3.74Å; A1357-D1466 CarbonylContact C-O 3.54Å; A1357-D1466 WeakPolarHBondContact CA-O 3.31Å; A1357-M1467 HydrophobicContact CB-CG 4.28Å
1358	T	84.5	Confident	70.6	Confident	27.8 Å²	27.8	67.3 Å²	67.3	17%	0.171	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	113.2	-178.9	-62.6	0	0	0	0	110.4	L1422 T1423 V1465 D1466	T1358-L1422 CarbonylContact C-O 3.52Å; T1358-L1422 WeakPolarHBondContact CA-O 3.23Å; T1358-T1423 VanDerWaalsContact CG2-OG1 3.28Å; T1358-T1423 WeakPolarHBondContact CG2-OG1 3.38Å; T1358-T1423 WeakPolarHBondContact OG1-CB 3.32Å; T1358-T1423 VanDerWaalsContact OG1-CG2 3.28Å; T1358-T1423 WeakPolarHBondContact OG1-CG2 3.25Å; T1358-T1423 PolarHBondContact OG1-OG1 3.02Å; T1358-V1465 CarbonylContact O-C 3.28Å; T1358-V1465 WeakPolarHBondContact O-CA 3.39Å; T1358-D1466 PolarHBondContact N-O 2.94Å; T1358-D1466 PolarHBondContact O-N 2.99Å
1359	T	82	Confident	73.5	Confident	0.2 Å²	0.2	61.9 Å²	61.9	0%	0.001	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	112.8	175.7	-53.4	0	0	0	0	109.5	V1361 V1372 L1422 V1456 Y1463 S1464 V1465	T1359-V1361 HydrophobicContact CG2-CG2 3.7Å; T1359-V1372 HydrophobicContact CG2-CG1 4.44Å; T1359-V1372 HydrophobicContact CG2-CG2 4.39Å; T1359-L1422 PolarHBondContact N-O 3.18Å; T1359-L1422 WeakPolarHBondContact O-CA 3.36Å; T1359-L1422 WeakPolarHBondContact O-CB 3.31Å; T1359-L1422 PolarHBondContact O-N 3.21Å; T1359-V1456 HydrophobicContact CG2-CG2 3.56Å; T1359-V1456 VanDerWaalsContact CG2-CG2 3.5Å; T1359-Y1463 HydrophobicContact CG2-CD2 4.43Å; T1359-S1464 CarbonylContact C-O 3.52Å; T1359-S1464 VanDerWaalsContact CA-O 3.29Å; T1359-S1464 WeakPolarHBondContact CA-O 3.24Å; T1359-V1465 HydrophobicContact CG2-CG2 4.17Å
1360	N	82	Confident	76.5	Confident	36.2 Å²	36.2	58.7 Å²	58.7	19%	0.194	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	123.4	170	-59.6	-74.3	0	0	0	108.7	N1419 P1421 Y1463 S1464	N1360-N1419 WeakPolarHBondContact CB-OD1 3.47Å; N1360-P1421 WeakPolarHBondContact OD1-CB 3.14Å; N1360-P1421 WeakPolarHBondContact OD1-CG 3.27Å; N1360-Y1463 CarbonylContact O-C 3.56Å; N1360-Y1463 WeakPolarHBondContact O-CA 3.39Å; N1360-Y1463 VanDerWaalsContact O-CB 3.28Å; N1360-Y1463 WeakPolarHBondContact O-CB 3.34Å; N1360-S1464 WeakPolarHBondContact CB-OG 3Å; N1360-S1464 PolarHBondContact N-O 2.97Å; N1360-S1464 PolarHBondContact ND2-OG 3.17Å; N1360-S1464 VanDerWaalsContact ND2-OG 3.09Å; N1360-S1464 PolarHBondContact O-N 3.05Å
1361	V	82.1	Confident	79.3	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	122	-176.9	-174.8	0	0	0	0	110.7	T1359 L1363 F1370 V1372 N1419 I1420 L1422 V1456 V1460 S1462	T1359-V1361 HydrophobicContact CG2-CG2 3.7Å; V1361-L1363 HydrophobicContact CG1-CD2 3.65Å; V1361-L1363 HydrophobicContact CG1-CG 4.42Å; V1361-F1370 HydrophobicContact CG1-CD2 4.31Å; V1361-F1370 HydrophobicContact CG1-CE2 4.45Å; V1361-F1370 HydrophobicContact CG1-CG 4.46Å; V1361-F1370 HydrophobicContact CG2-CE2 4.44Å; V1361-V1372 HydrophobicContact CG2-CG2 4.39Å; V1361-N1419 CarbonylContact O-C 3.53Å; V1361-N1419 WeakPolarHBondContact O-CA 3.42Å; V1361-I1420 PolarHBondContact N-O 3.14Å; V1361-I1420 WeakPolarHBondContact O-CB 3.41Å; V1361-I1420 PolarHBondContact O-N 3.01Å; V1361-L1422 HydrophobicContact CB-CD1 4.36Å; V1361-L1422 HydrophobicContact CG2-CD1 3.65Å; V1361-L1422 HydrophobicContact CG2-CG 4.41Å; V1361-V1456 HydrophobicContact CG1-CG1 4.45Å; V1361-V1456 HydrophobicContact CG2-CG1 4.22Å; V1361-V1460 HydrophobicContact CG1-CB 4.4Å; V1361-V1460 HydrophobicContact CG1-CG1 3.91Å; V1361-V1460 HydrophobicContact CG1-CG2 3.82Å; V1361-S1462 WeakPolarHBondContact CA-O 3.34Å
1362	A	80.3	Confident	81.5	Confident	8.4 Å²	8.4	51.9 Å²	51.9	7%	0.069	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	135.4	167.2	0	0	0	0	0	109.5	K1418 V1460 D1461 S1462	A1362-K1418 VanDerWaalsContact CB-O 3.29Å; A1362-K1418 WeakPolarHBondContact CB-O 3.34Å; A1362-V1460 CarbonylContact O-C 3.56Å; A1362-V1460 WeakPolarHBondContact O-CA 3.38Å; A1362-V1460 WeakPolarHBondContact O-CG1 3.28Å; A1362-D1461 HydrophobicContact CB-CB 4.26Å; A1362-D1461 PolarHBondContact O-N 3.3Å; A1362-S1462 PolarHBondContact N-O 3Å; A1362-S1462 PolarHBondContact O-N 2.96Å
1363	L	83.3	Confident	83.1	Confident	17.6 Å²	17.6	49 Å²	49	9%	0.092	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	148.5	-175.4	-59.1	-179.6	0	0	0	112.5	V1361 A1367 F1370 L1388 L1417 I1420 D1459 V1460	V1361-L1363 HydrophobicContact CG1-CD2 3.65Å; V1361-L1363 HydrophobicContact CG1-CG 4.42Å; L1363-A1367 HydrophobicContact CB-CB 3.98Å; L1363-A1367 HydrophobicContact CD1-CB 4.36Å; L1363-A1367 HydrophobicContact CG-CB 4.49Å; L1363-F1370 HydrophobicContact CD1-CD1 3.84Å; L1363-F1370 HydrophobicContact CD1-CE1 4Å; L1363-F1370 HydrophobicContact CD2-CB 3.99Å; L1363-F1370 HydrophobicContact CD2-CD1 3.59Å; L1363-F1370 HydrophobicContact CD2-CE1 4.25Å; L1363-F1370 HydrophobicContact CD2-CG 3.89Å; L1363-F1370 HydrophobicContact CG-CD1 4.36Å; L1363-L1388 HydrophobicContact CD1-CD1 3.84Å; L1363-L1388 HydrophobicContact CD1-CD2 3.91Å; L1363-L1388 HydrophobicContact CD1-CG 4.4Å; L1363-L1417 HydrophobicContact CD1-CD2 4.16Å; L1363-L1417 PolarHBondContact N-O 2.9Å; L1363-I1420 HydrophobicContact CD1-CD1 3.64Å; L1363-I1420 HydrophobicContact CG-CD1 4.11Å; L1363-D1459 WeakPolarHBondContact CA-O 3.13Å; L1363-V1460 HydrophobicContact CD2-CB 4.45Å; L1363-V1460 HydrophobicContact CD2-CG2 3.91Å
1364	K	81	Confident	84	Confident	67.8 Å²	67.8	47.4 Å²	47.4	30%	0.295	22%	0.217	S	C	.	.			trans	-63	152.3	175.6	-71.9	176.3	-165.6	173.2	0	110.8	E1327 L1329 D1331 N1366 A1367 G1458 D1459 V1460 D1461	E1327-K1364 IonicContact OE1-NZ 3.73Å; E1327-K1364 PolarHBondContact OE1-NZ 2.92Å; L1329-K1364 WeakPolarHBondContact O-CE 3.12Å; L1329-K1364 PolarHBondContact O-NZ 2.84Å; D1331-K1364 IonicContact OD1-NZ 3.21Å; D1331-K1364 PolarHBondContact OD1-NZ 2.86Å; D1331-K1364 WeakPolarHBondContact OD2-CD 3.04Å; D1331-K1364 WeakPolarHBondContact OD2-CE 3.36Å; D1331-K1364 IonicContact OD2-NZ 3.61Å; D1331-K1364 PolarHBondContact OD2-NZ 3.07Å; K1364-N1366 PolarHBondContact O-N 2.87Å; K1364-A1367 VanDerWaalsContact O-CB 3.3Å; K1364-A1367 WeakPolarHBondContact O-CB 3.33Å; K1364-A1367 PolarHBondContact O-N 3.07Å; K1364-A1367 VanDerWaalsContact O-N 3.1Å; K1364-G1458 PolarHBondContact NZ-O 2.83Å; K1364-G1458 VanDerWaalsContact NZ-O 3.11Å; K1364-D1459 PolarHBondContact N-O 2.88Å; K1364-D1459 VanDerWaalsContact NZ-CA 3.34Å; K1364-V1460 VanDerWaalsContact CE-O 3.25Å; K1364-V1460 WeakPolarHBondContact CE-O 3.28Å; K1364-D1461 HydrophobicContact CG-CB 4.24Å
1365	K	74.3	Confident	84.6	Confident	194.8 Å²	194.8	50.6 Å²	50.6	85%	0.847	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	126	170	-172	-178.4	178.7	-173	0	108.4	A1367	K1365-A1367 VanDerWaalsContact C-N 3.34Å; K1365-A1367 PolarHBondContact O-N 3.13Å
1366	N	78.3	Confident	84.8	Confident	143.6 Å²	143.6	44.9 Å²	44.9	77%	0.768	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.9	24.6	-175.9	-50.9	-19.1	0	0	0	116	K1364	K1364-N1366 PolarHBondContact O-N 2.87Å
1367	A	81.2	Confident	84.3	Confident	19.2 Å²	19.2	44.2 Å²	44.2	16%	0.159	21%	0.207	C	C	.	.			trans	-47.9	142	170.8	0	0	0	0	0	113.4	L1363 K1364 K1365 L1388 D1459	L1363-A1367 HydrophobicContact CB-CB 3.98Å; L1363-A1367 HydrophobicContact CD1-CB 4.36Å; L1363-A1367 HydrophobicContact CG-CB 4.49Å; K1364-A1367 VanDerWaalsContact O-CB 3.3Å; K1364-A1367 WeakPolarHBondContact O-CB 3.33Å; K1364-A1367 PolarHBondContact O-N 3.07Å; K1364-A1367 VanDerWaalsContact O-N 3.1Å; K1365-A1367 VanDerWaalsContact C-N 3.34Å; K1365-A1367 PolarHBondContact O-N 3.13Å; A1367-L1388 HydrophobicContact CB-CD1 3.79Å; A1367-L1388 VanDerWaalsContact O-CD1 3.23Å; A1367-L1388 WeakPolarHBondContact O-CD1 3.23Å; A1367-D1459 HydrophobicContact CB-CB 3.49Å; A1367-D1459 VanDerWaalsContact CB-CB 3.45Å; A1367-D1459 WeakPolarHBondContact CB-O 3.46Å
1368	R	85.3	Confident	83.7	Confident	191.2 Å²	191.2	49.5 Å²	49.5	72%	0.722	24%	0.241	S	C	*	.			trans	-107.6	-37.6	177.5	-59.1	179.8	177.4	-169.7	-0.4	111.5	L1388 D1459	R1368-L1388 PolarHBondContact O-N 3.11Å; R1368-D1459 VanDerWaalsContact CA-OD2 3.29Å; R1368-D1459 WeakPolarHBondContact CA-OD2 3.23Å; R1368-D1459 WeakPolarHBondContact CB-OD2 3.36Å; R1368-D1459 PolarHBondContact N-OD2 2.84Å
1369	N	89.9	Confident	83.4	Confident	56 Å²	56	54.6 Å²	54.6	30%	0.299	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	161.9	-178	77.5	100	0	0	0	112.5	A1386 P1387 D1459	N1369-A1386 CarbonylContact C-O 3.56Å; N1369-A1386 WeakPolarHBondContact CA-O 3.39Å; N1369-P1387 HydrophobicContact CB-CB 4.48Å; N1369-D1459 PolarHBondContact N-OD2 3.24Å; N1369-D1459 PolarHBondContact ND2-OD1 3.41Å; N1369-D1459 PolarHBondContact ND2-OD2 3.17Å; N1369-D1459 WeakPolarHBondContact O-CA 3.24Å; N1369-D1459 VanDerWaalsContact O-CB 3.31Å; N1369-D1459 WeakPolarHBondContact O-CB 3.29Å; N1369-D1459 PolarHBondContact O-N 2.97Å; N1369-D1459 VanDerWaalsContact O-OD2 3.04Å
1370	F	91.2	Very high	83.5	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	171.2	158	70.6	-87.5	0	0	0	110.9	V1361 L1363 V1372 A1386 L1388 W1392 I1420 L1422 N1457 V1460	V1361-F1370 HydrophobicContact CG1-CD2 4.31Å; V1361-F1370 HydrophobicContact CG1-CE2 4.45Å; V1361-F1370 HydrophobicContact CG1-CG 4.46Å; V1361-F1370 HydrophobicContact CG2-CE2 4.44Å; L1363-F1370 HydrophobicContact CD1-CD1 3.84Å; L1363-F1370 HydrophobicContact CD1-CE1 4Å; L1363-F1370 HydrophobicContact CD2-CB 3.99Å; L1363-F1370 HydrophobicContact CD2-CD1 3.59Å; L1363-F1370 HydrophobicContact CD2-CE1 4.25Å; L1363-F1370 HydrophobicContact CD2-CG 3.89Å; L1363-F1370 HydrophobicContact CG-CD1 4.36Å; F1370-V1372 HydrophobicContact CD2-CG2 4.19Å; F1370-V1372 HydrophobicContact CE2-CG2 4.08Å; F1370-A1386 HydrophobicContact CD1-CB 3.71Å; F1370-A1386 HydrophobicContact CD2-CB 3.97Å; F1370-A1386 HydrophobicContact CE1-CB 3.44Å; F1370-A1386 VanDerWaalsContact CE1-CB 3.44Å; F1370-A1386 HydrophobicContact CE2-CB 3.69Å; F1370-A1386 HydrophobicContact CG-CB 3.97Å; F1370-A1386 HydrophobicContact CZ-CB 3.43Å; F1370-A1386 VanDerWaalsContact CZ-CB 3.46Å; F1370-A1386 PolarHBondContact N-O 3.15Å; F1370-A1386 VanDerWaalsContact N-O 3.09Å; F1370-A1386 CarbonylContact O-C 3.56Å; F1370-A1386 WeakPolarHBondContact O-CA 3.42Å; F1370-A1386 WeakPolarHBondContact O-CB 3.41Å; F1370-A1386 PolarHBondContact O-N 3.09Å; F1370-L1388 HydrophobicContact CD1-CD2 4.22Å; F1370-L1388 HydrophobicContact CE1-CD2 4.16Å; F1370-W1392 AromaticContact CE1-CH2 3.65Å; F1370-W1392 HydrophobicContact CE1-CH2 3.65Å; F1370-W1392 AromaticContact CE1-CZ2 3.65Å; F1370-W1392 HydrophobicContact CE1-CZ2 3.65Å; F1370-W1392 HydrophobicContact CE1-CZ3 4.45Å; F1370-W1392 AromaticContact CZ-CH2 3.42Å; F1370-W1392 HydrophobicContact CZ-CH2 3.42Å; F1370-W1392 VanDerWaalsContact CZ-CH2 3.43Å; F1370-W1392 AromaticContact CZ-CZ2 3.89Å; F1370-W1392 HydrophobicContact CZ-CZ2 3.89Å; F1370-W1392 AromaticContact CZ-CZ3 3.85Å; F1370-W1392 HydrophobicContact CZ-CZ3 3.85Å; F1370-I1420 HydrophobicContact CE1-CD1 4.21Å; F1370-I1420 HydrophobicContact CZ-CD1 4.45Å; F1370-L1422 HydrophobicContact CE2-CD1 3.57Å; F1370-L1422 HydrophobicContact CZ-CD1 3.94Å; F1370-L1422 HydrophobicContact CZ-CD2 4.47Å; F1370-N1457 CarbonylContact C-O 3.56Å; F1370-N1457 VanDerWaalsContact CA-O 3.29Å; F1370-N1457 WeakPolarHBondContact CA-O 3.43Å; F1370-N1457 WeakPolarHBondContact CB-O 3.41Å; F1370-V1460 HydrophobicContact CB-CG2 3.6Å; F1370-V1460 HydrophobicContact CG-CG2 4.35Å
1371	R	92	Very high	83.8	Confident	82.4 Å²	82.4	53.7 Å²	53.7	31%	0.311	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	141.4	179	-168.2	177.8	99.4	-141.5	-0.7	110.6	D1373 R1383 L1384 H1385 V1456 N1457	R1371-D1373 WeakPolarHBondContact CD-OD1 3.2Å; R1371-D1373 WeakPolarHBondContact CG-OD1 3.38Å; R1371-D1373 IonicContact CZ-OD1 2.68Å; R1371-D1373 IonicContact CZ-OD2 3.07Å; R1371-D1373 VanDerWaalsContact CZ-OD2 3.27Å; R1371-D1373 VanDerWaalsContact NE-CG 3.29Å; R1371-D1373 IonicContact NE-OD1 3.13Å; R1371-D1373 PolarHBondContact NE-OD1 2.89Å; R1371-D1373 IonicContact NE-OD2 2.77Å; R1371-D1373 PolarHBondContact NE-OD2 2.81Å; R1371-D1373 VanDerWaalsContact NE-OD2 3.16Å; R1371-D1373 IonicContact NH2-OD1 3.37Å; R1371-D1373 IonicContact NH2-OD2 3.13Å; R1371-D1373 PolarHBondContact NH2-OD2 3.03Å; R1371-R1383 HydrophobicContact CG-CG 4.22Å; R1371-L1384 CarbonylContact C-O 3.52Å; R1371-L1384 VanDerWaalsContact CA-O 3.27Å; R1371-L1384 WeakPolarHBondContact CA-O 3.19Å; R1371-L1384 VanDerWaalsContact CG-O 3.27Å; R1371-L1384 WeakPolarHBondContact CG-O 3.43Å; R1371-H1385 HydrophobicContact CG-CB 4.37Å; R1371-V1456 CarbonylContact O-C 3.53Å; R1371-V1456 VanDerWaalsContact O-CA 3.27Å; R1371-V1456 WeakPolarHBondContact O-CA 3.32Å; R1371-N1457 HydrophobicContact CB-CB 4.38Å; R1371-N1457 PolarHBondContact N-O 3.1Å; R1371-N1457 PolarHBondContact NH2-ND2 2.8Å; R1371-N1457 VanDerWaalsContact NH2-ND2 3.17Å; R1371-N1457 PolarHBondContact O-N 3.22Å
1372	V	92	Very high	84.2	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	117.6	170	-175.5	0	0	0	0	108.5	T1359 V1361 F1370 V1374 R1383 L1384 L1422 F1424 V1454 D1455 V1456	T1359-V1372 HydrophobicContact CG2-CG1 4.44Å; T1359-V1372 HydrophobicContact CG2-CG2 4.39Å; V1361-V1372 HydrophobicContact CG2-CG2 4.39Å; F1370-V1372 HydrophobicContact CD2-CG2 4.19Å; F1370-V1372 HydrophobicContact CE2-CG2 4.08Å; V1372-V1374 HydrophobicContact CG1-CG2 4.34Å; V1372-R1383 CarbonylContact O-C 3.49Å; V1372-R1383 WeakPolarHBondContact O-CA 3.32Å; V1372-L1384 HydrophobicContact CB-CB 4.28Å; V1372-L1384 HydrophobicContact CB-CD2 4.44Å; V1372-L1384 HydrophobicContact CG2-CD2 4.4Å; V1372-L1384 PolarHBondContact N-O 2.87Å; V1372-L1384 PolarHBondContact O-N 3.1Å; V1372-L1422 HydrophobicContact CG2-CD1 3.9Å; V1372-F1424 HydrophobicContact CB-CZ 4.39Å; V1372-F1424 HydrophobicContact CG1-CE2 4.05Å; V1372-F1424 HydrophobicContact CG1-CZ 4.22Å; V1372-V1454 HydrophobicContact CG1-CG1 3.81Å; V1372-D1455 CarbonylContact C-O 3.5Å; V1372-D1455 VanDerWaalsContact CA-O 3.24Å; V1372-D1455 WeakPolarHBondContact CA-O 3.29Å; V1372-V1456 HydrophobicContact CG1-CG2 4.27Å; V1372-V1456 HydrophobicContact CG2-CG1 4.38Å; V1372-V1456 HydrophobicContact CG2-CG2 4.23Å
1373	D	91.5	Very high	84.9	Confident	5.8 Å²	5.8	55.8 Å²	55.8	3%	0.031	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	111.8	176.4	-75.4	-3.9	0	0	0	108.9	R1371 K1375 T1381 R1383 V1454 D1455	R1371-D1373 WeakPolarHBondContact CD-OD1 3.2Å; R1371-D1373 WeakPolarHBondContact CG-OD1 3.38Å; R1371-D1373 IonicContact CZ-OD1 2.68Å; R1371-D1373 IonicContact CZ-OD2 3.07Å; R1371-D1373 VanDerWaalsContact CZ-OD2 3.27Å; R1371-D1373 VanDerWaalsContact NE-CG 3.29Å; R1371-D1373 IonicContact NE-OD1 3.13Å; R1371-D1373 PolarHBondContact NE-OD1 2.89Å; R1371-D1373 IonicContact NE-OD2 2.77Å; R1371-D1373 PolarHBondContact NE-OD2 2.81Å; R1371-D1373 VanDerWaalsContact NE-OD2 3.16Å; R1371-D1373 IonicContact NH2-OD1 3.37Å; R1371-D1373 IonicContact NH2-OD2 3.13Å; R1371-D1373 PolarHBondContact NH2-OD2 3.03Å; D1373-K1375 PolarHBondContact O-N 2.8Å; D1373-T1381 HydrophobicContact CB-CG2 3.81Å; D1373-R1383 VanDerWaalsContact OD1-CG 3.29Å; D1373-R1383 WeakPolarHBondContact OD1-CG 3.32Å; D1373-R1383 IonicContact OD1-CZ 3.33Å; D1373-R1383 IonicContact OD1-NE 3.35Å; D1373-R1383 PolarHBondContact OD1-NE 3.18Å; D1373-R1383 IonicContact OD1-NH2 3.42Å; D1373-R1383 PolarHBondContact OD1-NH2 2.77Å; D1373-R1383 IonicContact OD2-CZ 2.64Å; D1373-R1383 IonicContact OD2-NE 3.21Å; D1373-R1383 PolarHBondContact OD2-NE 2.71Å; D1373-R1383 IonicContact OD2-NH2 3.32Å; D1373-R1383 PolarHBondContact OD2-NH2 2.91Å; D1373-V1454 CarbonylContact O-C 3.59Å; D1373-V1454 WeakPolarHBondContact O-CA 3.4Å; D1373-D1455 HydrophobicContact CB-CB 4.26Å; D1373-D1455 PolarHBondContact N-O 2.97Å; D1373-D1455 PolarHBondContact O-N 3.04Å
1374	V	90	Very high	85.3	Confident	0 Å²	0	55 Å²	55	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	108	170.8	-175.7	0	0	0	0	108.2	V1372 M1376 T1381 L1382 F1424 M1426 V1451 K1453 V1454	V1372-V1374 HydrophobicContact CG1-CG2 4.34Å; V1374-M1376 HydrophobicContact CB-CE 4.1Å; V1374-M1376 HydrophobicContact CB-CG 4.44Å; V1374-M1376 HydrophobicContact CG1-CE 3.51Å; V1374-M1376 VanDerWaalsContact CG1-CE 3.46Å; V1374-M1376 HydrophobicContact CG1-CG 3.94Å; V1374-M1376 HydrophobicContact CG1-SD 4.27Å; V1374-T1381 CarbonylContact O-C 3.51Å; V1374-T1381 WeakPolarHBondContact O-CA 3.3Å; V1374-T1381 WeakPolarHBondContact O-CG2 3.34Å; V1374-L1382 HydrophobicContact CB-CB 4.24Å; V1374-L1382 HydrophobicContact CB-CD2 4.37Å; V1374-L1382 HydrophobicContact CG2-CD2 4.42Å; V1374-L1382 PolarHBondContact N-O 2.84Å; V1374-L1382 WeakPolarHBondContact O-CA 3.38Å; V1374-L1382 PolarHBondContact O-N 2.83Å; V1374-F1424 HydrophobicContact CG2-CD2 4.22Å; V1374-F1424 HydrophobicContact CG2-CE1 4.37Å; V1374-F1424 HydrophobicContact CG2-CE2 4.14Å; V1374-F1424 HydrophobicContact CG2-CG 4.45Å; V1374-F1424 HydrophobicContact CG2-CZ 4.27Å; V1374-M1426 HydrophobicContact CG1-CE 4.12Å; V1374-V1451 HydrophobicContact CG1-CB 4.46Å; V1374-V1451 HydrophobicContact CG1-CG1 3.82Å; V1374-V1451 HydrophobicContact CG1-CG2 3.98Å; V1374-K1453 CarbonylContact C-O 3.54Å; V1374-K1453 WeakPolarHBondContact CA-O 3.48Å; V1374-V1454 HydrophobicContact CB-CG2 4.44Å; V1374-V1454 HydrophobicContact CG1-CG2 4.18Å; V1374-V1454 HydrophobicContact CG2-CG1 4.33Å; V1374-V1454 HydrophobicContact CG2-CG2 4.18Å
1375	K	88.2	Confident	85.9	Confident	67.6 Å²	67.6	55.3 Å²	55.3	29%	0.294	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	126.9	175.2	-81	-86.4	176.1	-169.2	0	109.3	D1373 G1377 T1381 V1451 E1452 K1453	D1373-K1375 PolarHBondContact O-N 2.8Å; K1375-G1377 WeakPolarHBondContact CE-O 2.99Å; K1375-G1377 WeakPolarHBondContact CG-O 3.4Å; K1375-T1381 HydrophobicContact CD-CG2 3.98Å; K1375-T1381 VanDerWaalsContact CD-OG1 3.29Å; K1375-T1381 WeakPolarHBondContact CD-OG1 3.32Å; K1375-T1381 WeakPolarHBondContact CE-OG1 3.49Å; K1375-T1381 PolarHBondContact NZ-OG1 2.97Å; K1375-V1451 CarbonylContact O-C 3.56Å; K1375-V1451 WeakPolarHBondContact O-CA 3.29Å; K1375-E1452 HydrophobicContact CB-CB 4.26Å; K1375-E1452 PolarHBondContact O-N 3.22Å; K1375-K1453 HydrophobicContact CB-CB 4.02Å; K1375-K1453 WeakPolarHBondContact CB-O 3.39Å; K1375-K1453 HydrophobicContact CG-CB 4.19Å; K1375-K1453 PolarHBondContact N-O 3.22Å; K1375-K1453 PolarHBondContact O-N 2.83Å
1376	M	84.3	Confident	86.7	Confident	1.4 Å²	1.4	46 Å²	46	1%	0.007	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	18.3	-170.4	-62.2	-169.3	110.8	0	0	114	L1353 V1374 A1380 L1382 M1426 L1446 P1447 G1448 R1450 V1451	L1353-M1376 HydrophobicContact CD1-CE 3.48Å; L1353-M1376 VanDerWaalsContact CD1-CE 3.48Å; L1353-M1376 HydrophobicContact CD2-CE 3.52Å; V1374-M1376 HydrophobicContact CB-CE 4.1Å; V1374-M1376 HydrophobicContact CB-CG 4.44Å; V1374-M1376 HydrophobicContact CG1-CE 3.51Å; V1374-M1376 VanDerWaalsContact CG1-CE 3.46Å; V1374-M1376 HydrophobicContact CG1-CG 3.94Å; V1374-M1376 HydrophobicContact CG1-SD 4.27Å; M1376-A1380 HydrophobicContact CB-CB 4.26Å; M1376-A1380 PolarHBondContact N-O 2.79Å; M1376-L1382 HydrophobicContact CE-CB 4.04Å; M1376-L1382 HydrophobicContact CE-CD2 3.83Å; M1376-L1382 HydrophobicContact SD-CB 4.04Å; M1376-L1382 HydrophobicContact SD-CD2 4.36Å; M1376-M1426 HydrophobicContact CE-CE 3.51Å; M1376-M1426 HydrophobicContact CE-SD 3.8Å; M1376-M1426 WeakPolarHBondContact CE-SD 3.12Å; M1376-M1426 HydrophobicContact SD-SD 4.45Å; M1376-L1446 HydrophobicContact CE-CB 4.42Å; M1376-L1446 HydrophobicContact CE-CD1 4.25Å; M1376-L1446 HydrophobicContact CE-CD2 3.88Å; M1376-L1446 HydrophobicContact CE-CG 4.39Å; M1376-L1446 HydrophobicContact SD-CB 4.37Å; M1376-L1446 HydrophobicContact SD-CD2 3.98Å; M1376-P1447 HydrophobicContact CB-CG 4.38Å; M1376-P1447 HydrophobicContact CG-CG 4.4Å; M1376-P1447 HydrophobicContact SD-CG 3.97Å; M1376-G1448 VanDerWaalsContact CE-O 3.31Å; M1376-G1448 WeakPolarHBondContact CE-O 3.4Å; M1376-G1448 WeakPolarHBondContact O-CA 3.37Å; M1376-R1450 CarbonylContact C-O 3.46Å; M1376-R1450 WeakPolarHBondContact CA-O 3.29Å; M1376-R1450 VanDerWaalsContact CB-O 3.25Å; M1376-R1450 WeakPolarHBondContact CB-O 3.3Å; M1376-R1450 VanDerWaalsContact CE-O 3.29Å; M1376-R1450 WeakPolarHBondContact CE-O 3.31Å; M1376-R1450 VanDerWaalsContact CG-O 3.31Å; M1376-R1450 WeakPolarHBondContact CG-O 3.49Å; M1376-V1451 HydrophobicContact CE-CG2 3.96Å; M1376-V1451 HydrophobicContact CG-CG2 4.25Å
1377	G	73.3	Confident	87.2	Confident	7.8 Å²	7.8	40.3 Å²	40.3	8%	0.08	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	151	161.8	-170.6	0	0	0	0	0	109.4	K1375 R1379 A1380 E1452	K1375-G1377 WeakPolarHBondContact CE-O 2.99Å; K1375-G1377 WeakPolarHBondContact CG-O 3.4Å; G1377-R1379 PolarHBondContact O-N 3.09Å; G1377-R1379 VanDerWaalsContact O-N 3.11Å; G1377-A1380 PolarHBondContact O-N 2.9Å; G1377-E1452 VanDerWaalsContact C-CD 3.44Å; G1377-E1452 VanDerWaalsContact C-OE2 3.31Å; G1377-E1452 VanDerWaalsContact CA-CD 3.42Å; G1377-E1452 VanDerWaalsContact CA-OE1 3.26Å; G1377-E1452 WeakPolarHBondContact CA-OE1 3.31Å; G1377-E1452 VanDerWaalsContact CA-OE2 3.29Å; G1377-E1452 WeakPolarHBondContact CA-OE2 3.37Å; G1377-E1452 PolarHBondContact N-OE2 2.88Å; G1377-E1452 VanDerWaalsContact N-OE2 3.13Å
1378	P	70.8	Confident	87.3	Confident	111.4 Å²	111.4	41.7 Å²	41.7	72%	0.723	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-27.6	-174.5	2.2	-6.4	0	0	0	113.7	E1452	P1378-E1452 VanDerWaalsContact CD-OE1 3.27Å; P1378-E1452 WeakPolarHBondContact CD-OE1 3.37Å
1379	R	78.1	Confident	87.2	Confident	134.2 Å²	134.2	43.7 Å²	43.7	51%	0.506	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.7	4.1	-179.3	-63.7	170.3	85.1	135.3	-5.4	113.8	T1090 T1092 G1377 I1398 D1399	T1090-R1379 PolarHBondContact OG1-NH2 2.84Å; T1092-R1379 PolarHBondContact OG1-NH1 2.86Å; T1092-R1379 PolarHBondContact OG1-NH2 2.93Å; G1377-R1379 PolarHBondContact O-N 3.09Å; G1377-R1379 VanDerWaalsContact O-N 3.11Å; R1379-I1398 CarbonylContact O-C 3.45Å; R1379-I1398 WeakPolarHBondContact O-CA 3.42Å; R1379-D1399 VanDerWaalsContact CB-OD1 3.31Å; R1379-D1399 WeakPolarHBondContact CB-OD1 3.33Å; R1379-D1399 WeakPolarHBondContact CD-OD1 3.43Å; R1379-D1399 VanDerWaalsContact CG-OD1 3.31Å; R1379-D1399 WeakPolarHBondContact CG-OD1 3.48Å; R1379-D1399 IonicContact CZ-OD1 3.21Å; R1379-D1399 IonicContact CZ-OD2 3.02Å; R1379-D1399 VanDerWaalsContact CZ-OD2 3.31Å; R1379-D1399 IonicContact NE-OD1 3.59Å; R1379-D1399 PolarHBondContact NE-OD1 3.2Å; R1379-D1399 IonicContact NE-OD2 2.94Å; R1379-D1399 PolarHBondContact NE-OD2 3.02Å; R1379-D1399 VanDerWaalsContact NE-OD2 3.17Å; R1379-D1399 IonicContact NH1-OD1 3.62Å; R1379-D1399 VanDerWaalsContact NH2-CG 3.33Å; R1379-D1399 IonicContact NH2-OD1 3.15Å; R1379-D1399 PolarHBondContact NH2-OD1 2.65Å; R1379-D1399 IonicContact NH2-OD2 2.95Å; R1379-D1399 PolarHBondContact NH2-OD2 3.05Å; R1379-D1399 PolarHBondContact O-N 2.99Å
1380	A	83.4	Confident	86.9	Confident	8 Å²	8	50.2 Å²	50.2	7%	0.066	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	125.3	-169.8	0	0	0	0	0	112.3	M1376 G1377 I1397 P1447	M1376-A1380 HydrophobicContact CB-CB 4.26Å; M1376-A1380 PolarHBondContact N-O 2.79Å; G1377-A1380 PolarHBondContact O-N 2.9Å; A1380-I1397 CarbonylContact C-O 3.55Å; A1380-I1397 WeakPolarHBondContact CA-O 3.28Å; A1380-P1447 HydrophobicContact CB-CB 3.99Å; A1380-P1447 HydrophobicContact CB-CG 4.36Å; A1380-P1447 VanDerWaalsContact CB-O 3.31Å; A1380-P1447 WeakPolarHBondContact CB-O 3.39Å
1381	T	89	Confident	86.7	Confident	9.6 Å²	9.6	53 Å²	53	6%	0.059	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	125.8	177.1	-47.1	0	0	0	0	112.2	D1373 V1374 K1375 R1383 I1397 P1447	D1373-T1381 HydrophobicContact CB-CG2 3.81Å; V1374-T1381 CarbonylContact O-C 3.51Å; V1374-T1381 WeakPolarHBondContact O-CA 3.3Å; V1374-T1381 WeakPolarHBondContact O-CG2 3.34Å; K1375-T1381 HydrophobicContact CD-CG2 3.98Å; K1375-T1381 VanDerWaalsContact CD-OG1 3.29Å; K1375-T1381 WeakPolarHBondContact CD-OG1 3.32Å; K1375-T1381 WeakPolarHBondContact CE-OG1 3.49Å; K1375-T1381 PolarHBondContact NZ-OG1 2.97Å; T1381-R1383 PolarHBondContact O-N 2.89Å; T1381-R1383 VanDerWaalsContact O-N 3.15Å; T1381-I1397 HydrophobicContact CG2-CD1 4.32Å; T1381-I1397 PolarHBondContact N-O 3.02Å; T1381-I1397 WeakPolarHBondContact O-CB 3.4Å; T1381-I1397 PolarHBondContact O-N 2.94Å; T1381-P1447 VanDerWaalsContact C-CG 3.44Å
1382	L	91.9	Very high	86.6	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	104.3	165.8	176.5	80.6	0	0	0	109.5	V1374 M1376 L1394 S1395 F1424 A1431 F1444 L1446 P1447	V1374-L1382 HydrophobicContact CB-CB 4.24Å; V1374-L1382 HydrophobicContact CB-CD2 4.37Å; V1374-L1382 HydrophobicContact CG2-CD2 4.42Å; V1374-L1382 PolarHBondContact N-O 2.84Å; V1374-L1382 WeakPolarHBondContact O-CA 3.38Å; V1374-L1382 PolarHBondContact O-N 2.83Å; M1376-L1382 HydrophobicContact CE-CB 4.04Å; M1376-L1382 HydrophobicContact CE-CD2 3.83Å; M1376-L1382 HydrophobicContact SD-CB 4.04Å; M1376-L1382 HydrophobicContact SD-CD2 4.36Å; L1382-L1394 HydrophobicContact CD1-CD1 3.73Å; L1382-L1394 HydrophobicContact CD1-CD2 4.32Å; L1382-L1394 HydrophobicContact CD1-CG 3.99Å; L1382-L1394 HydrophobicContact CD2-CD1 4.43Å; L1382-L1394 HydrophobicContact CG-CD1 3.96Å; L1382-S1395 WeakPolarHBondContact CD1-O 3.15Å; L1382-F1424 HydrophobicContact CD2-CD1 3.89Å; L1382-F1424 HydrophobicContact CD2-CE1 4.18Å; L1382-A1431 HydrophobicContact CD1-CB 3.88Å; L1382-A1431 HydrophobicContact CD2-CB 3.77Å; L1382-F1444 HydrophobicContact CD1-CD1 3.52Å; L1382-F1444 HydrophobicContact CD1-CE1 3.5Å; L1382-F1444 VanDerWaalsContact CD1-CE1 3.45Å; L1382-F1444 HydrophobicContact CD1-CG 4.35Å; L1382-F1444 HydrophobicContact CD1-CZ 4.48Å; L1382-L1446 HydrophobicContact CD2-CD2 4.28Å; L1382-P1447 HydrophobicContact CB-CG 3.78Å; L1382-P1447 VanDerWaalsContact N-CG 3.34Å
1383	R	93.3	Very high	86.5	Confident	53.2 Å²	53.2	50.2 Å²	50.2	20%	0.201	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	122.2	-175.5	170.6	168.2	-69.2	159.2	3.3	111.3	R1371 V1372 D1373 T1381 H1385 L1394 S1395 I1397 E1402	R1371-R1383 HydrophobicContact CG-CG 4.22Å; V1372-R1383 CarbonylContact O-C 3.49Å; V1372-R1383 WeakPolarHBondContact O-CA 3.32Å; D1373-R1383 VanDerWaalsContact OD1-CG 3.29Å; D1373-R1383 WeakPolarHBondContact OD1-CG 3.32Å; D1373-R1383 IonicContact OD1-CZ 3.33Å; D1373-R1383 IonicContact OD1-NE 3.35Å; D1373-R1383 PolarHBondContact OD1-NE 3.18Å; D1373-R1383 IonicContact OD1-NH2 3.42Å; D1373-R1383 PolarHBondContact OD1-NH2 2.77Å; D1373-R1383 IonicContact OD2-CZ 2.64Å; D1373-R1383 IonicContact OD2-NE 3.21Å; D1373-R1383 PolarHBondContact OD2-NE 2.71Å; D1373-R1383 IonicContact OD2-NH2 3.32Å; D1373-R1383 PolarHBondContact OD2-NH2 2.91Å; T1381-R1383 PolarHBondContact O-N 2.89Å; T1381-R1383 VanDerWaalsContact O-N 3.15Å; R1383-H1385 HydrophobicContact CG-CB 4.45Å; R1383-L1394 CarbonylContact O-C 3.58Å; R1383-L1394 VanDerWaalsContact O-CA 3.31Å; R1383-L1394 WeakPolarHBondContact O-CA 3.35Å; R1383-S1395 PolarHBondContact N-O 3.12Å; R1383-S1395 VanDerWaalsContact N-O 3.11Å; R1383-S1395 PolarHBondContact O-N 2.88Å; R1383-I1397 HydrophobicContact CB-CD1 3.91Å; R1383-I1397 HydrophobicContact CB-CG1 4.49Å; R1383-I1397 HydrophobicContact CG-CD1 4.45Å; R1383-I1397 VanDerWaalsContact CZ-CD1 3.45Å; R1383-I1397 VanDerWaalsContact NH1-CD1 3.32Å; R1383-E1402 IonicContact NH1-OE2 3.61Å; R1383-E1402 PolarHBondContact NH1-OE2 2.87Å
1384	L	93.3	Very high	86.6	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	117	161.4	175.2	63.8	0	0	0	108.9	R1371 V1372 W1392 T1393 L1394 F1408 L1422 F1424 L1433	R1371-L1384 CarbonylContact C-O 3.52Å; R1371-L1384 VanDerWaalsContact CA-O 3.27Å; R1371-L1384 WeakPolarHBondContact CA-O 3.19Å; R1371-L1384 VanDerWaalsContact CG-O 3.27Å; R1371-L1384 WeakPolarHBondContact CG-O 3.43Å; V1372-L1384 HydrophobicContact CB-CB 4.28Å; V1372-L1384 HydrophobicContact CB-CD2 4.44Å; V1372-L1384 HydrophobicContact CG2-CD2 4.4Å; V1372-L1384 PolarHBondContact N-O 2.87Å; V1372-L1384 PolarHBondContact O-N 3.1Å; L1384-W1392 HydrophobicContact CD1-CB 4.4Å; L1384-W1392 HydrophobicContact CD1-CE3 4.17Å; L1384-W1392 HydrophobicContact CD2-CE3 4.29Å; L1384-W1392 HydrophobicContact CD2-CZ3 4.32Å; L1384-T1393 CarbonylContact C-O 3.48Å; L1384-T1393 WeakPolarHBondContact CA-O 3.31Å; L1384-L1394 HydrophobicContact CB-CD1 4.24Å; L1384-L1394 HydrophobicContact CD1-CD1 4.34Å; L1384-F1408 HydrophobicContact CD1-CE2 4.18Å; L1384-F1408 HydrophobicContact CD1-CZ 3.74Å; L1384-L1422 HydrophobicContact CD2-CD1 4.07Å; L1384-L1422 HydrophobicContact CD2-CD2 4.38Å; L1384-F1424 HydrophobicContact CB-CE1 4.4Å; L1384-F1424 HydrophobicContact CB-CZ 4.04Å; L1384-F1424 HydrophobicContact CD2-CZ 4.17Å; L1384-L1433 HydrophobicContact CD1-CD2 3.72Å; L1384-L1433 HydrophobicContact CD2-CD1 4.4Å; L1384-L1433 HydrophobicContact CD2-CD2 3.75Å; L1384-L1433 HydrophobicContact CG-CD2 4.32Å
1385	H	92	Very high	86.6	Confident	75.4 Å²	75.4	49.9 Å²	49.9	35%	0.349	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	123	170.4	174.4	-151.5	0	0	0	109.4	R1371 R1383 P1387 W1392 T1393	R1371-H1385 HydrophobicContact CG-CB 4.37Å; R1383-H1385 HydrophobicContact CG-CB 4.45Å; H1385-P1387 VanDerWaalsContact C-CD 3.45Å; H1385-P1387 VanDerWaalsContact O-CD 3.26Å; H1385-P1387 WeakPolarHBondContact O-CD 3.33Å; H1385-W1392 CarbonylContact O-C 3.44Å; H1385-W1392 VanDerWaalsContact O-CA 3.29Å; H1385-W1392 WeakPolarHBondContact O-CA 3.36Å; H1385-T1393 WeakPolarHBondContact CB-OG1 3.46Å; H1385-T1393 PolarHBondContact N-O 3.08Å; H1385-T1393 PolarHBondContact O-N 2.94Å; H1385-T1393 PolarHBondContact O-OG1 2.96Å
1386	A	91.2	Very high	86.6	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	70.6	-164.4	0	0	0	0	0	112.5	N1369 F1370 L1388 W1392	N1369-A1386 CarbonylContact C-O 3.56Å; N1369-A1386 WeakPolarHBondContact CA-O 3.39Å; F1370-A1386 HydrophobicContact CD1-CB 3.71Å; F1370-A1386 HydrophobicContact CD2-CB 3.97Å; F1370-A1386 HydrophobicContact CE1-CB 3.44Å; F1370-A1386 VanDerWaalsContact CE1-CB 3.44Å; F1370-A1386 HydrophobicContact CE2-CB 3.69Å; F1370-A1386 HydrophobicContact CG-CB 3.97Å; F1370-A1386 HydrophobicContact CZ-CB 3.43Å; F1370-A1386 VanDerWaalsContact CZ-CB 3.46Å; F1370-A1386 PolarHBondContact N-O 3.15Å; F1370-A1386 VanDerWaalsContact N-O 3.09Å; F1370-A1386 CarbonylContact O-C 3.56Å; F1370-A1386 WeakPolarHBondContact O-CA 3.42Å; F1370-A1386 WeakPolarHBondContact O-CB 3.41Å; F1370-A1386 PolarHBondContact O-N 3.09Å; A1386-L1388 PolarHBondContact O-N 2.85Å; A1386-W1392 VanDerWaalsContact CA-CD1 3.49Å; A1386-W1392 HydrophobicContact CB-CD2 3.47Å; A1386-W1392 VanDerWaalsContact CB-CD2 3.47Å; A1386-W1392 VanDerWaalsContact CB-CE2 3.47Å; A1386-W1392 HydrophobicContact CB-CE3 3.81Å; A1386-W1392 HydrophobicContact CB-CG 3.88Å; A1386-W1392 HydrophobicContact CB-CH2 4.19Å; A1386-W1392 HydrophobicContact CB-CZ2 3.88Å; A1386-W1392 HydrophobicContact CB-CZ3 4.16Å
1387	P	90.2	Very high	86.7	Confident	22.2 Å²	22.2	50.2 Å²	50.2	14%	0.144	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	125.8	169.9	29.3	-34.6	0	0	0	110.3	N1369 H1385 R1389 R1390 P1391 W1392	N1369-P1387 HydrophobicContact CB-CB 4.48Å; H1385-P1387 VanDerWaalsContact C-CD 3.45Å; H1385-P1387 VanDerWaalsContact O-CD 3.26Å; H1385-P1387 WeakPolarHBondContact O-CD 3.33Å; P1387-R1389 VanDerWaalsContact C-N 3.27Å; P1387-R1389 PolarHBondContact O-N 3.11Å; P1387-R1390 HydrophobicContact CB-CB 4.12Å; P1387-R1390 HydrophobicContact CG-CB 3.81Å; P1387-R1390 PolarHBondContact O-N 3.21Å; P1387-P1391 WeakPolarHBondContact CG-O 3.38Å; P1387-W1392 VanDerWaalsContact O-CD1 3.26Å; P1387-W1392 PolarHBondContact O-NE1 3.08Å; P1387-W1392 VanDerWaalsContact O-NE1 3.16Å
1388	L	83.4	Confident	87.1	Confident	50.2 Å²	50.2	51.7 Å²	51.7	26%	0.263	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-13.8	-173.4	-58.9	-169.6	0	0	0	114.2	L1363 A1367 R1368 F1370 A1386 W1392 L1417	L1363-L1388 HydrophobicContact CD1-CD1 3.84Å; L1363-L1388 HydrophobicContact CD1-CD2 3.91Å; L1363-L1388 HydrophobicContact CD1-CG 4.4Å; A1367-L1388 HydrophobicContact CB-CD1 3.79Å; A1367-L1388 VanDerWaalsContact O-CD1 3.23Å; A1367-L1388 WeakPolarHBondContact O-CD1 3.23Å; R1368-L1388 PolarHBondContact O-N 3.11Å; F1370-L1388 HydrophobicContact CD1-CD2 4.22Å; F1370-L1388 HydrophobicContact CE1-CD2 4.16Å; A1386-L1388 PolarHBondContact O-N 2.85Å; L1388-W1392 HydrophobicContact CD2-CZ2 4.18Å; L1388-L1417 HydrophobicContact CD1-CD2 4.39Å
1389	R	81.7	Confident	87.4	Confident	233.2 Å²	233.2	49.8 Å²	49.8	88%	0.88	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-108.7	0.3	179.2	-63.6	-174.5	179.2	-177.9	-1.3	114.2	P1387	P1387-R1389 VanDerWaalsContact C-N 3.27Å; P1387-R1389 PolarHBondContact O-N 3.11Å
1390	R	84.4	Confident	87.2	Confident	192 Å²	192	46.1 Å²	46.1	73%	0.725	22%	0.222	S	C	*	.	S	Bend	trans	-134.6	168.7	-177.5	-71.1	-175.1	178	-176.3	-1	109.9	P1387 W1392	P1387-R1390 HydrophobicContact CB-CB 4.12Å; P1387-R1390 HydrophobicContact CG-CB 3.81Å; P1387-R1390 PolarHBondContact O-N 3.21Å; R1390-W1392 PolarHBondContact O-N 2.86Å
1391	P	85.9	Confident	86.9	Confident	58 Å²	58	50.9 Å²	50.9	38%	0.377	25%	0.247	S	C	.	.			trans	-55.1	140.7	168.3	-24.2	35	0	0	0	111.4	P1387 Q1407 F1408 K1409	P1387-P1391 WeakPolarHBondContact CG-O 3.38Å; P1391-Q1407 HydrophobicContact CB-CB 4.21Å; P1391-Q1407 HydrophobicContact CB-CG 4.5Å; P1391-F1408 CarbonylContact C-O 3.54Å; P1391-F1408 WeakPolarHBondContact CA-O 3.41Å; P1391-K1409 HydrophobicContact CB-CB 4.11Å; P1391-K1409 HydrophobicContact CG-CB 4.03Å
1392	W	91.4	Very high	86.5	Confident	4.4 Å²	4.4	54.7 Å²	54.7	2%	0.017	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	145.6	170.7	-65.9	10.9	0	0	0	109.2	F1370 L1384 H1385 A1386 P1387 L1388 R1390 Q1407 F1408 P1410 L1412 I1420 L1422 V1435	F1370-W1392 AromaticContact CE1-CH2 3.65Å; F1370-W1392 HydrophobicContact CE1-CH2 3.65Å; F1370-W1392 AromaticContact CE1-CZ2 3.65Å; F1370-W1392 HydrophobicContact CE1-CZ2 3.65Å; F1370-W1392 HydrophobicContact CE1-CZ3 4.45Å; F1370-W1392 AromaticContact CZ-CH2 3.42Å; F1370-W1392 HydrophobicContact CZ-CH2 3.42Å; F1370-W1392 VanDerWaalsContact CZ-CH2 3.43Å; F1370-W1392 AromaticContact CZ-CZ2 3.89Å; F1370-W1392 HydrophobicContact CZ-CZ2 3.89Å; F1370-W1392 AromaticContact CZ-CZ3 3.85Å; F1370-W1392 HydrophobicContact CZ-CZ3 3.85Å; L1384-W1392 HydrophobicContact CD1-CB 4.4Å; L1384-W1392 HydrophobicContact CD1-CE3 4.17Å; L1384-W1392 HydrophobicContact CD2-CE3 4.29Å; L1384-W1392 HydrophobicContact CD2-CZ3 4.32Å; H1385-W1392 CarbonylContact O-C 3.44Å; H1385-W1392 VanDerWaalsContact O-CA 3.29Å; H1385-W1392 WeakPolarHBondContact O-CA 3.36Å; A1386-W1392 VanDerWaalsContact CA-CD1 3.49Å; A1386-W1392 HydrophobicContact CB-CD2 3.47Å; A1386-W1392 VanDerWaalsContact CB-CD2 3.47Å; A1386-W1392 VanDerWaalsContact CB-CE2 3.47Å; A1386-W1392 HydrophobicContact CB-CE3 3.81Å; A1386-W1392 HydrophobicContact CB-CG 3.88Å; A1386-W1392 HydrophobicContact CB-CH2 4.19Å; A1386-W1392 HydrophobicContact CB-CZ2 3.88Å; A1386-W1392 HydrophobicContact CB-CZ3 4.16Å; P1387-W1392 VanDerWaalsContact O-CD1 3.26Å; P1387-W1392 PolarHBondContact O-NE1 3.08Å; P1387-W1392 VanDerWaalsContact O-NE1 3.16Å; L1388-W1392 HydrophobicContact CD2-CZ2 4.18Å; R1390-W1392 PolarHBondContact O-N 2.86Å; W1392-Q1407 CarbonylContact O-C 3.41Å; W1392-Q1407 VanDerWaalsContact O-CA 3.29Å; W1392-Q1407 WeakPolarHBondContact O-CA 3.42Å; W1392-F1408 HydrophobicContact CB-CD2 4.05Å; W1392-F1408 HydrophobicContact CB-CE2 3.75Å; W1392-F1408 HydrophobicContact CB-CZ 4.29Å; W1392-F1408 HydrophobicContact CE3-CE2 4.16Å; W1392-F1408 HydrophobicContact CG-CE2 4.5Å; W1392-F1408 PolarHBondContact N-O 3.21Å; W1392-F1408 PolarHBondContact O-N 3.17Å; W1392-P1410 VanDerWaalsContact CD1-CG 3.41Å; W1392-P1410 HydrophobicContact CD2-CG 3.7Å; W1392-P1410 VanDerWaalsContact CE2-CG 3.43Å; W1392-P1410 HydrophobicContact CE3-CG 3.82Å; W1392-P1410 HydrophobicContact CG-CG 4.09Å; W1392-P1410 HydrophobicContact CH2-CG 3.9Å; W1392-P1410 HydrophobicContact CZ2-CG 3.85Å; W1392-P1410 HydrophobicContact CZ3-CG 3.97Å; W1392-P1410 VanDerWaalsContact NE1-CG 3.27Å; W1392-L1412 HydrophobicContact CH2-CD1 3.66Å; W1392-L1412 HydrophobicContact CZ2-CD1 3.48Å; W1392-L1412 VanDerWaalsContact CZ2-CD1 3.46Å; W1392-I1420 HydrophobicContact CH2-CG2 4.42Å; W1392-L1422 HydrophobicContact CH2-CD2 4.42Å; W1392-L1422 HydrophobicContact CZ3-CD2 3.93Å; W1392-V1435 HydrophobicContact CE3-CG2 4.17Å; W1392-V1435 HydrophobicContact CH2-CG1 4.14Å; W1392-V1435 HydrophobicContact CZ3-CB 4.48Å; W1392-V1435 HydrophobicContact CZ3-CG1 3.97Å; W1392-V1435 HydrophobicContact CZ3-CG2 4.11Å
1393	T	89.6	Confident	85.5	Confident	20 Å²	20	59 Å²	59	12%	0.123	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	130.6	179.1	37.6	0	0	0	0	110	L1384 H1385 I1405 T1406 Q1407	L1384-T1393 CarbonylContact C-O 3.48Å; L1384-T1393 WeakPolarHBondContact CA-O 3.31Å; H1385-T1393 WeakPolarHBondContact CB-OG1 3.46Å; H1385-T1393 PolarHBondContact N-O 3.08Å; H1385-T1393 PolarHBondContact O-N 2.94Å; H1385-T1393 PolarHBondContact O-OG1 2.96Å; T1393-I1405 HydrophobicContact CG2-CG2 3.72Å; T1393-T1406 CarbonylContact C-O 3.6Å; T1393-T1406 WeakPolarHBondContact CA-O 3.32Å; T1393-Q1407 HydrophobicContact CG2-CG 3.78Å
1394	L	92.2	Very high	84.2	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	122.8	165.4	-174.5	67.5	0	0	0	108.1	L1382 R1383 L1384 I1405 T1406 F1408 F1424 L1433 F1444	L1382-L1394 HydrophobicContact CD1-CD1 3.73Å; L1382-L1394 HydrophobicContact CD1-CD2 4.32Å; L1382-L1394 HydrophobicContact CD1-CG 3.99Å; L1382-L1394 HydrophobicContact CD2-CD1 4.43Å; L1382-L1394 HydrophobicContact CG-CD1 3.96Å; R1383-L1394 CarbonylContact O-C 3.58Å; R1383-L1394 VanDerWaalsContact O-CA 3.31Å; R1383-L1394 WeakPolarHBondContact O-CA 3.35Å; L1384-L1394 HydrophobicContact CB-CD1 4.24Å; L1384-L1394 HydrophobicContact CD1-CD1 4.34Å; L1394-I1405 WeakPolarHBondContact O-CA 3.46Å; L1394-T1406 PolarHBondContact N-O 3.05Å; L1394-T1406 PolarHBondContact O-N 3.11Å; L1394-F1408 HydrophobicContact CB-CE1 3.7Å; L1394-F1408 HydrophobicContact CB-CZ 4.05Å; L1394-F1424 HydrophobicContact CD1-CE1 3.96Å; L1394-L1433 HydrophobicContact CD2-CB 4.42Å; L1394-F1444 HydrophobicContact CB-CE2 4.47Å; L1394-F1444 HydrophobicContact CD2-CB 3.87Å; L1394-F1444 HydrophobicContact CD2-CD1 4Å; L1394-F1444 HydrophobicContact CD2-CD2 3.99Å; L1394-F1444 HydrophobicContact CD2-CG 3.73Å; L1394-F1444 HydrophobicContact CG-CD1 4.15Å; L1394-F1444 HydrophobicContact CG-CD2 4.22Å; L1394-F1444 HydrophobicContact CG-CE1 4.3Å; L1394-F1444 HydrophobicContact CG-CE2 4.34Å; L1394-F1444 HydrophobicContact CG-CG 4.19Å; L1394-F1444 HydrophobicContact CG-CZ 4.31Å; L1394-F1444 VanDerWaalsContact O-CE2 3.28Å; L1394-F1444 WeakPolarHBondContact O-CE2 3.39Å; L1394-F1444 WeakPolarHBondContact O-CZ 3.27Å
1395	S	90.3	Very high	83.5	Confident	0.2 Å²	0.2	66.6 Å²	66.6	0%	0.001	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	147	-172.5	-36.1	0	0	0	0	112.3	L1382 R1383 E1402 K1404	L1382-S1395 WeakPolarHBondContact CD1-O 3.15Å; R1383-S1395 PolarHBondContact N-O 3.12Å; R1383-S1395 VanDerWaalsContact N-O 3.11Å; R1383-S1395 PolarHBondContact O-N 2.88Å; S1395-E1402 WeakPolarHBondContact CB-OE1 3.4Å; S1395-E1402 VanDerWaalsContact OG-CD 3.23Å; S1395-E1402 PolarHBondContact OG-OE1 3.18Å; S1395-K1404 CarbonylContact C-O 3.5Å; S1395-K1404 WeakPolarHBondContact CA-O 3.24Å
1396	R	89.3	Confident	82.9	Confident	60.8 Å²	60.8	65 Å²	65	23%	0.229	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	109.5	175.9	173.6	-173	175.5	-151.9	-1.1	108.6	I1398 E1403 K1404 F1444 L1446 P1447	R1396-I1398 HydrophobicContact CG-CD1 4.35Å; R1396-I1398 HydrophobicContact CG-CG1 4.25Å; R1396-E1403 HydrophobicContact CB-CB 4.33Å; R1396-E1403 WeakPolarHBondContact CB-O 3.2Å; R1396-E1403 WeakPolarHBondContact CD-OE2 3.08Å; R1396-E1403 IonicContact CZ-OE2 2.76Å; R1396-E1403 PolarHBondContact N-O 2.97Å; R1396-E1403 IonicContact NE-OE2 3.49Å; R1396-E1403 PolarHBondContact NE-OE2 3.3Å; R1396-E1403 IonicContact NH1-OE2 2.73Å; R1396-E1403 PolarHBondContact NH1-OE2 2.97Å; R1396-E1403 IonicContact NH2-OE2 3.81Å; R1396-E1403 PolarHBondContact NH2-OE2 2.74Å; R1396-E1403 WeakPolarHBondContact O-CA 3.34Å; R1396-E1403 VanDerWaalsContact O-CB 3.31Å; R1396-E1403 WeakPolarHBondContact O-CB 3.33Å; R1396-E1403 PolarHBondContact O-N 2.86Å; R1396-K1404 HydrophobicContact CB-CB 4.21Å; R1396-K1404 PolarHBondContact N-O 2.84Å; R1396-F1444 HydrophobicContact CB-CE1 3.86Å; R1396-F1444 HydrophobicContact CB-CZ 3.98Å; R1396-L1446 PolarHBondContact NE-O 2.92Å; R1396-L1446 VanDerWaalsContact NE-O 3.14Å; R1396-L1446 PolarHBondContact NH2-O 2.88Å; R1396-P1447 HydrophobicContact CG-CB 3.64Å; R1396-P1447 HydrophobicContact CG-CG 4.3Å
1397	I	87	Confident	82.6	Confident	14.2 Å²	14.2	71.4 Å²	71.4	7%	0.073	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	121.2	176.6	-56.3	169.8	0	0	0	108.4	A1380 T1381 R1383 N1401 E1402	A1380-I1397 CarbonylContact C-O 3.55Å; A1380-I1397 WeakPolarHBondContact CA-O 3.28Å; T1381-I1397 HydrophobicContact CG2-CD1 4.32Å; T1381-I1397 PolarHBondContact N-O 3.02Å; T1381-I1397 WeakPolarHBondContact O-CB 3.4Å; T1381-I1397 PolarHBondContact O-N 2.94Å; R1383-I1397 HydrophobicContact CB-CD1 3.91Å; R1383-I1397 HydrophobicContact CB-CG1 4.49Å; R1383-I1397 HydrophobicContact CG-CD1 4.45Å; R1383-I1397 VanDerWaalsContact CZ-CD1 3.45Å; R1383-I1397 VanDerWaalsContact NH1-CD1 3.32Å; I1397-N1401 VanDerWaalsContact CA-O 3.28Å; I1397-N1401 WeakPolarHBondContact CA-O 3.39Å; I1397-E1402 HydrophobicContact CG1-CB 4.27Å; I1397-E1402 HydrophobicContact CG1-CG 4.08Å
1398	I	81.3	Confident	82.2	Confident	37.8 Å²	37.8	71.2 Å²	71.2	19%	0.194	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	129.1	174.5	-56	179.5	0	0	0	107.2	R1379 R1396 G1400 N1401 E1403 P1447	R1379-I1398 CarbonylContact O-C 3.45Å; R1379-I1398 WeakPolarHBondContact O-CA 3.42Å; R1396-I1398 HydrophobicContact CG-CD1 4.35Å; R1396-I1398 HydrophobicContact CG-CG1 4.25Å; I1398-G1400 PolarHBondContact O-N 3.12Å; I1398-N1401 PolarHBondContact N-O 2.96Å; I1398-N1401 WeakPolarHBondContact O-CA 3.29Å; I1398-N1401 WeakPolarHBondContact O-CB 3.31Å; I1398-N1401 PolarHBondContact O-N 2.94Å; I1398-E1403 VanDerWaalsContact CD1-OE2 3.24Å; I1398-E1403 WeakPolarHBondContact CD1-OE2 3.42Å; I1398-P1447 HydrophobicContact CD1-CB 4.28Å; I1398-P1447 HydrophobicContact CG1-CB 4.03Å
1399	D	77.2	Confident	82	Confident	73.4 Å²	73.4	75.6 Å²	75.6	39%	0.393	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.9	24.9	177.7	-63	-10.4	0	0	0	114	G1104 N1106 R1379 N1401	G1104-D1399 CarbonylContact O-C 3.59Å; G1104-D1399 VanDerWaalsContact O-O 3.14Å; N1106-D1399 PolarHBondContact N-O 3.18Å; N1106-D1399 WeakPolarHBondContact ND2-CB 3.31Å; R1379-D1399 VanDerWaalsContact CB-OD1 3.31Å; R1379-D1399 WeakPolarHBondContact CB-OD1 3.33Å; R1379-D1399 WeakPolarHBondContact CD-OD1 3.43Å; R1379-D1399 VanDerWaalsContact CG-OD1 3.31Å; R1379-D1399 WeakPolarHBondContact CG-OD1 3.48Å; R1379-D1399 IonicContact CZ-OD1 3.21Å; R1379-D1399 IonicContact CZ-OD2 3.02Å; R1379-D1399 VanDerWaalsContact CZ-OD2 3.31Å; R1379-D1399 IonicContact NE-OD1 3.59Å; R1379-D1399 PolarHBondContact NE-OD1 3.2Å; R1379-D1399 IonicContact NE-OD2 2.94Å; R1379-D1399 PolarHBondContact NE-OD2 3.02Å; R1379-D1399 VanDerWaalsContact NE-OD2 3.17Å; R1379-D1399 IonicContact NH1-OD1 3.62Å; R1379-D1399 VanDerWaalsContact NH2-CG 3.33Å; R1379-D1399 IonicContact NH2-OD1 3.15Å; R1379-D1399 PolarHBondContact NH2-OD1 2.65Å; R1379-D1399 IonicContact NH2-OD2 2.95Å; R1379-D1399 PolarHBondContact NH2-OD2 3.05Å; R1379-D1399 PolarHBondContact O-N 2.99Å; D1399-N1401 VanDerWaalsContact C-N 3.31Å; D1399-N1401 PolarHBondContact O-N 2.83Å
1400	G	73.8	Confident	81.8	Confident	56 Å²	56	65.4 Å²	65.4	58%	0.577	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.8	-18.5	-174.6	0	0	0	0	0	114.5	G1104 I1398	G1104-G1400 PolarHBondContact O-N 2.88Å; I1398-G1400 PolarHBondContact O-N 3.12Å
1401	N	76.2	Confident	81.2	Confident	107.4 Å²	107.4	63.2 Å²	63.2	57%	0.574	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.3	131.7	178.7	-63.9	-34.4	0	0	0	111.1	I1397 I1398 D1399 E1403	I1397-N1401 VanDerWaalsContact CA-O 3.28Å; I1397-N1401 WeakPolarHBondContact CA-O 3.39Å; I1398-N1401 PolarHBondContact N-O 2.96Å; I1398-N1401 WeakPolarHBondContact O-CA 3.29Å; I1398-N1401 WeakPolarHBondContact O-CB 3.31Å; I1398-N1401 PolarHBondContact O-N 2.94Å; D1399-N1401 VanDerWaalsContact C-N 3.31Å; D1399-N1401 PolarHBondContact O-N 2.83Å; N1401-E1403 HydrophobicContact CB-CG 4.47Å; N1401-E1403 PolarHBondContact O-N 3.17Å; N1401-E1403 VanDerWaalsContact O-N 3.12Å
1402	E	80.7	Confident	80.4	Confident	89.4 Å²	89.4	62.3 Å²	62.3	42%	0.418	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	88.3	179.4	-166.7	165.9	178.4	0	0	110.6	R1383 S1395 I1397 K1404 I1405	R1383-E1402 IonicContact NH1-OE2 3.61Å; R1383-E1402 PolarHBondContact NH1-OE2 2.87Å; S1395-E1402 WeakPolarHBondContact CB-OE1 3.4Å; S1395-E1402 VanDerWaalsContact OG-CD 3.23Å; S1395-E1402 PolarHBondContact OG-OE1 3.18Å; I1397-E1402 HydrophobicContact CG1-CB 4.27Å; I1397-E1402 HydrophobicContact CG1-CG 4.08Å; E1402-K1404 PolarHBondContact O-N 3.46Å; E1402-K1404 VanDerWaalsContact O-N 3.14Å; E1402-I1405 HydrophobicContact CG-CD1 4.19Å; E1402-I1405 HydrophobicContact CG-CG1 4.17Å
1403	E	71.3	Confident	79.2	Confident	90.8 Å²	90.8	68.5 Å²	68.5	42%	0.424	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	166.6	-177.6	-60.4	-178.1	159.3	0	0	113.5	R1396 I1398 N1401 I1405	R1396-E1403 HydrophobicContact CB-CB 4.33Å; R1396-E1403 WeakPolarHBondContact CB-O 3.2Å; R1396-E1403 WeakPolarHBondContact CD-OE2 3.08Å; R1396-E1403 IonicContact CZ-OE2 2.76Å; R1396-E1403 PolarHBondContact N-O 2.97Å; R1396-E1403 IonicContact NE-OE2 3.49Å; R1396-E1403 PolarHBondContact NE-OE2 3.3Å; R1396-E1403 IonicContact NH1-OE2 2.73Å; R1396-E1403 PolarHBondContact NH1-OE2 2.97Å; R1396-E1403 IonicContact NH2-OE2 3.81Å; R1396-E1403 PolarHBondContact NH2-OE2 2.74Å; R1396-E1403 WeakPolarHBondContact O-CA 3.34Å; R1396-E1403 VanDerWaalsContact O-CB 3.31Å; R1396-E1403 WeakPolarHBondContact O-CB 3.33Å; R1396-E1403 PolarHBondContact O-N 2.86Å; I1398-E1403 VanDerWaalsContact CD1-OE2 3.24Å; I1398-E1403 WeakPolarHBondContact CD1-OE2 3.42Å; N1401-E1403 HydrophobicContact CB-CG 4.47Å; N1401-E1403 PolarHBondContact O-N 3.17Å; N1401-E1403 VanDerWaalsContact O-N 3.12Å; E1403-I1405 PolarHBondContact O-N 3.23Å
1404	K	66.3	Low	77.7	Confident	125.2 Å²	125.2	73.7 Å²	73.7	54%	0.544	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	62.1	100.5	171.1	-137.5	173.1	-176.5	165.6	0	112.4	S1395 R1396 E1402 F1444 P1445	S1395-K1404 CarbonylContact C-O 3.5Å; S1395-K1404 WeakPolarHBondContact CA-O 3.24Å; R1396-K1404 HydrophobicContact CB-CB 4.21Å; R1396-K1404 PolarHBondContact N-O 2.84Å; E1402-K1404 PolarHBondContact O-N 3.46Å; E1402-K1404 VanDerWaalsContact O-N 3.14Å; K1404-F1444 HydrophobicContact CB-CE2 4.21Å; K1404-F1444 HydrophobicContact CB-CZ 4.12Å; K1404-F1444 HydrophobicContact CD-CE2 4.48Å; K1404-F1444 HydrophobicContact CG-CE2 4.05Å; K1404-F1444 HydrophobicContact CG-CZ 4.23Å; K1404-F1444 WeakPolarHBondContact O-CE2 3.24Å; K1404-F1444 WeakPolarHBondContact O-CZ 3.3Å; K1404-P1445 HydrophobicContact CD-CG 4.2Å
1405	I	77.7	Confident	75.7	Confident	87 Å²	87	77.2 Å²	77.2	45%	0.446	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	131.7	179.1	-53.2	179	0	0	0	109.8	T1393 L1394 E1402 E1403 Q1407	T1393-I1405 HydrophobicContact CG2-CG2 3.72Å; L1394-I1405 WeakPolarHBondContact O-CA 3.46Å; E1402-I1405 HydrophobicContact CG-CD1 4.19Å; E1402-I1405 HydrophobicContact CG-CG1 4.17Å; E1403-I1405 PolarHBondContact O-N 3.23Å; I1405-Q1407 HydrophobicContact CG2-CG 4.34Å
1406	T	80.8	Confident	74.2	Confident	43.6 Å²	43.6	78.4 Å²	78.4	27%	0.267	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	124.5	167.5	-64	0	0	0	0	109.7	T1393 L1394 F1408 F1444	T1393-T1406 CarbonylContact C-O 3.6Å; T1393-T1406 WeakPolarHBondContact CA-O 3.32Å; L1394-T1406 PolarHBondContact N-O 3.05Å; L1394-T1406 PolarHBondContact O-N 3.11Å; T1406-F1408 HydrophobicContact CG2-CD1 4.27Å; T1406-F1408 WeakPolarHBondContact O-CD1 3.22Å; T1406-F1408 WeakPolarHBondContact O-CE1 3.19Å; T1406-F1444 VanDerWaalsContact OG1-CD2 3.24Å; T1406-F1444 WeakPolarHBondContact OG1-CD2 3.28Å; T1406-F1444 WeakPolarHBondContact OG1-CE2 3.37Å
1407	Q	83.7	Confident	73.3	Confident	132.8 Å²	132.8	78.1 Å²	78.1	62%	0.621	41%	0.405	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.3	142.4	177.5	-69.6	-174.1	13.9	0	0	112.4	P1391 W1392 T1393 I1405	P1391-Q1407 HydrophobicContact CB-CB 4.21Å; P1391-Q1407 HydrophobicContact CB-CG 4.5Å; W1392-Q1407 CarbonylContact O-C 3.41Å; W1392-Q1407 VanDerWaalsContact O-CA 3.29Å; W1392-Q1407 WeakPolarHBondContact O-CA 3.42Å; T1393-Q1407 HydrophobicContact CG2-CG 3.78Å; I1405-Q1407 HydrophobicContact CG2-CG 4.34Å
1408	F	82.9	Confident	72.4	Confident	19.6 Å²	19.6	84.7 Å²	84.7	9%	0.086	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.1	151.2	174.8	45.7	-89.8	0	0	0	111.2	L1384 P1391 W1392 L1394 T1406 P1410 L1433 I1440	L1384-F1408 HydrophobicContact CD1-CE2 4.18Å; L1384-F1408 HydrophobicContact CD1-CZ 3.74Å; P1391-F1408 CarbonylContact C-O 3.54Å; P1391-F1408 WeakPolarHBondContact CA-O 3.41Å; W1392-F1408 HydrophobicContact CB-CD2 4.05Å; W1392-F1408 HydrophobicContact CB-CE2 3.75Å; W1392-F1408 HydrophobicContact CB-CZ 4.29Å; W1392-F1408 HydrophobicContact CE3-CE2 4.16Å; W1392-F1408 HydrophobicContact CG-CE2 4.5Å; W1392-F1408 PolarHBondContact N-O 3.21Å; W1392-F1408 PolarHBondContact O-N 3.17Å; L1394-F1408 HydrophobicContact CB-CE1 3.7Å; L1394-F1408 HydrophobicContact CB-CZ 4.05Å; T1406-F1408 HydrophobicContact CG2-CD1 4.27Å; T1406-F1408 WeakPolarHBondContact O-CD1 3.22Å; T1406-F1408 WeakPolarHBondContact O-CE1 3.19Å; F1408-P1410 WeakPolarHBondContact O-CD 3.45Å; F1408-L1433 HydrophobicContact CE2-CD2 3.82Å; F1408-L1433 HydrophobicContact CZ-CD2 3.59Å; F1408-L1433 VanDerWaalsContact CZ-CD2 3.5Å; F1408-I1440 HydrophobicContact CB-CG2 3.89Å; F1408-I1440 WeakPolarHBondContact CB-O 3.44Å; F1408-I1440 HydrophobicContact CD2-CB 4.39Å; F1408-I1440 HydrophobicContact CD2-CD1 3.47Å; F1408-I1440 VanDerWaalsContact CD2-CD1 3.47Å; F1408-I1440 HydrophobicContact CD2-CG1 4.03Å; F1408-I1440 HydrophobicContact CD2-CG2 3.57Å; F1408-I1440 WeakPolarHBondContact CD2-O 3.33Å; F1408-I1440 HydrophobicContact CE2-CD1 3.43Å; F1408-I1440 VanDerWaalsContact CE2-CD1 3.43Å; F1408-I1440 HydrophobicContact CE2-CG1 4.08Å; F1408-I1440 HydrophobicContact CE2-CG2 4.44Å; F1408-I1440 HydrophobicContact CG-CD1 4.45Å; F1408-I1440 HydrophobicContact CG-CG2 3.92Å; F1408-I1440 VanDerWaalsContact CG-O 3.28Å; F1408-I1440 WeakPolarHBondContact CG-O 3.41Å; F1408-I1440 HydrophobicContact CZ-CD1 4.4Å
1409	K	78.6	Confident	72.2	Confident	142.6 Å²	142.6	85.5 Å²	85.5	62%	0.62	44%	0.438	S	S	*	.			trans	-108.7	103.8	178.7	-177.8	-178.3	-179.1	-173.7	0	111.1	P1391	P1391-K1409 HydrophobicContact CB-CB 4.11Å; P1391-K1409 HydrophobicContact CG-CB 4.03Å
1410	P	76.3	Confident	72.4	Confident	19 Å²	19	82 Å²	82	12%	0.123	42%	0.419	C	S	.	.			trans	-68.7	142.6	-179.3	19.3	-22.2	0	0	0	112.4	W1392 F1408 L1412 V1435 I1440	W1392-P1410 VanDerWaalsContact CD1-CG 3.41Å; W1392-P1410 HydrophobicContact CD2-CG 3.7Å; W1392-P1410 VanDerWaalsContact CE2-CG 3.43Å; W1392-P1410 HydrophobicContact CE3-CG 3.82Å; W1392-P1410 HydrophobicContact CG-CG 4.09Å; W1392-P1410 HydrophobicContact CH2-CG 3.9Å; W1392-P1410 HydrophobicContact CZ2-CG 3.85Å; W1392-P1410 HydrophobicContact CZ3-CG 3.97Å; W1392-P1410 VanDerWaalsContact NE1-CG 3.27Å; F1408-P1410 WeakPolarHBondContact O-CD 3.45Å; P1410-L1412 VanDerWaalsContact C-N 3.3Å; P1410-L1412 HydrophobicContact CB-CD1 4.48Å; P1410-L1412 HydrophobicContact CB-CG 4.23Å; P1410-L1412 HydrophobicContact CG-CD1 4.32Å; P1410-L1412 HydrophobicContact CG-CG 4.3Å; P1410-L1412 PolarHBondContact O-N 2.9Å; P1410-L1412 VanDerWaalsContact O-N 3.13Å; P1410-V1435 HydrophobicContact CB-CG1 4.32Å; P1410-V1435 HydrophobicContact CB-CG2 4.47Å; P1410-I1440 HydrophobicContact CB-CD1 3.86Å; P1410-I1440 HydrophobicContact CG-CD1 4.47Å
1411	N	72.1	Confident	72.7	Confident	145 Å²	145	80.7 Å²	80.7	78%	0.775	40%	0.4	S	S	*	.			trans	-92	71.4	171.8	-153.5	-1.3	0	0	0	110.4
1412	L	70.6	Confident	73.3	Confident	39.2 Å²	39.2	75.6 Å²	75.6	21%	0.205	37%	0.373	C	S	.	.			trans	-86.5	128.9	175.5	-68.7	174.9	0	0	0	110.5	W1392 P1410 D1416 L1417 I1420 V1435 N1436	W1392-L1412 HydrophobicContact CH2-CD1 3.66Å; W1392-L1412 HydrophobicContact CZ2-CD1 3.48Å; W1392-L1412 VanDerWaalsContact CZ2-CD1 3.46Å; P1410-L1412 VanDerWaalsContact C-N 3.3Å; P1410-L1412 HydrophobicContact CB-CD1 4.48Å; P1410-L1412 HydrophobicContact CB-CG 4.23Å; P1410-L1412 HydrophobicContact CG-CD1 4.32Å; P1410-L1412 HydrophobicContact CG-CG 4.3Å; P1410-L1412 PolarHBondContact O-N 2.9Å; P1410-L1412 VanDerWaalsContact O-N 3.13Å; L1412-D1416 HydrophobicContact CD2-CB 4.11Å; L1412-L1417 HydrophobicContact CB-CD2 4.26Å; L1412-L1417 HydrophobicContact CD1-CD2 4.26Å; L1412-I1420 HydrophobicContact CD1-CD1 3.88Å; L1412-I1420 HydrophobicContact CD1-CG1 4.49Å; L1412-I1420 HydrophobicContact CD2-CD1 4.43Å; L1412-I1420 HydrophobicContact CD2-CG1 4.32Å; L1412-I1420 HydrophobicContact CD2-CG2 4.09Å; L1412-V1435 HydrophobicContact CD2-CG1 3.92Å; L1412-N1436 WeakPolarHBondContact CD2-ND2 3.29Å
1413	R	65.8	Low	73.7	Confident	135 Å²	135	72.5 Å²	72.5	51%	0.509	36%	0.36	S	S	.	.			trans	-85.4	158.2	169.1	-57.6	172	-137.2	-170.6	2.9	109.3	T1245 T1415 D1416 L1417	T1245-R1413 PolarHBondContact OG1-NH1 3.21Å; R1413-T1415 WeakPolarHBondContact CB-OG1 3.38Å; R1413-T1415 PolarHBondContact O-N 2.96Å; R1413-T1415 VanDerWaalsContact O-N 3.11Å; R1413-D1416 VanDerWaalsContact CB-OD2 3.3Å; R1413-D1416 WeakPolarHBondContact CB-OD2 3.33Å; R1413-D1416 IonicContact CZ-OD1 3.17Å; R1413-D1416 IonicContact CZ-OD2 3.65Å; R1413-D1416 PolarHBondContact N-OD2 2.96Å; R1413-D1416 IonicContact NE-OD1 3.23Å; R1413-D1416 PolarHBondContact NE-OD1 3.11Å; R1413-D1416 IonicContact NE-OD2 2.87Å; R1413-D1416 PolarHBondContact NE-OD2 3.01Å; R1413-D1416 IonicContact NH2-OD1 3.44Å; R1413-D1416 PolarHBondContact NH2-OD1 3.15Å; R1413-D1416 IonicContact NH2-OD2 3.35Å; R1413-D1416 PolarHBondContact NH2-OD2 2.85Å; R1413-D1416 WeakPolarHBondContact O-CA 3.29Å; R1413-D1416 VanDerWaalsContact O-CB 3.3Å; R1413-D1416 WeakPolarHBondContact O-CB 3.27Å; R1413-D1416 PolarHBondContact O-N 3.09Å; R1413-L1417 PolarHBondContact O-N 2.79Å
1414	V	56.8	Low	74.6	Confident	128.4 Å²	128.4	68.2 Å²	68.2	78%	0.778	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-27.8	177.7	-178.3	0	0	0	0	112.4	D1416 L1417	V1414-D1416 VanDerWaalsContact C-N 3.29Å; V1414-D1416 PolarHBondContact O-N 3.11Å; V1414-L1417 HydrophobicContact CG1-CD1 4.45Å
1415	T	49.9	Very low	75.7	Confident	74.2 Å²	74.2	64.3 Å²	64.3	46%	0.455	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-32.3	172.3	44.9	0	0	0	0	113.7	R1413 L1417 K1418	R1413-T1415 WeakPolarHBondContact CB-OG1 3.38Å; R1413-T1415 PolarHBondContact O-N 2.96Å; R1413-T1415 VanDerWaalsContact O-N 3.11Å; T1415-L1417 VanDerWaalsContact C-N 3.32Å; T1415-L1417 PolarHBondContact O-N 3.1Å; T1415-K1418 PolarHBondContact O-N 2.84Å
1416	D	60.2	Low	76.1	Confident	25 Å²	25	60.4 Å²	60.4	13%	0.134	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-81.4	-23.2	-167.8	-49.8	-16.1	0	0	0	110.8	L1412 R1413 V1414 K1418 N1419 I1420 N1436	L1412-D1416 HydrophobicContact CD2-CB 4.11Å; R1413-D1416 VanDerWaalsContact CB-OD2 3.3Å; R1413-D1416 WeakPolarHBondContact CB-OD2 3.33Å; R1413-D1416 IonicContact CZ-OD1 3.17Å; R1413-D1416 IonicContact CZ-OD2 3.65Å; R1413-D1416 PolarHBondContact N-OD2 2.96Å; R1413-D1416 IonicContact NE-OD1 3.23Å; R1413-D1416 PolarHBondContact NE-OD1 3.11Å; R1413-D1416 IonicContact NE-OD2 2.87Å; R1413-D1416 PolarHBondContact NE-OD2 3.01Å; R1413-D1416 IonicContact NH2-OD1 3.44Å; R1413-D1416 PolarHBondContact NH2-OD1 3.15Å; R1413-D1416 IonicContact NH2-OD2 3.35Å; R1413-D1416 PolarHBondContact NH2-OD2 2.85Å; R1413-D1416 WeakPolarHBondContact O-CA 3.29Å; R1413-D1416 VanDerWaalsContact O-CB 3.3Å; R1413-D1416 WeakPolarHBondContact O-CB 3.27Å; R1413-D1416 PolarHBondContact O-N 3.09Å; V1414-D1416 VanDerWaalsContact C-N 3.29Å; V1414-D1416 PolarHBondContact O-N 3.11Å; D1416-K1418 PolarHBondContact O-N 2.98Å; D1416-K1418 VanDerWaalsContact O-N 3.13Å; D1416-N1419 CarbonylContact O-C 3.56Å; D1416-N1419 PolarHBondContact O-N 3.09Å; D1416-N1419 VanDerWaalsContact O-N 3.12Å; D1416-I1420 VanDerWaalsContact O-CG1 3.25Å; D1416-I1420 WeakPolarHBondContact O-CG1 3.41Å; D1416-I1420 PolarHBondContact O-N 3.1Å; D1416-N1436 PolarHBondContact OD2-ND2 3.06Å; D1416-N1436 VanDerWaalsContact OD2-ND2 3.16Å
1417	L	69.2	Low	75.9	Confident	54 Å²	54	61.7 Å²	61.7	28%	0.283	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-58.7	-17.5	177.5	-54.6	178.3	0	0	0	113.8	L1363 L1388 L1412 R1413 V1414 T1415 I1420	L1363-L1417 HydrophobicContact CD1-CD2 4.16Å; L1363-L1417 PolarHBondContact N-O 2.9Å; L1388-L1417 HydrophobicContact CD1-CD2 4.39Å; L1412-L1417 HydrophobicContact CB-CD2 4.26Å; L1412-L1417 HydrophobicContact CD1-CD2 4.26Å; R1413-L1417 PolarHBondContact O-N 2.79Å; V1414-L1417 HydrophobicContact CG1-CD1 4.45Å; T1415-L1417 VanDerWaalsContact C-N 3.32Å; T1415-L1417 PolarHBondContact O-N 3.1Å; L1417-I1420 HydrophobicContact CD2-CD1 4.41Å
1418	K	68.1	Low	75.3	Confident	153.2 Å²	153.2	60.8 Å²	60.8	67%	0.666	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-81.4	-20.3	176.1	-66.6	-168.2	176.3	-169.1	0	114	A1362 T1415 D1416	A1362-K1418 VanDerWaalsContact CB-O 3.29Å; A1362-K1418 WeakPolarHBondContact CB-O 3.34Å; T1415-K1418 PolarHBondContact O-N 2.84Å; D1416-K1418 PolarHBondContact O-N 2.98Å; D1416-K1418 VanDerWaalsContact O-N 3.13Å
1419	N	76.9	Confident	75.1	Confident	54.8 Å²	54.8	61.8 Å²	61.8	29%	0.293	33%	0.327	S	S	.	.			trans	-164.2	105.2	169.8	-177.1	27.3	0	0	0	109.5	N1360 V1361 D1416 P1421	N1360-N1419 WeakPolarHBondContact CB-OD1 3.47Å; V1361-N1419 CarbonylContact O-C 3.53Å; V1361-N1419 WeakPolarHBondContact O-CA 3.42Å; D1416-N1419 CarbonylContact O-C 3.56Å; D1416-N1419 PolarHBondContact O-N 3.09Å; D1416-N1419 VanDerWaalsContact O-N 3.12Å; N1419-P1421 WeakPolarHBondContact O-CD 3.31Å; N1419-P1421 WeakPolarHBondContact OD1-CD 3.25Å
1420	I	82	Confident	75.3	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	99.9	175.8	-49.7	171.5	0	0	0	108	V1361 L1363 F1370 W1392 L1412 D1416 L1417 L1422 V1435	V1361-I1420 PolarHBondContact N-O 3.14Å; V1361-I1420 WeakPolarHBondContact O-CB 3.41Å; V1361-I1420 PolarHBondContact O-N 3.01Å; L1363-I1420 HydrophobicContact CD1-CD1 3.64Å; L1363-I1420 HydrophobicContact CG-CD1 4.11Å; F1370-I1420 HydrophobicContact CE1-CD1 4.21Å; F1370-I1420 HydrophobicContact CZ-CD1 4.45Å; W1392-I1420 HydrophobicContact CH2-CG2 4.42Å; L1412-I1420 HydrophobicContact CD1-CD1 3.88Å; L1412-I1420 HydrophobicContact CD1-CG1 4.49Å; L1412-I1420 HydrophobicContact CD2-CD1 4.43Å; L1412-I1420 HydrophobicContact CD2-CG1 4.32Å; L1412-I1420 HydrophobicContact CD2-CG2 4.09Å; D1416-I1420 VanDerWaalsContact O-CG1 3.25Å; D1416-I1420 WeakPolarHBondContact O-CG1 3.41Å; D1416-I1420 PolarHBondContact O-N 3.1Å; L1417-I1420 HydrophobicContact CD2-CD1 4.41Å; I1420-L1422 HydrophobicContact CG2-CD2 3.66Å; I1420-L1422 HydrophobicContact CG2-CG 4.14Å; I1420-L1422 PolarHBondContact O-N 3.05Å; I1420-V1435 HydrophobicContact CG2-CG1 3.6Å; I1420-V1435 VanDerWaalsContact CG2-CG1 3.45Å
1421	P	81.4	Confident	75.8	Confident	28.2 Å²	28.2	58 Å²	58	18%	0.183	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	121.2	167.8	8.5	-8.2	0	0	0	110.5	N1360 N1419 V1435 N1436	N1360-P1421 WeakPolarHBondContact OD1-CB 3.14Å; N1360-P1421 WeakPolarHBondContact OD1-CG 3.27Å; N1419-P1421 WeakPolarHBondContact O-CD 3.31Å; N1419-P1421 WeakPolarHBondContact OD1-CD 3.25Å; P1421-V1435 CarbonylContact O-C 3.6Å; P1421-V1435 WeakPolarHBondContact O-CA 3.35Å; P1421-N1436 VanDerWaalsContact CD-OD1 3.26Å; P1421-N1436 WeakPolarHBondContact CD-OD1 3.32Å; P1421-N1436 VanDerWaalsContact CG-OD1 3.27Å; P1421-N1436 WeakPolarHBondContact CG-OD1 3.01Å; P1421-N1436 PolarHBondContact O-N 3.06Å; P1421-N1436 VanDerWaalsContact O-N 3.09Å
1422	L	88.8	Confident	76.6	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	98.7	178.5	-56	170.6	0	0	0	108.4	T1358 T1359 V1361 F1370 V1372 L1384 W1392 I1420 L1433 S1434 V1435	T1358-L1422 CarbonylContact C-O 3.52Å; T1358-L1422 WeakPolarHBondContact CA-O 3.23Å; T1359-L1422 PolarHBondContact N-O 3.18Å; T1359-L1422 WeakPolarHBondContact O-CA 3.36Å; T1359-L1422 WeakPolarHBondContact O-CB 3.31Å; T1359-L1422 PolarHBondContact O-N 3.21Å; V1361-L1422 HydrophobicContact CB-CD1 4.36Å; V1361-L1422 HydrophobicContact CG2-CD1 3.65Å; V1361-L1422 HydrophobicContact CG2-CG 4.41Å; F1370-L1422 HydrophobicContact CE2-CD1 3.57Å; F1370-L1422 HydrophobicContact CZ-CD1 3.94Å; F1370-L1422 HydrophobicContact CZ-CD2 4.47Å; V1372-L1422 HydrophobicContact CG2-CD1 3.9Å; L1384-L1422 HydrophobicContact CD2-CD1 4.07Å; L1384-L1422 HydrophobicContact CD2-CD2 4.38Å; W1392-L1422 HydrophobicContact CH2-CD2 4.42Å; W1392-L1422 HydrophobicContact CZ3-CD2 3.93Å; I1420-L1422 HydrophobicContact CG2-CD2 3.66Å; I1420-L1422 HydrophobicContact CG2-CG 4.14Å; I1420-L1422 PolarHBondContact O-N 3.05Å; L1422-L1433 HydrophobicContact CB-CD1 4.25Å; L1422-S1434 CarbonylContact C-O 3.54Å; L1422-S1434 VanDerWaalsContact CA-O 3.27Å; L1422-S1434 WeakPolarHBondContact CA-O 3.35Å; L1422-V1435 HydrophobicContact CD2-CB 4.29Å; L1422-V1435 HydrophobicContact CD2-CG1 3.97Å; L1422-V1435 HydrophobicContact CD2-CG2 3.7Å
1423	T	89.2	Confident	77.6	Confident	25 Å²	25	51.5 Å²	51.5	15%	0.153	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	114	-179.7	-59.1	0	0	0	0	110.1	T1356 A1357 T1358 T1425 L1433 S1434	T1356-T1423 HydrophobicContact CG2-CG2 4.26Å; A1357-T1423 WeakPolarHBondContact O-CA 3.34Å; T1358-T1423 VanDerWaalsContact CG2-OG1 3.28Å; T1358-T1423 WeakPolarHBondContact CG2-OG1 3.38Å; T1358-T1423 WeakPolarHBondContact OG1-CB 3.32Å; T1358-T1423 VanDerWaalsContact OG1-CG2 3.28Å; T1358-T1423 WeakPolarHBondContact OG1-CG2 3.25Å; T1358-T1423 PolarHBondContact OG1-OG1 3.02Å; T1423-T1425 PolarHBondContact O-N 3.02Å; T1423-L1433 WeakPolarHBondContact O-CA 3.32Å; T1423-S1434 WeakPolarHBondContact CB-OG 3.43Å; T1423-S1434 PolarHBondContact N-O 2.88Å; T1423-S1434 PolarHBondContact O-N 2.92Å; T1423-S1434 PolarHBondContact O-OG 2.92Å; T1423-S1434 VanDerWaalsContact O-OG 3.06Å
1424	F	90.2	Very high	78.6	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	103.9	165.5	-58.1	-95.4	0	0	0	107.8	T1356 A1357 V1372 V1374 L1382 L1384 L1394 M1426 L1433	T1356-F1424 CarbonylContact C-O 3.54Å; T1356-F1424 VanDerWaalsContact CA-O 3.3Å; T1356-F1424 WeakPolarHBondContact CA-O 3.32Å; A1357-F1424 HydrophobicContact CB-CB 4.48Å; A1357-F1424 PolarHBondContact N-O 2.79Å; A1357-F1424 WeakPolarHBondContact O-CD2 3.09Å; A1357-F1424 PolarHBondContact O-N 3.15Å; V1372-F1424 HydrophobicContact CB-CZ 4.39Å; V1372-F1424 HydrophobicContact CG1-CE2 4.05Å; V1372-F1424 HydrophobicContact CG1-CZ 4.22Å; V1374-F1424 HydrophobicContact CG2-CD2 4.22Å; V1374-F1424 HydrophobicContact CG2-CE1 4.37Å; V1374-F1424 HydrophobicContact CG2-CE2 4.14Å; V1374-F1424 HydrophobicContact CG2-CG 4.45Å; V1374-F1424 HydrophobicContact CG2-CZ 4.27Å; L1382-F1424 HydrophobicContact CD2-CD1 3.89Å; L1382-F1424 HydrophobicContact CD2-CE1 4.18Å; L1384-F1424 HydrophobicContact CB-CE1 4.4Å; L1384-F1424 HydrophobicContact CB-CZ 4.04Å; L1384-F1424 HydrophobicContact CD2-CZ 4.17Å; L1394-F1424 HydrophobicContact CD1-CE1 3.96Å; F1424-M1426 HydrophobicContact CB-CE 3.83Å; F1424-M1426 HydrophobicContact CB-CG 4.49Å; F1424-M1426 HydrophobicContact CG-CE 4.41Å; F1424-M1426 PolarHBondContact O-N 3.05Å; F1424-L1433 HydrophobicContact CD1-CB 4.4Å; F1424-L1433 HydrophobicContact CD1-CD1 4.07Å; F1424-L1433 HydrophobicContact CD2-CD1 4.36Å; F1424-L1433 HydrophobicContact CE1-CD1 3.95Å; F1424-L1433 HydrophobicContact CE2-CD1 4.25Å; F1424-L1433 HydrophobicContact CG-CD1 4.28Å; F1424-L1433 HydrophobicContact CZ-CD1 4.05Å
1425	T	88.3	Confident	79.9	Confident	43.2 Å²	43.2	39.5 Å²	39.5	27%	0.265	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	120.1	168.8	-58.3	0	0	0	0	108	R1355 T1356 T1423 D1427 A1431 Q1432	R1355-T1425 CarbonylContact O-C 3.49Å; R1355-T1425 WeakPolarHBondContact O-CA 3.37Å; R1355-T1425 WeakPolarHBondContact O-CG2 3.48Å; T1356-T1425 HydrophobicContact CG2-CG2 4.38Å; T1423-T1425 PolarHBondContact O-N 3.02Å; T1425-D1427 HydrophobicContact CG2-CB 4.35Å; T1425-A1431 CarbonylContact O-C 3.46Å; T1425-A1431 VanDerWaalsContact O-CA 3.29Å; T1425-A1431 WeakPolarHBondContact O-CA 3.32Å; T1425-Q1432 PolarHBondContact N-O 3.09Å; T1425-Q1432 PolarHBondContact O-N 2.9Å
1426	M	86.1	Confident	81.3	Confident	6 Å²	6	38.2 Å²	38.2	3%	0.03	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	117.1	-177.4	-47.3	-176.3	-166.4	0	0	109	L1353 P1354 R1355 A1357 V1374 M1376 F1424 F1430 L1446 V1451	L1353-M1426 HydrophobicContact CD1-SD 4.08Å; L1353-M1426 HydrophobicContact CD2-CB 3.84Å; L1353-M1426 HydrophobicContact CD2-SD 4.36Å; L1353-M1426 HydrophobicContact CG-CB 4.25Å; L1353-M1426 HydrophobicContact CG-SD 4.22Å; P1354-M1426 HydrophobicContact CG-SD 4.43Å; P1354-M1426 WeakPolarHBondContact O-CB 3.39Å; R1355-M1426 PolarHBondContact O-N 2.97Å; A1357-M1426 HydrophobicContact CB-CE 3.74Å; V1374-M1426 HydrophobicContact CG1-CE 4.12Å; M1376-M1426 HydrophobicContact CE-CE 3.51Å; M1376-M1426 HydrophobicContact CE-SD 3.8Å; M1376-M1426 WeakPolarHBondContact CE-SD 3.12Å; M1376-M1426 HydrophobicContact SD-SD 4.45Å; F1424-M1426 HydrophobicContact CB-CE 3.83Å; F1424-M1426 HydrophobicContact CB-CG 4.49Å; F1424-M1426 HydrophobicContact CG-CE 4.41Å; F1424-M1426 PolarHBondContact O-N 3.05Å; M1426-F1430 CarbonylContact C-O 3.59Å; M1426-F1430 VanDerWaalsContact CA-O 3.3Å; M1426-F1430 WeakPolarHBondContact CA-O 3.4Å; M1426-L1446 HydrophobicContact CB-CD1 4.33Å; M1426-L1446 HydrophobicContact CB-CD2 4.44Å; M1426-L1446 HydrophobicContact CG-CD2 4.27Å; M1426-L1446 HydrophobicContact SD-CD2 4.39Å; M1426-V1451 HydrophobicContact CE-CG2 4.15Å; M1426-V1451 HydrophobicContact SD-CG2 4.02Å
1427	D	76.5	Confident	81.9	Confident	69.6 Å²	69.6	39.5 Å²	39.5	37%	0.372	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	132.5	-169.9	171.5	50.1	0	0	0	110.2	T1425 G1429 F1430 K1443	T1425-D1427 HydrophobicContact CG2-CB 4.35Å; D1427-G1429 VanDerWaalsContact C-N 3.27Å; D1427-G1429 PolarHBondContact O-N 2.94Å; D1427-G1429 VanDerWaalsContact O-N 3.12Å; D1427-F1430 PolarHBondContact N-O 2.92Å; D1427-F1430 PolarHBondContact O-N 3.09Å; D1427-F1430 VanDerWaalsContact O-O 3.12Å; D1427-K1443 IonicContact OD2-NZ 3.17Å; D1427-K1443 PolarHBondContact OD2-NZ 3.15Å
1428	N	72	Confident	82.1	Confident	115.6 Å²	115.6	40.8 Å²	40.8	62%	0.618	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.8	40.2	176.2	-72.6	-45.1	0	0	0	114.6	F1430	N1428-F1430 VanDerWaalsContact C-N 3.33Å; N1428-F1430 WeakPolarHBondContact O-CD2 3.39Å; N1428-F1430 WeakPolarHBondContact O-CE2 3.36Å; N1428-F1430 PolarHBondContact O-N 3.07Å
1429	G	77.1	Confident	82.7	Confident	39 Å²	39	37 Å²	37	40%	0.402	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.8	5.9	-179.9	0	0	0	0	0	115.7	D1427 L1446	D1427-G1429 VanDerWaalsContact C-N 3.27Å; D1427-G1429 PolarHBondContact O-N 2.94Å; D1427-G1429 VanDerWaalsContact O-N 3.12Å; G1429-L1446 WeakPolarHBondContact O-CB 3.44Å; G1429-L1446 WeakPolarHBondContact O-CG 3.43Å; G1429-L1446 PolarHBondContact O-N 2.9Å
1430	F	84.5	Confident	82.8	Confident	83.2 Å²	83.2	36.4 Å²	36.4	37%	0.365	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	140.6	177.5	-58.8	-92	0	0	0	112.1	M1426 D1427 N1428 K1443 F1444 P1445	M1426-F1430 CarbonylContact C-O 3.59Å; M1426-F1430 VanDerWaalsContact CA-O 3.3Å; M1426-F1430 WeakPolarHBondContact CA-O 3.4Å; D1427-F1430 PolarHBondContact N-O 2.92Å; D1427-F1430 PolarHBondContact O-N 3.09Å; D1427-F1430 VanDerWaalsContact O-O 3.12Å; N1428-F1430 VanDerWaalsContact C-N 3.33Å; N1428-F1430 WeakPolarHBondContact O-CD2 3.39Å; N1428-F1430 WeakPolarHBondContact O-CE2 3.36Å; N1428-F1430 PolarHBondContact O-N 3.07Å; F1430-K1443 HydrophobicContact CB-CB 4.02Å; F1430-K1443 HydrophobicContact CB-CD 4.12Å; F1430-K1443 HydrophobicContact CB-CG 4.26Å; F1430-K1443 HydrophobicContact CD1-CB 4.14Å; F1430-K1443 HydrophobicContact CD2-CD 4.31Å; F1430-K1443 HydrophobicContact CG-CB 4.18Å; F1430-K1443 HydrophobicContact CG-CD 4.28Å; F1430-F1444 CarbonylContact C-O 3.57Å; F1430-F1444 VanDerWaalsContact CA-O 3.27Å; F1430-F1444 WeakPolarHBondContact CA-O 3.32Å; F1430-P1445 HydrophobicContact CD1-CB 4.13Å; F1430-P1445 HydrophobicContact CD1-CG 4.29Å; F1430-P1445 HydrophobicContact CE1-CB 4.12Å; F1430-P1445 HydrophobicContact CE1-CG 4.14Å
1431	A	87	Confident	82.7	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	144.5	159.8	0	0	0	0	0	110.6	L1382 T1425 K1443 F1444 L1446	L1382-A1431 HydrophobicContact CD1-CB 3.88Å; L1382-A1431 HydrophobicContact CD2-CB 3.77Å; T1425-A1431 CarbonylContact O-C 3.46Å; T1425-A1431 VanDerWaalsContact O-CA 3.29Å; T1425-A1431 WeakPolarHBondContact O-CA 3.32Å; A1431-K1443 WeakPolarHBondContact O-CA 3.36Å; A1431-F1444 PolarHBondContact N-O 3.01Å; A1431-F1444 WeakPolarHBondContact O-CA 3.49Å; A1431-F1444 WeakPolarHBondContact O-CB 3.16Å; A1431-F1444 PolarHBondContact O-N 3.07Å; A1431-L1446 HydrophobicContact CB-CD2 3.57Å; A1431-L1446 VanDerWaalsContact CB-CD2 3.49Å; A1431-L1446 HydrophobicContact CB-CG 4.43Å; A1431-L1446 VanDerWaalsContact N-CD2 3.31Å
1432	Q	88.4	Confident	82.5	Confident	47.4 Å²	47.4	43.6 Å²	43.6	22%	0.221	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	123.1	159.4	-168.6	166.8	28.8	0	0	108.9	T1425 N1439 S1441 K1442 K1443	T1425-Q1432 PolarHBondContact N-O 3.09Å; T1425-Q1432 PolarHBondContact O-N 2.9Å; Q1432-N1439 VanDerWaalsContact CD-ND2 3.33Å; Q1432-N1439 VanDerWaalsContact CD-OD1 3.3Å; Q1432-N1439 HydrophobicContact CG-CB 4.42Å; Q1432-N1439 WeakPolarHBondContact CG-OD1 3.34Å; Q1432-N1439 PolarHBondContact NE2-ND2 2.79Å; Q1432-N1439 PolarHBondContact OE1-ND2 2.85Å; Q1432-N1439 PolarHBondContact OE1-OD1 2.72Å; Q1432-S1441 WeakPolarHBondContact CG-O 3.13Å; Q1432-S1441 PolarHBondContact NE2-O 3.1Å; Q1432-S1441 VanDerWaalsContact NE2-O 3.17Å; Q1432-K1442 WeakPolarHBondContact CG-O 3.41Å; Q1432-K1443 HydrophobicContact CB-CG 4.4Å; Q1432-K1443 HydrophobicContact CG-CG 4.27Å
1433	L	90.3	Very high	82	Confident	0.2 Å²	0.2	48.8 Å²	48.8	0%	0.001	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	126.8	177.7	177.5	67.4	0	0	0	110.5	L1384 L1394 F1408 L1422 T1423 F1424 V1435 N1439 I1440 S1441	L1384-L1433 HydrophobicContact CD1-CD2 3.72Å; L1384-L1433 HydrophobicContact CD2-CD1 4.4Å; L1384-L1433 HydrophobicContact CD2-CD2 3.75Å; L1384-L1433 HydrophobicContact CG-CD2 4.32Å; L1394-L1433 HydrophobicContact CD2-CB 4.42Å; F1408-L1433 HydrophobicContact CE2-CD2 3.82Å; F1408-L1433 HydrophobicContact CZ-CD2 3.59Å; F1408-L1433 VanDerWaalsContact CZ-CD2 3.5Å; L1422-L1433 HydrophobicContact CB-CD1 4.25Å; T1423-L1433 WeakPolarHBondContact O-CA 3.32Å; F1424-L1433 HydrophobicContact CD1-CB 4.4Å; F1424-L1433 HydrophobicContact CD1-CD1 4.07Å; F1424-L1433 HydrophobicContact CD2-CD1 4.36Å; F1424-L1433 HydrophobicContact CE1-CD1 3.95Å; F1424-L1433 HydrophobicContact CE2-CD1 4.25Å; F1424-L1433 HydrophobicContact CG-CD1 4.28Å; F1424-L1433 HydrophobicContact CZ-CD1 4.05Å; L1433-V1435 HydrophobicContact CD1-CG2 4.4Å; L1433-V1435 HydrophobicContact CD2-CG2 4.29Å; L1433-V1435 HydrophobicContact CG-CG2 4.29Å; L1433-N1439 CarbonylContact O-C 3.55Å; L1433-N1439 WeakPolarHBondContact O-CA 3.44Å; L1433-I1440 HydrophobicContact CD2-CD1 4.14Å; L1433-I1440 HydrophobicContact CD2-CG1 4.3Å; L1433-I1440 HydrophobicContact CG-CG1 4.29Å; L1433-I1440 PolarHBondContact O-N 2.97Å; L1433-S1441 WeakPolarHBondContact CA-OG 3.39Å; L1433-S1441 VanDerWaalsContact CB-OG 3.32Å; L1433-S1441 WeakPolarHBondContact CB-OG 3.36Å; L1433-S1441 PolarHBondContact N-OG 3.18Å; L1433-S1441 PolarHBondContact O-N 3.03Å; L1433-S1441 PolarHBondContact O-OG 2.66Å
1434	S	86.6	Confident	81.7	Confident	6.8 Å²	6.8	47.8 Å²	47.8	5%	0.048	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	142.6	164.3	46.2	0	0	0	0	112	L1422 T1423 G1437 T1438 N1439	L1422-S1434 CarbonylContact C-O 3.54Å; L1422-S1434 VanDerWaalsContact CA-O 3.27Å; L1422-S1434 WeakPolarHBondContact CA-O 3.35Å; T1423-S1434 WeakPolarHBondContact CB-OG 3.43Å; T1423-S1434 PolarHBondContact N-O 2.88Å; T1423-S1434 PolarHBondContact O-N 2.92Å; T1423-S1434 PolarHBondContact O-OG 2.92Å; T1423-S1434 VanDerWaalsContact O-OG 3.06Å; S1434-G1437 WeakPolarHBondContact CB-O 3.4Å; S1434-G1437 PolarHBondContact OG-O 2.87Å; S1434-T1438 CarbonylContact C-O 3.56Å; S1434-T1438 WeakPolarHBondContact CA-O 3.27Å; S1434-T1438 VanDerWaalsContact CB-O 3.29Å; S1434-T1438 WeakPolarHBondContact CB-O 3.27Å; S1434-N1439 WeakPolarHBondContact CB-OD1 3.3Å; S1434-N1439 PolarHBondContact OG-OD1 3.13Å
1435	V	85	Confident	81.3	Confident	4.6 Å²	4.6	49.2 Å²	49.2	3%	0.028	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	129.5	176.1	-176.1	0	0	0	0	107.6	W1392 P1410 L1412 I1420 P1421 L1422 L1433 G1437 T1438 I1440	W1392-V1435 HydrophobicContact CE3-CG2 4.17Å; W1392-V1435 HydrophobicContact CH2-CG1 4.14Å; W1392-V1435 HydrophobicContact CZ3-CB 4.48Å; W1392-V1435 HydrophobicContact CZ3-CG1 3.97Å; W1392-V1435 HydrophobicContact CZ3-CG2 4.11Å; P1410-V1435 HydrophobicContact CB-CG1 4.32Å; P1410-V1435 HydrophobicContact CB-CG2 4.47Å; L1412-V1435 HydrophobicContact CD2-CG1 3.92Å; I1420-V1435 HydrophobicContact CG2-CG1 3.6Å; I1420-V1435 VanDerWaalsContact CG2-CG1 3.45Å; P1421-V1435 CarbonylContact O-C 3.6Å; P1421-V1435 WeakPolarHBondContact O-CA 3.35Å; L1422-V1435 HydrophobicContact CD2-CB 4.29Å; L1422-V1435 HydrophobicContact CD2-CG1 3.97Å; L1422-V1435 HydrophobicContact CD2-CG2 3.7Å; L1433-V1435 HydrophobicContact CD1-CG2 4.4Å; L1433-V1435 HydrophobicContact CD2-CG2 4.29Å; L1433-V1435 HydrophobicContact CG-CG2 4.29Å; V1435-G1437 PolarHBondContact O-N 3.03Å; V1435-G1437 VanDerWaalsContact O-N 3.14Å; V1435-T1438 PolarHBondContact N-O 2.88Å; V1435-T1438 WeakPolarHBondContact O-CB 3.37Å; V1435-T1438 PolarHBondContact O-N 3.06Å; V1435-I1440 HydrophobicContact CB-CD1 3.82Å; V1435-I1440 HydrophobicContact CB-CG1 4.33Å; V1435-I1440 HydrophobicContact CB-CG2 4.44Å; V1435-I1440 HydrophobicContact CG2-CD1 3.67Å; V1435-I1440 HydrophobicContact CG2-CG1 4.12Å
1436	N	78.4	Confident	81.2	Confident	45.4 Å²	45.4	47.9 Å²	47.9	24%	0.243	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.9	34.5	-172.7	-64.1	-21.4	0	0	0	112.6	L1412 D1416 P1421 T1438	L1412-N1436 WeakPolarHBondContact CD2-ND2 3.29Å; D1416-N1436 PolarHBondContact OD2-ND2 3.06Å; D1416-N1436 VanDerWaalsContact OD2-ND2 3.16Å; P1421-N1436 VanDerWaalsContact CD-OD1 3.26Å; P1421-N1436 WeakPolarHBondContact CD-OD1 3.32Å; P1421-N1436 VanDerWaalsContact CG-OD1 3.27Å; P1421-N1436 WeakPolarHBondContact CG-OD1 3.01Å; P1421-N1436 PolarHBondContact O-N 3.06Å; P1421-N1436 VanDerWaalsContact O-N 3.09Å; N1436-T1438 VanDerWaalsContact C-N 3.27Å; N1436-T1438 PolarHBondContact O-N 2.92Å
1437	G	72.9	Confident	81.2	Confident	52.8 Å²	52.8	48.2 Å²	48.2	54%	0.544	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.9	-6.1	-177.3	0	0	0	0	0	115.7	S1434 V1435	S1434-G1437 WeakPolarHBondContact CB-O 3.4Å; S1434-G1437 PolarHBondContact OG-O 2.87Å; V1435-G1437 PolarHBondContact O-N 3.03Å; V1435-G1437 VanDerWaalsContact O-N 3.14Å
1438	T	75.3	Confident	81.4	Confident	82.2 Å²	82.2	45.8 Å²	45.8	50%	0.504	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	125.7	177.1	-54.1	0	0	0	0	109.9	S1434 V1435 N1436 I1440	S1434-T1438 CarbonylContact C-O 3.56Å; S1434-T1438 WeakPolarHBondContact CA-O 3.27Å; S1434-T1438 VanDerWaalsContact CB-O 3.29Å; S1434-T1438 WeakPolarHBondContact CB-O 3.27Å; V1435-T1438 PolarHBondContact N-O 2.88Å; V1435-T1438 WeakPolarHBondContact O-CB 3.37Å; V1435-T1438 PolarHBondContact O-N 3.06Å; N1436-T1438 VanDerWaalsContact C-N 3.27Å; N1436-T1438 PolarHBondContact O-N 2.92Å; T1438-I1440 HydrophobicContact CG2-CG1 4.46Å; T1438-I1440 WeakPolarHBondContact O-CG1 3.38Å; T1438-I1440 PolarHBondContact O-N 2.89Å
1439	N	80.3	Confident	81.5	Confident	73.4 Å²	73.4	45.6 Å²	45.6	39%	0.393	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	124.7	173.9	-75.5	-18.5	0	0	0	109.6	Q1432 L1433 S1434	Q1432-N1439 VanDerWaalsContact CD-ND2 3.33Å; Q1432-N1439 VanDerWaalsContact CD-OD1 3.3Å; Q1432-N1439 HydrophobicContact CG-CB 4.42Å; Q1432-N1439 WeakPolarHBondContact CG-OD1 3.34Å; Q1432-N1439 PolarHBondContact NE2-ND2 2.79Å; Q1432-N1439 PolarHBondContact OE1-ND2 2.85Å; Q1432-N1439 PolarHBondContact OE1-OD1 2.72Å; L1433-N1439 CarbonylContact O-C 3.55Å; L1433-N1439 WeakPolarHBondContact O-CA 3.44Å; S1434-N1439 WeakPolarHBondContact CB-OD1 3.3Å; S1434-N1439 PolarHBondContact OG-OD1 3.13Å
1440	I	78.8	Confident	81.6	Confident	42.4 Å²	42.4	48.3 Å²	48.3	22%	0.217	26%	0.256	C	S	.	.			trans	-120.5	-16.6	179.6	4.2	-177.2	0	0	0	113.3	F1408 P1410 L1433 V1435 T1438	F1408-I1440 HydrophobicContact CB-CG2 3.89Å; F1408-I1440 WeakPolarHBondContact CB-O 3.44Å; F1408-I1440 HydrophobicContact CD2-CB 4.39Å; F1408-I1440 HydrophobicContact CD2-CD1 3.47Å; F1408-I1440 VanDerWaalsContact CD2-CD1 3.47Å; F1408-I1440 HydrophobicContact CD2-CG1 4.03Å; F1408-I1440 HydrophobicContact CD2-CG2 3.57Å; F1408-I1440 WeakPolarHBondContact CD2-O 3.33Å; F1408-I1440 HydrophobicContact CE2-CD1 3.43Å; F1408-I1440 VanDerWaalsContact CE2-CD1 3.43Å; F1408-I1440 HydrophobicContact CE2-CG1 4.08Å; F1408-I1440 HydrophobicContact CE2-CG2 4.44Å; F1408-I1440 HydrophobicContact CG-CD1 4.45Å; F1408-I1440 HydrophobicContact CG-CG2 3.92Å; F1408-I1440 VanDerWaalsContact CG-O 3.28Å; F1408-I1440 WeakPolarHBondContact CG-O 3.41Å; F1408-I1440 HydrophobicContact CZ-CD1 4.4Å; P1410-I1440 HydrophobicContact CB-CD1 3.86Å; P1410-I1440 HydrophobicContact CG-CD1 4.47Å; L1433-I1440 HydrophobicContact CD2-CD1 4.14Å; L1433-I1440 HydrophobicContact CD2-CG1 4.3Å; L1433-I1440 HydrophobicContact CG-CG1 4.29Å; L1433-I1440 PolarHBondContact O-N 2.97Å; V1435-I1440 HydrophobicContact CB-CD1 3.82Å; V1435-I1440 HydrophobicContact CB-CG1 4.33Å; V1435-I1440 HydrophobicContact CB-CG2 4.44Å; V1435-I1440 HydrophobicContact CG2-CD1 3.67Å; V1435-I1440 HydrophobicContact CG2-CG1 4.12Å; T1438-I1440 HydrophobicContact CG2-CG1 4.46Å; T1438-I1440 WeakPolarHBondContact O-CG1 3.38Å; T1438-I1440 PolarHBondContact O-N 2.89Å
1441	S	79	Confident	81.3	Confident	6.6 Å²	6.6	44.6 Å²	44.6	5%	0.046	24%	0.24	C	C	.	.	S	Bend	trans	-96.9	154.7	167.9	79.7	0	0	0	0	111.5	Q1432 L1433	Q1432-S1441 WeakPolarHBondContact CG-O 3.13Å; Q1432-S1441 PolarHBondContact NE2-O 3.1Å; Q1432-S1441 VanDerWaalsContact NE2-O 3.17Å; L1433-S1441 WeakPolarHBondContact CA-OG 3.39Å; L1433-S1441 VanDerWaalsContact CB-OG 3.32Å; L1433-S1441 WeakPolarHBondContact CB-OG 3.36Å; L1433-S1441 PolarHBondContact N-OG 3.18Å; L1433-S1441 PolarHBondContact O-N 3.03Å; L1433-S1441 PolarHBondContact O-OG 2.66Å
1442	K	77.6	Confident	80.8	Confident	171.4 Å²	171.4	47.7 Å²	47.7	75%	0.745	25%	0.254	S	S	*	.	P	Polyproline II helix	trans	-67.1	165	157.2	-64.5	-177.8	179.4	-179.5	0	109.3	Q1432 F1444	Q1432-K1442 WeakPolarHBondContact CG-O 3.41Å; K1442-F1444 PolarHBondContact O-N 2.91Å
1443	K	79.3	Confident	80.4	Confident	110.8 Å²	110.8	48.6 Å²	48.6	48%	0.482	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-56.5	125.8	168.5	-80.7	-164.2	171.5	-160.5	0	109	D1427 F1430 A1431 Q1432	D1427-K1443 IonicContact OD2-NZ 3.17Å; D1427-K1443 PolarHBondContact OD2-NZ 3.15Å; F1430-K1443 HydrophobicContact CB-CB 4.02Å; F1430-K1443 HydrophobicContact CB-CD 4.12Å; F1430-K1443 HydrophobicContact CB-CG 4.26Å; F1430-K1443 HydrophobicContact CD1-CB 4.14Å; F1430-K1443 HydrophobicContact CD2-CD 4.31Å; F1430-K1443 HydrophobicContact CG-CB 4.18Å; F1430-K1443 HydrophobicContact CG-CD 4.28Å; A1431-K1443 WeakPolarHBondContact O-CA 3.36Å; Q1432-K1443 HydrophobicContact CB-CG 4.4Å; Q1432-K1443 HydrophobicContact CG-CG 4.27Å
1444	F	82.3	Confident	80.1	Confident	3.6 Å²	3.6	49.2 Å²	49.2	2%	0.016	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	125.3	-168.5	-175	-87.7	0	0	0	109.6	L1382 L1394 R1396 K1404 T1406 F1430 A1431 K1442 L1446	L1382-F1444 HydrophobicContact CD1-CD1 3.52Å; L1382-F1444 HydrophobicContact CD1-CE1 3.5Å; L1382-F1444 VanDerWaalsContact CD1-CE1 3.45Å; L1382-F1444 HydrophobicContact CD1-CG 4.35Å; L1382-F1444 HydrophobicContact CD1-CZ 4.48Å; L1394-F1444 HydrophobicContact CB-CE2 4.47Å; L1394-F1444 HydrophobicContact CD2-CB 3.87Å; L1394-F1444 HydrophobicContact CD2-CD1 4Å; L1394-F1444 HydrophobicContact CD2-CD2 3.99Å; L1394-F1444 HydrophobicContact CD2-CG 3.73Å; L1394-F1444 HydrophobicContact CG-CD1 4.15Å; L1394-F1444 HydrophobicContact CG-CD2 4.22Å; L1394-F1444 HydrophobicContact CG-CE1 4.3Å; L1394-F1444 HydrophobicContact CG-CE2 4.34Å; L1394-F1444 HydrophobicContact CG-CG 4.19Å; L1394-F1444 HydrophobicContact CG-CZ 4.31Å; L1394-F1444 VanDerWaalsContact O-CE2 3.28Å; L1394-F1444 WeakPolarHBondContact O-CE2 3.39Å; L1394-F1444 WeakPolarHBondContact O-CZ 3.27Å; R1396-F1444 HydrophobicContact CB-CE1 3.86Å; R1396-F1444 HydrophobicContact CB-CZ 3.98Å; K1404-F1444 HydrophobicContact CB-CE2 4.21Å; K1404-F1444 HydrophobicContact CB-CZ 4.12Å; K1404-F1444 HydrophobicContact CD-CE2 4.48Å; K1404-F1444 HydrophobicContact CG-CE2 4.05Å; K1404-F1444 HydrophobicContact CG-CZ 4.23Å; K1404-F1444 WeakPolarHBondContact O-CE2 3.24Å; K1404-F1444 WeakPolarHBondContact O-CZ 3.3Å; T1406-F1444 VanDerWaalsContact OG1-CD2 3.24Å; T1406-F1444 WeakPolarHBondContact OG1-CD2 3.28Å; T1406-F1444 WeakPolarHBondContact OG1-CE2 3.37Å; F1430-F1444 CarbonylContact C-O 3.57Å; F1430-F1444 VanDerWaalsContact CA-O 3.27Å; F1430-F1444 WeakPolarHBondContact CA-O 3.32Å; A1431-F1444 PolarHBondContact N-O 3.01Å; A1431-F1444 WeakPolarHBondContact O-CA 3.49Å; A1431-F1444 WeakPolarHBondContact O-CB 3.16Å; A1431-F1444 PolarHBondContact O-N 3.07Å; K1442-F1444 PolarHBondContact O-N 2.91Å; F1444-L1446 PolarHBondContact O-N 3.22Å
1445	P	82.5	Confident	79.9	Confident	29.8 Å²	29.8	50.2 Å²	50.2	19%	0.194	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61	138	-174	-14.8	22	0	0	0	113	K1404 F1430	K1404-P1445 HydrophobicContact CD-CG 4.2Å; F1430-P1445 HydrophobicContact CD1-CB 4.13Å; F1430-P1445 HydrophobicContact CD1-CG 4.29Å; F1430-P1445 HydrophobicContact CE1-CB 4.12Å; F1430-P1445 HydrophobicContact CE1-CG 4.14Å
1446	L	86.1	Confident	79.8	Confident	14.2 Å²	14.2	50.2 Å²	50.2	7%	0.074	27%	0.266	C	S	.	.			trans	-71.8	144.7	176.7	-62.4	172.9	0	0	0	111.3	L1353 M1376 L1382 R1396 M1426 G1429 A1431 F1444 G1448	L1353-L1446 HydrophobicContact CD1-CD1 4.13Å; L1353-L1446 HydrophobicContact CD2-CD1 3.74Å; L1353-L1446 VanDerWaalsContact CD2-CD1 3.42Å; L1353-L1446 HydrophobicContact CG-CD1 4.43Å; M1376-L1446 HydrophobicContact CE-CB 4.42Å; M1376-L1446 HydrophobicContact CE-CD1 4.25Å; M1376-L1446 HydrophobicContact CE-CD2 3.88Å; M1376-L1446 HydrophobicContact CE-CG 4.39Å; M1376-L1446 HydrophobicContact SD-CB 4.37Å; M1376-L1446 HydrophobicContact SD-CD2 3.98Å; L1382-L1446 HydrophobicContact CD2-CD2 4.28Å; R1396-L1446 PolarHBondContact NE-O 2.92Å; R1396-L1446 VanDerWaalsContact NE-O 3.14Å; R1396-L1446 PolarHBondContact NH2-O 2.88Å; M1426-L1446 HydrophobicContact CB-CD1 4.33Å; M1426-L1446 HydrophobicContact CB-CD2 4.44Å; M1426-L1446 HydrophobicContact CG-CD2 4.27Å; M1426-L1446 HydrophobicContact SD-CD2 4.39Å; G1429-L1446 WeakPolarHBondContact O-CB 3.44Å; G1429-L1446 WeakPolarHBondContact O-CG 3.43Å; G1429-L1446 PolarHBondContact O-N 2.9Å; A1431-L1446 HydrophobicContact CB-CD2 3.57Å; A1431-L1446 VanDerWaalsContact CB-CD2 3.49Å; A1431-L1446 HydrophobicContact CB-CG 4.43Å; A1431-L1446 VanDerWaalsContact N-CD2 3.31Å; F1444-L1446 PolarHBondContact O-N 3.22Å; L1446-G1448 VanDerWaalsContact C-N 3.3Å; L1446-G1448 WeakPolarHBondContact CB-O 3.41Å
1447	P	85.3	Confident	80.2	Confident	12.4 Å²	12.4	50.7 Å²	50.7	8%	0.081	27%	0.269	C	S	.	.	S	Bend	trans	-77.5	-17.4	170.3	25.2	-27.2	0	0	0	113.4	M1376 A1380 T1381 L1382 R1396 I1398	M1376-P1447 HydrophobicContact CB-CG 4.38Å; M1376-P1447 HydrophobicContact CG-CG 4.4Å; M1376-P1447 HydrophobicContact SD-CG 3.97Å; A1380-P1447 HydrophobicContact CB-CB 3.99Å; A1380-P1447 HydrophobicContact CB-CG 4.36Å; A1380-P1447 VanDerWaalsContact CB-O 3.31Å; A1380-P1447 WeakPolarHBondContact CB-O 3.39Å; T1381-P1447 VanDerWaalsContact C-CG 3.44Å; L1382-P1447 HydrophobicContact CB-CG 3.78Å; L1382-P1447 VanDerWaalsContact N-CG 3.34Å; R1396-P1447 HydrophobicContact CG-CB 3.64Å; R1396-P1447 HydrophobicContact CG-CG 4.3Å; I1398-P1447 HydrophobicContact CD1-CB 4.28Å; I1398-P1447 HydrophobicContact CG1-CB 4.03Å
1448	G	81.1	Confident	80.7	Confident	20.6 Å²	20.6	50 Å²	50	21%	0.212	26%	0.261	C	S	.	.			trans	-160.6	176.9	179.1	0	0	0	0	0	112.8	M1376 L1446	M1376-G1448 VanDerWaalsContact CE-O 3.31Å; M1376-G1448 WeakPolarHBondContact CE-O 3.4Å; M1376-G1448 WeakPolarHBondContact O-CA 3.37Å; L1446-G1448 VanDerWaalsContact C-N 3.3Å; L1446-G1448 WeakPolarHBondContact CB-O 3.41Å
1449	N	74.3	Confident	81.2	Confident	110.6 Å²	110.6	48 Å²	48	59%	0.591	25%	0.247	S	C	*	.	S	Bend	trans	-109.4	3.7	-169.6	63.8	-14.2	0	0	0	114.8	L1353	L1353-N1449 WeakPolarHBondContact CB-O 3.4Å; L1353-N1449 WeakPolarHBondContact CD1-O 3.35Å; L1353-N1449 WeakPolarHBondContact CG-O 3.28Å
1450	R	77.5	Confident	81.2	Confident	96.6 Å²	96.6	44.7 Å²	44.7	37%	0.365	23%	0.23	S	C	.	.	S	Bend	trans	-131.2	173	171.4	64.1	-174.8	-173.5	-153.9	6.8	110.1	M1376 E1452	M1376-R1450 CarbonylContact C-O 3.46Å; M1376-R1450 WeakPolarHBondContact CA-O 3.29Å; M1376-R1450 VanDerWaalsContact CB-O 3.25Å; M1376-R1450 WeakPolarHBondContact CB-O 3.3Å; M1376-R1450 VanDerWaalsContact CE-O 3.29Å; M1376-R1450 WeakPolarHBondContact CE-O 3.31Å; M1376-R1450 VanDerWaalsContact CG-O 3.31Å; M1376-R1450 WeakPolarHBondContact CG-O 3.49Å; R1450-E1452 HydrophobicContact CG-CG 4.15Å; R1450-E1452 IonicContact CZ-OE1 3.29Å; R1450-E1452 IonicContact NE-OE1 3.36Å; R1450-E1452 PolarHBondContact NE-OE1 3.09Å; R1450-E1452 IonicContact NH2-OE1 3.33Å; R1450-E1452 PolarHBondContact NH2-OE1 3.07Å
1451	V	79.2	Confident	80.8	Confident	5.8 Å²	5.8	45.5 Å²	45.5	4%	0.035	24%	0.235	C	C	.	.			trans	-122.8	116.8	168.5	175.6	0	0	0	0	108.6	W1344 L1353 P1354 V1374 K1375 M1376 M1426 V1454 M1467	W1344-V1451 VanDerWaalsContact CZ3-O 3.29Å; W1344-V1451 WeakPolarHBondContact CZ3-O 3.04Å; L1353-V1451 HydrophobicContact CD1-CG2 4.24Å; L1353-V1451 HydrophobicContact CD2-CG2 4.37Å; P1354-V1451 HydrophobicContact CG-CB 4.11Å; P1354-V1451 HydrophobicContact CG-CG2 3.7Å; V1374-V1451 HydrophobicContact CG1-CB 4.46Å; V1374-V1451 HydrophobicContact CG1-CG1 3.82Å; V1374-V1451 HydrophobicContact CG1-CG2 3.98Å; K1375-V1451 CarbonylContact O-C 3.56Å; K1375-V1451 WeakPolarHBondContact O-CA 3.29Å; M1376-V1451 HydrophobicContact CE-CG2 3.96Å; M1376-V1451 HydrophobicContact CG-CG2 4.25Å; M1426-V1451 HydrophobicContact CE-CG2 4.15Å; M1426-V1451 HydrophobicContact SD-CG2 4.02Å; V1451-V1454 HydrophobicContact CG1-CG2 4.21Å; V1451-M1467 HydrophobicContact CB-SD 4.3Å; V1451-M1467 HydrophobicContact CG1-CE 3.74Å; V1451-M1467 HydrophobicContact CG1-SD 4.22Å
1452	E	76.9	Confident	80.3	Confident	64.8 Å²	64.8	46 Å²	46	30%	0.303	24%	0.238	S	C	.	.			trans	-93.9	-32.7	-177	-63.1	179.5	159.4	0	0	112.2	S1342 K1375 G1377 P1378 R1450	S1342-E1452 PolarHBondContact OG-O 2.61Å; K1375-E1452 HydrophobicContact CB-CB 4.26Å; K1375-E1452 PolarHBondContact O-N 3.22Å; G1377-E1452 VanDerWaalsContact C-CD 3.44Å; G1377-E1452 VanDerWaalsContact C-OE2 3.31Å; G1377-E1452 VanDerWaalsContact CA-CD 3.42Å; G1377-E1452 VanDerWaalsContact CA-OE1 3.26Å; G1377-E1452 WeakPolarHBondContact CA-OE1 3.31Å; G1377-E1452 VanDerWaalsContact CA-OE2 3.29Å; G1377-E1452 WeakPolarHBondContact CA-OE2 3.37Å; G1377-E1452 PolarHBondContact N-OE2 2.88Å; G1377-E1452 VanDerWaalsContact N-OE2 3.13Å; P1378-E1452 VanDerWaalsContact CD-OE1 3.27Å; P1378-E1452 WeakPolarHBondContact CD-OE1 3.37Å; R1450-E1452 HydrophobicContact CG-CG 4.15Å; R1450-E1452 IonicContact CZ-OE1 3.29Å; R1450-E1452 IonicContact NE-OE1 3.36Å; R1450-E1452 PolarHBondContact NE-OE1 3.09Å; R1450-E1452 IonicContact NH2-OE1 3.33Å; R1450-E1452 PolarHBondContact NH2-OE1 3.07Å
1453	K	80.2	Confident	80.3	Confident	66.6 Å²	66.6	39.6 Å²	39.6	29%	0.29	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.2	153.8	-175.6	-164.5	171.1	175.4	-136.3	0	110.8	I1324 F1341 V1374 K1375 D1455	I1324-K1453 HydrophobicContact CD1-CD 3.89Å; I1324-K1453 HydrophobicContact CD1-CG 4.13Å; F1341-K1453 WeakPolarHBondContact O-CE 3.15Å; V1374-K1453 CarbonylContact C-O 3.54Å; V1374-K1453 WeakPolarHBondContact CA-O 3.48Å; K1375-K1453 HydrophobicContact CB-CB 4.02Å; K1375-K1453 WeakPolarHBondContact CB-O 3.39Å; K1375-K1453 HydrophobicContact CG-CB 4.19Å; K1375-K1453 PolarHBondContact N-O 3.22Å; K1375-K1453 PolarHBondContact O-N 2.83Å; K1453-D1455 VanDerWaalsContact CD-OD2 3.3Å; K1453-D1455 WeakPolarHBondContact CD-OD2 3.4Å; K1453-D1455 VanDerWaalsContact CE-CG 3.47Å; K1453-D1455 WeakPolarHBondContact CE-OD1 3.32Å; K1453-D1455 VanDerWaalsContact CE-OD2 3.29Å; K1453-D1455 WeakPolarHBondContact CE-OD2 3.36Å; K1453-D1455 WeakPolarHBondContact CG-OD1 3.4Å; K1453-D1455 IonicContact NZ-OD1 3.27Å; K1453-D1455 PolarHBondContact NZ-OD1 3.09Å; K1453-D1455 IonicContact NZ-OD2 3.01Å; K1453-D1455 PolarHBondContact NZ-OD2 3Å
1454	V	83.1	Confident	79.7	Confident	11.2 Å²	11.2	35.2 Å²	35.2	7%	0.068	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	116.1	165.5	-180	0	0	0	0	108.6	V1372 D1373 V1374 V1451 V1456 V1465 M1467	V1372-V1454 HydrophobicContact CG1-CG1 3.81Å; D1373-V1454 CarbonylContact O-C 3.59Å; D1373-V1454 WeakPolarHBondContact O-CA 3.4Å; V1374-V1454 HydrophobicContact CB-CG2 4.44Å; V1374-V1454 HydrophobicContact CG1-CG2 4.18Å; V1374-V1454 HydrophobicContact CG2-CG1 4.33Å; V1374-V1454 HydrophobicContact CG2-CG2 4.18Å; V1451-V1454 HydrophobicContact CG1-CG2 4.21Å; V1454-V1456 HydrophobicContact CG1-CG2 4.38Å; V1454-V1465 HydrophobicContact CB-CG1 4.1Å; V1454-V1465 HydrophobicContact CB-CG2 4.06Å; V1454-V1465 HydrophobicContact CG1-CG1 4.3Å; V1454-V1465 HydrophobicContact CG1-CG2 3.84Å; V1454-V1465 HydrophobicContact CG2-CG1 4.1Å; V1454-M1467 HydrophobicContact CB-CE 4.47Å; V1454-M1467 HydrophobicContact CG2-CE 3.51Å; V1454-M1467 VanDerWaalsContact CG2-CE 3.47Å
1455	D	83.1	Confident	79.2	Confident	27.4 Å²	27.4	36 Å²	36	15%	0.147	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	129.5	-179.5	-82.2	-42.6	0	0	0	110.8	V1372 D1373 K1453 N1457	V1372-D1455 CarbonylContact C-O 3.5Å; V1372-D1455 VanDerWaalsContact CA-O 3.24Å; V1372-D1455 WeakPolarHBondContact CA-O 3.29Å; D1373-D1455 HydrophobicContact CB-CB 4.26Å; D1373-D1455 PolarHBondContact N-O 2.97Å; D1373-D1455 PolarHBondContact O-N 3.04Å; K1453-D1455 VanDerWaalsContact CD-OD2 3.3Å; K1453-D1455 WeakPolarHBondContact CD-OD2 3.4Å; K1453-D1455 VanDerWaalsContact CE-CG 3.47Å; K1453-D1455 WeakPolarHBondContact CE-OD1 3.32Å; K1453-D1455 VanDerWaalsContact CE-OD2 3.29Å; K1453-D1455 WeakPolarHBondContact CE-OD2 3.36Å; K1453-D1455 WeakPolarHBondContact CG-OD1 3.4Å; K1453-D1455 IonicContact NZ-OD1 3.27Å; K1453-D1455 PolarHBondContact NZ-OD1 3.09Å; K1453-D1455 IonicContact NZ-OD2 3.01Å; K1453-D1455 PolarHBondContact NZ-OD2 3Å; D1455-N1457 PolarHBondContact O-ND2 2.89Å
1456	V	83.6	Confident	78.5	Confident	6.2 Å²	6.2	37.1 Å²	37.1	4%	0.038	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	125.3	179.6	-177	0	0	0	0	109.3	T1359 V1361 R1371 V1372 V1454 V1460 Y1463	T1359-V1456 HydrophobicContact CG2-CG2 3.56Å; T1359-V1456 VanDerWaalsContact CG2-CG2 3.5Å; V1361-V1456 HydrophobicContact CG1-CG1 4.45Å; V1361-V1456 HydrophobicContact CG2-CG1 4.22Å; R1371-V1456 CarbonylContact O-C 3.53Å; R1371-V1456 VanDerWaalsContact O-CA 3.27Å; R1371-V1456 WeakPolarHBondContact O-CA 3.32Å; V1372-V1456 HydrophobicContact CG1-CG2 4.27Å; V1372-V1456 HydrophobicContact CG2-CG1 4.38Å; V1372-V1456 HydrophobicContact CG2-CG2 4.23Å; V1454-V1456 HydrophobicContact CG1-CG2 4.38Å; V1456-V1460 HydrophobicContact CG1-CB 4.4Å; V1456-V1460 HydrophobicContact CG1-CG1 4.14Å; V1456-V1460 HydrophobicContact CG1-CG2 3.97Å; V1456-Y1463 HydrophobicContact CB-CD1 3.8Å; V1456-Y1463 HydrophobicContact CB-CD2 3.77Å; V1456-Y1463 HydrophobicContact CB-CE1 3.98Å; V1456-Y1463 HydrophobicContact CB-CE2 3.95Å; V1456-Y1463 HydrophobicContact CB-CG 3.7Å; V1456-Y1463 HydrophobicContact CG1-CD1 4.08Å; V1456-Y1463 HydrophobicContact CG1-CD2 4.41Å; V1456-Y1463 HydrophobicContact CG1-CE1 4.47Å; V1456-Y1463 HydrophobicContact CG1-CG 3.95Å; V1456-Y1463 HydrophobicContact CG2-CD1 4.34Å; V1456-Y1463 HydrophobicContact CG2-CD2 3.44Å; V1456-Y1463 VanDerWaalsContact CG2-CD2 3.47Å; V1456-Y1463 HydrophobicContact CG2-CE1 4.43Å; V1456-Y1463 HydrophobicContact CG2-CE2 3.72Å; V1456-Y1463 HydrophobicContact CG2-CG 3.81Å
1457	N	85.3	Confident	78.2	Confident	56 Å²	56	38 Å²	38	30%	0.299	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	166.6	-168.6	-66.3	-83.3	0	0	0	112	F1370 R1371 D1455	F1370-N1457 CarbonylContact C-O 3.56Å; F1370-N1457 VanDerWaalsContact CA-O 3.29Å; F1370-N1457 WeakPolarHBondContact CA-O 3.43Å; F1370-N1457 WeakPolarHBondContact CB-O 3.41Å; R1371-N1457 HydrophobicContact CB-CB 4.38Å; R1371-N1457 PolarHBondContact N-O 3.1Å; R1371-N1457 PolarHBondContact NH2-ND2 2.8Å; R1371-N1457 VanDerWaalsContact NH2-ND2 3.17Å; R1371-N1457 PolarHBondContact O-N 3.22Å; D1455-N1457 PolarHBondContact O-ND2 2.89Å
1458	G	84.8	Confident	77.5	Confident	37.8 Å²	37.8	40.7 Å²	40.7	39%	0.39	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	94.9	-147.1	178.9	0	0	0	0	0	112.9	K1364 V1460	K1364-G1458 PolarHBondContact NZ-O 2.83Å; K1364-G1458 VanDerWaalsContact NZ-O 3.11Å; G1458-V1460 PolarHBondContact O-N 3.1Å
1459	D	85.3	Confident	77	Confident	39 Å²	39	43.6 Å²	43.6	21%	0.209	22%	0.223	C	C	.	.	S	Bend	trans	-80.2	49.1	-170.5	-55	-47.8	0	0	0	112.9	D1331 L1363 K1364 A1367 R1368 N1369	D1331-D1459 WeakPolarHBondContact OD2-CA 3.49Å; D1331-D1459 WeakPolarHBondContact OD2-CB 3.44Å; L1363-D1459 WeakPolarHBondContact CA-O 3.13Å; K1364-D1459 PolarHBondContact N-O 2.88Å; K1364-D1459 VanDerWaalsContact NZ-CA 3.34Å; A1367-D1459 HydrophobicContact CB-CB 3.49Å; A1367-D1459 VanDerWaalsContact CB-CB 3.45Å; A1367-D1459 WeakPolarHBondContact CB-O 3.46Å; R1368-D1459 VanDerWaalsContact CA-OD2 3.29Å; R1368-D1459 WeakPolarHBondContact CA-OD2 3.23Å; R1368-D1459 WeakPolarHBondContact CB-OD2 3.36Å; R1368-D1459 PolarHBondContact N-OD2 2.84Å; N1369-D1459 PolarHBondContact N-OD2 3.24Å; N1369-D1459 PolarHBondContact ND2-OD1 3.41Å; N1369-D1459 PolarHBondContact ND2-OD2 3.17Å; N1369-D1459 WeakPolarHBondContact O-CA 3.24Å; N1369-D1459 VanDerWaalsContact O-CB 3.31Å; N1369-D1459 WeakPolarHBondContact O-CB 3.29Å; N1369-D1459 PolarHBondContact O-N 2.97Å; N1369-D1459 VanDerWaalsContact O-OD2 3.04Å
1460	V	79.4	Confident	76.2	Confident	5.6 Å²	5.6	40.9 Å²	40.9	3%	0.034	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	129	-173.2	177.4	0	0	0	0	110.6	L1329 V1361 A1362 L1363 K1364 F1370 V1456 G1458 S1462 Y1463	L1329-V1460 WeakPolarHBondContact CB-O 3.23Å; L1329-V1460 HydrophobicContact CD1-CB 4.12Å; L1329-V1460 HydrophobicContact CD1-CG1 4.34Å; L1329-V1460 PolarHBondContact N-O 2.96Å; V1361-V1460 HydrophobicContact CG1-CB 4.4Å; V1361-V1460 HydrophobicContact CG1-CG1 3.91Å; V1361-V1460 HydrophobicContact CG1-CG2 3.82Å; A1362-V1460 CarbonylContact O-C 3.56Å; A1362-V1460 WeakPolarHBondContact O-CA 3.38Å; A1362-V1460 WeakPolarHBondContact O-CG1 3.28Å; L1363-V1460 HydrophobicContact CD2-CB 4.45Å; L1363-V1460 HydrophobicContact CD2-CG2 3.91Å; K1364-V1460 VanDerWaalsContact CE-O 3.25Å; K1364-V1460 WeakPolarHBondContact CE-O 3.28Å; F1370-V1460 HydrophobicContact CB-CG2 3.6Å; F1370-V1460 HydrophobicContact CG-CG2 4.35Å; V1456-V1460 HydrophobicContact CG1-CB 4.4Å; V1456-V1460 HydrophobicContact CG1-CG1 4.14Å; V1456-V1460 HydrophobicContact CG1-CG2 3.97Å; G1458-V1460 PolarHBondContact O-N 3.1Å; V1460-S1462 WeakPolarHBondContact CG1-O 3.44Å; V1460-Y1463 HydrophobicContact CG1-CD1 4.34Å
1461	D	71.7	Confident	74.5	Confident	59 Å²	59	43.8 Å²	43.8	32%	0.316	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	-45.6	175.1	179.1	76.2	0	0	0	111	K1243 E1327 T1328 L1329 A1362 K1364	K1243-D1461 PolarHBondContact NZ-O 2.93Å; K1243-D1461 IonicContact NZ-OD1 3.42Å; E1327-D1461 CarbonylContact C-O 3.48Å; E1327-D1461 CarbonylContact O-C 3.56Å; T1328-D1461 WeakPolarHBondContact CA-O 3.38Å; L1329-D1461 PolarHBondContact N-O 3.2Å; L1329-D1461 VanDerWaalsContact N-O 3.16Å; A1362-D1461 HydrophobicContact CB-CB 4.26Å; A1362-D1461 PolarHBondContact O-N 3.3Å; K1364-D1461 HydrophobicContact CG-CB 4.24Å
1462	S	67.9	Low	72.6	Confident	16.2 Å²	16.2	47.4 Å²	47.4	11%	0.113	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.4	158.4	174.9	53.8	0	0	0	0	111.4	T1245 Y1289 S1326 E1327 V1361 A1362 V1460	T1245-S1462 WeakPolarHBondContact O-CB 3.48Å; Y1289-S1462 WeakPolarHBondContact OH-CB 3.4Å; S1326-S1462 WeakPolarHBondContact OG-CB 3.34Å; E1327-S1462 VanDerWaalsContact O-CA 3.27Å; E1327-S1462 WeakPolarHBondContact O-CA 3.34Å; E1327-S1462 VanDerWaalsContact O-CB 3.28Å; E1327-S1462 WeakPolarHBondContact O-CB 3.45Å; V1361-S1462 WeakPolarHBondContact CA-O 3.34Å; A1362-S1462 PolarHBondContact N-O 3Å; A1362-S1462 PolarHBondContact O-N 2.96Å; V1460-S1462 WeakPolarHBondContact CG1-O 3.44Å
1463	Y	77.2	Confident	70.5	Confident	37 Å²	37	52.7 Å²	52.7	15%	0.145	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	162	172.3	72.2	-83.2	0	0	0	112.7	N1247 I1324 K1325 S1326 E1327 T1359 N1360 V1456 V1460 V1465	N1247-Y1463 PolarHBondContact ND2-O 2.8Å; I1324-Y1463 WeakPolarHBondContact CA-O 3.33Å; I1324-Y1463 VanDerWaalsContact CG2-O 3.28Å; I1324-Y1463 WeakPolarHBondContact CG2-O 2.98Å; K1325-Y1463 HydrophobicContact CB-CE1 3.84Å; K1325-Y1463 WeakPolarHBondContact O-CD1 3.38Å; S1326-Y1463 WeakPolarHBondContact CA-O 3.32Å; E1327-Y1463 HydrophobicContact CB-CE1 3.92Å; E1327-Y1463 PolarHBondContact OE2-OH 2.93Å; T1359-Y1463 HydrophobicContact CG2-CD2 4.43Å; N1360-Y1463 CarbonylContact O-C 3.56Å; N1360-Y1463 WeakPolarHBondContact O-CA 3.39Å; N1360-Y1463 VanDerWaalsContact O-CB 3.28Å; N1360-Y1463 WeakPolarHBondContact O-CB 3.34Å; V1456-Y1463 HydrophobicContact CB-CD1 3.8Å; V1456-Y1463 HydrophobicContact CB-CD2 3.77Å; V1456-Y1463 HydrophobicContact CB-CE1 3.98Å; V1456-Y1463 HydrophobicContact CB-CE2 3.95Å; V1456-Y1463 HydrophobicContact CB-CG 3.7Å; V1456-Y1463 HydrophobicContact CG1-CD1 4.08Å; V1456-Y1463 HydrophobicContact CG1-CD2 4.41Å; V1456-Y1463 HydrophobicContact CG1-CE1 4.47Å; V1456-Y1463 HydrophobicContact CG1-CG 3.95Å; V1456-Y1463 HydrophobicContact CG2-CD1 4.34Å; V1456-Y1463 HydrophobicContact CG2-CD2 3.44Å; V1456-Y1463 VanDerWaalsContact CG2-CD2 3.47Å; V1456-Y1463 HydrophobicContact CG2-CE1 4.43Å; V1456-Y1463 HydrophobicContact CG2-CE2 3.72Å; V1456-Y1463 HydrophobicContact CG2-CG 3.81Å; V1460-Y1463 HydrophobicContact CG1-CD1 4.34Å; Y1463-V1465 HydrophobicContact CD2-CG2 4.11Å; Y1463-V1465 HydrophobicContact CE2-CG2 4.18Å
1464	S	66.3	Low	68.1	Low	19 Å²	19	56.6 Å²	56.6	13%	0.133	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	142.6	168.5	65.5	0	0	0	0	110.2	N1247 T1359 N1360	N1247-S1464 WeakPolarHBondContact OD1-CB 3.23Å; T1359-S1464 CarbonylContact C-O 3.52Å; T1359-S1464 VanDerWaalsContact CA-O 3.29Å; T1359-S1464 WeakPolarHBondContact CA-O 3.24Å; N1360-S1464 WeakPolarHBondContact CB-OG 3Å; N1360-S1464 PolarHBondContact N-O 2.97Å; N1360-S1464 PolarHBondContact ND2-OG 3.17Å; N1360-S1464 VanDerWaalsContact ND2-OG 3.09Å; N1360-S1464 PolarHBondContact O-N 3.05Å
1465	V	72.4	Confident	65.6	Low	20.6 Å²	20.6	60.3 Å²	60.3	13%	0.125	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	127.2	176.3	-175.7	0	0	0	0	109.4	R1182 T1323 I1324 T1358 T1359 V1454 Y1463 M1467	R1182-V1465 PolarHBondContact NH2-O 3.02Å; T1323-V1465 WeakPolarHBondContact CA-O 3.38Å; I1324-V1465 HydrophobicContact CB-CB 4.46Å; I1324-V1465 PolarHBondContact N-O 2.86Å; T1358-V1465 CarbonylContact O-C 3.28Å; T1358-V1465 WeakPolarHBondContact O-CA 3.39Å; T1359-V1465 HydrophobicContact CG2-CG2 4.17Å; V1454-V1465 HydrophobicContact CB-CG1 4.1Å; V1454-V1465 HydrophobicContact CB-CG2 4.06Å; V1454-V1465 HydrophobicContact CG1-CG1 4.3Å; V1454-V1465 HydrophobicContact CG1-CG2 3.84Å; V1454-V1465 HydrophobicContact CG2-CG1 4.1Å; Y1463-V1465 HydrophobicContact CD2-CG2 4.11Å; Y1463-V1465 HydrophobicContact CE2-CG2 4.18Å; V1465-M1467 HydrophobicContact CG1-CE 3.97Å; V1465-M1467 HydrophobicContact CG1-CG 4.34Å
1466	D	68.9	Low	63.1	Low	53.4 Å²	53.4	65.2 Å²	65.2	29%	0.286	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	141.3	171.1	-150.1	3.5	0	0	0	109.5	R1182 N1290 T1323 A1357 T1358	R1182-D1466 IonicContact NH1-OD1 3.93Å; R1182-D1466 PolarHBondContact NH1-OD1 2.72Å; N1290-D1466 PolarHBondContact ND2-OD2 2.67Å; T1323-D1466 PolarHBondContact OG1-OD1 3.08Å; T1323-D1466 VanDerWaalsContact OG1-OD1 3.14Å; A1357-D1466 CarbonylContact C-O 3.54Å; A1357-D1466 WeakPolarHBondContact CA-O 3.31Å; T1358-D1466 PolarHBondContact N-O 2.94Å; T1358-D1466 PolarHBondContact O-N 2.99Å
1467	M	78.8	Confident	60.6	Low	32.6 Å²	32.6	71 Å²	71	16%	0.161	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	125.5	179.6	-67.6	-174	-159	0	0	111.2	I1324 W1344 P1354 T1356 A1357 V1451 V1454 V1465 Y1469	I1324-M1467 HydrophobicContact CD1-CE 3.9Å; I1324-M1467 HydrophobicContact CD1-SD 4.19Å; W1344-M1467 HydrophobicContact CH2-CE 4.27Å; W1344-M1467 HydrophobicContact CH2-SD 4.16Å; P1354-M1467 HydrophobicContact CB-CB 4.28Å; P1354-M1467 HydrophobicContact CG-SD 4.43Å; T1356-M1467 CarbonylContact O-C 3.57Å; T1356-M1467 WeakPolarHBondContact O-CA 3.27Å; A1357-M1467 HydrophobicContact CB-CG 4.28Å; V1451-M1467 HydrophobicContact CB-SD 4.3Å; V1451-M1467 HydrophobicContact CG1-CE 3.74Å; V1451-M1467 HydrophobicContact CG1-SD 4.22Å; V1454-M1467 HydrophobicContact CB-CE 4.47Å; V1454-M1467 HydrophobicContact CG2-CE 3.51Å; V1454-M1467 VanDerWaalsContact CG2-CE 3.47Å; V1465-M1467 HydrophobicContact CG1-CE 3.97Å; V1465-M1467 HydrophobicContact CG1-CG 4.34Å; M1467-Y1469 HydrophobicContact CB-CD2 4.12Å; M1467-Y1469 HydrophobicContact CB-CE2 3.9Å; M1467-Y1469 PolarHBondContact O-N 2.89Å; M1467-Y1469 HydrophobicContact SD-CE2 4.28Å; M1467-Y1469 PolarHBondContact SD-OH 2.91Å
1468	E	71.5	Confident	57.9	Low	69.4 Å²	69.4	72.1 Å²	72.1	32%	0.324	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	109.1	175.1	-174.2	-170.1	177.6	0	0	108.6	P1172 P1354 R1355 T1356	P1172-E1468 WeakPolarHBondContact CA-OE1 3.3Å; P1172-E1468 WeakPolarHBondContact CB-OE1 3.34Å; P1354-E1468 CarbonylContact C-O 3.58Å; P1354-E1468 VanDerWaalsContact C-O 3.26Å; P1354-E1468 WeakPolarHBondContact CA-O 3.36Å; P1354-E1468 WeakPolarHBondContact CB-O 3.44Å; R1355-E1468 WeakPolarHBondContact CA-O 3.25Å; R1355-E1468 WeakPolarHBondContact CB-O 3.34Å; R1355-E1468 VanDerWaalsContact CD-OE1 3.29Å; R1355-E1468 WeakPolarHBondContact CD-OE1 3.39Å; R1355-E1468 IonicContact CZ-OE1 2.76Å; R1355-E1468 PolarHBondContact N-O 3.06Å; R1355-E1468 IonicContact NE-OE1 3.21Å; R1355-E1468 IonicContact NH1-OE1 2.94Å; R1355-E1468 PolarHBondContact NH1-OE1 2.98Å; T1356-E1468 VanDerWaalsContact CG2-OE2 3.28Å; T1356-E1468 WeakPolarHBondContact CG2-OE2 3.34Å; T1356-E1468 PolarHBondContact N-O 3.14Å; T1356-E1468 VanDerWaalsContact N-O 3.1Å; T1356-E1468 PolarHBondContact O-N 3.04Å; T1356-E1468 VanDerWaalsContact OG1-CB 3.3Å; T1356-E1468 WeakPolarHBondContact OG1-CB 3.36Å; T1356-E1468 PolarHBondContact OG1-OE2 3.16Å
1469	Y	70.1	Confident	55.4	Low	80.8 Å²	80.8	78.3 Å²	78.3	32%	0.317	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-86.1	147.5	174	-68.4	-92.5	0	0	0	110.7	Q1351 V1352 P1354 M1467 E1471	Q1351-Y1469 HydrophobicContact CB-CE1 4.41Å; Q1351-Y1469 HydrophobicContact CG-CE1 3.88Å; Q1351-Y1469 PolarHBondContact NE2-OH 2.63Å; Q1351-Y1469 VanDerWaalsContact NE2-OH 3.14Å; V1352-Y1469 WeakPolarHBondContact O-CD1 3.36Å; V1352-Y1469 VanDerWaalsContact O-CE1 3.32Å; V1352-Y1469 WeakPolarHBondContact O-CE1 3.33Å; P1354-Y1469 HydrophobicContact CB-CD1 3.96Å; P1354-Y1469 HydrophobicContact CB-CD2 4.42Å; P1354-Y1469 HydrophobicContact CB-CE1 3.89Å; P1354-Y1469 HydrophobicContact CB-CE2 4.31Å; P1354-Y1469 HydrophobicContact CB-CG 4.28Å; P1354-Y1469 HydrophobicContact CG-CE1 4.27Å; M1467-Y1469 HydrophobicContact CB-CD2 4.12Å; M1467-Y1469 HydrophobicContact CB-CE2 3.9Å; M1467-Y1469 PolarHBondContact O-N 2.89Å; M1467-Y1469 HydrophobicContact SD-CE2 4.28Å; M1467-Y1469 PolarHBondContact SD-OH 2.91Å; Y1469-E1471 PolarHBondContact O-N 3.48Å
1470	P	56.8	Low	52.8	Low	53.2 Å²	53.2	84 Å²	84	35%	0.345	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-61	146.2	167.1	10.8	-8.7	0	0	0	110	V1352 L1353 R1355 A1472	V1352-P1470 HydrophobicContact CB-CG 4.5Å; V1352-P1470 HydrophobicContact CG1-CB 4.28Å; V1352-P1470 HydrophobicContact CG1-CG 3.65Å; L1353-P1470 WeakPolarHBondContact O-CD 3.43Å; L1353-P1470 VanDerWaalsContact O-CG 3.27Å; L1353-P1470 WeakPolarHBondContact O-CG 3.3Å; R1355-P1470 HydrophobicContact CB-CG 4.24Å; P1470-A1472 PolarHBondContact O-N 2.85Å
1471	E	42.5	Very low	50.4	Low	159.2 Å²	159.2	91.7 Å²	91.7	74%	0.744	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-68.4	127.3	172.6	-81.1	-179.2	142.1	0	0	108.8	F1173 R1297 L1319 Y1469 E1473	F1173-E1471 HydrophobicContact CZ-CG 4.28Å; F1173-E1471 WeakPolarHBondContact CZ-OE1 3.39Å; R1297-E1471 IonicContact CZ-OE1 3.18Å; R1297-E1471 IonicContact NH1-OE1 2.75Å; R1297-E1471 PolarHBondContact NH1-OE1 2.78Å; R1297-E1471 IonicContact NH2-OE1 2.7Å; R1297-E1471 PolarHBondContact NH2-OE1 3.46Å; L1319-E1471 HydrophobicContact CD1-CG 3.91Å; Y1469-E1471 PolarHBondContact O-N 3.48Å; E1471-E1473 PolarHBondContact O-N 3.21Å; E1471-E1473 VanDerWaalsContact O-N 3.12Å
1472	A	39	Very low	48.4	Very low	81.2 Å²	81.2	94.8 Å²	94.8	67%	0.671	50%	0.501	S	S	*	.			trans	-73.1	109.5	180	0	0	0	0	0	109.6	V1352 P1470 Q1474	V1352-A1472 HydrophobicContact CG2-CB 4.49Å; P1470-A1472 PolarHBondContact O-N 2.85Å; A1472-Q1474 PolarHBondContact O-N 2.95Å
1473	E	32.5	Very low	46.5	Very low	174.8 Å²	174.8	102.2 Å²	102.2	82%	0.817	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-63.9	126.2	171.7	-64.5	-174.5	164.7	0	0	109.1	E1471 P1475	E1471-E1473 PolarHBondContact O-N 3.21Å; E1471-E1473 VanDerWaalsContact O-N 3.12Å; E1473-P1475 VanDerWaalsContact O-CD 3.3Å; E1473-P1475 WeakPolarHBondContact O-CD 3.49Å
1474	Q	30.2	Very low	44.3	Very low	148 Å²	148	103.5 Å²	103.5	69%	0.692	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-79.5	134.8	177.9	-72.4	-173.6	-44.2	0	0	109.5	R1297 A1472 V1476	R1297-Q1474 VanDerWaalsContact CZ-OE1 3.28Å; A1472-Q1474 PolarHBondContact O-N 2.95Å; Q1474-V1476 PolarHBondContact O-N 2.93Å
1475	P	30.4	Very low	42.5	Very low	90.2 Å²	90.2	109.8 Å²	109.8	59%	0.586	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-67.2	126.3	175.1	22.1	-24.7	0	0	0	109.8	E1473 I1477 E2079	E1473-P1475 VanDerWaalsContact O-CD 3.3Å; E1473-P1475 WeakPolarHBondContact O-CD 3.49Å; P1475-I1477 VanDerWaalsContact C-N 3.28Å; P1475-I1477 PolarHBondContact O-N 3.19Å; P1475-E2079 WeakPolarHBondContact CB-OE2 3.48Å; P1475-E2079 WeakPolarHBondContact CG-OE1 3.19Å; P1475-E2079 VanDerWaalsContact CG-OE2 3.32Å; P1475-E2079 WeakPolarHBondContact CG-OE2 3.06Å
1476	V	30.1	Very low	40.4	Very low	130.4 Å²	130.4	118.8 Å²	118.8	79%	0.79	62%	0.621	S	S	*	*			trans	-81.6	111.8	170.3	-179.8	0	0	0	0	108.3	Q1474 S1478 E2033	Q1474-V1476 PolarHBondContact O-N 2.93Å; V1476-S1478 PolarHBondContact O-N 2.68Å; V1476-E2033 HydrophobicContact CG1-CG 4.42Å
1477	I	32.4	Very low	38.5	Very low	127.8 Å²	127.8	124.8 Å²	124.8	66%	0.655	65%	0.645	S	S	*	*			trans	-83.7	134.4	171	-63.2	173.3	0	0	0	107.5	P1475 E1479 E2033	P1475-I1477 VanDerWaalsContact C-N 3.28Å; P1475-I1477 PolarHBondContact O-N 3.19Å; I1477-E1479 PolarHBondContact O-N 2.81Å; I1477-E2033 HydrophobicContact CB-CG 4.48Å; I1477-E2033 WeakPolarHBondContact CG1-OE1 3.41Å; I1477-E2033 PolarHBondContact N-OE1 2.79Å
1478	S	28.8	Very low	36.1	Very low	79.4 Å²	79.4	128.4 Å²	128.4	56%	0.555	67%	0.671	S	S	*	*			trans	-86.9	122.2	-179.9	49.6	0	0	0	0	111.5	V1476 E1480 P2076 K2077	V1476-S1478 PolarHBondContact O-N 2.68Å; S1478-E1480 PolarHBondContact O-N 3.12Å; S1478-P2076 PolarHBondContact OG-O 2.89Å; S1478-K2077 WeakPolarHBondContact OG-CG 3.29Å
1479	E	31.4	Very low	34.1	Very low	168 Å²	168	131.7 Å²	131.7	79%	0.785	69%	0.691	S	S	*	*			trans	-115.6	122.5	159.4	-68.4	170.5	173.7	0	0	105.9	I1477 T2034 V2036	I1477-E1479 PolarHBondContact O-N 2.81Å; E1479-T2034 HydrophobicContact CB-CG2 3.47Å; E1479-T2034 VanDerWaalsContact CB-CG2 3.47Å; E1479-T2034 HydrophobicContact CG-CG2 3.45Å; E1479-T2034 VanDerWaalsContact CG-CG2 3.45Å; E1479-T2034 WeakPolarHBondContact OE1-CA 3.47Å; E1479-T2034 WeakPolarHBondContact OE1-CB 3.25Å; E1479-T2034 VanDerWaalsContact OE1-CG2 3.3Å; E1479-T2034 WeakPolarHBondContact OE1-CG2 3.14Å; E1479-V2036 WeakPolarHBondContact OE1-CG2 3.24Å
1480	E	30.1	Very low	32.2	Very low	157.8 Å²	157.8	135 Å²	135	74%	0.737	71%	0.709	S	S	*	*				-176.6	129.1	127.1	-86	174.5	176.5	0	0	112.1	S1478 T1482 Y2078	S1478-E1480 PolarHBondContact O-N 3.12Å; E1480-T1482 PolarHBondContact O-N 2.74Å; E1480-Y2078 VanDerWaalsContact CD-CD2 3.43Å; E1480-Y2078 HydrophobicContact CG-CD2 3.24Å; E1480-Y2078 HydrophobicContact CG-CE2 3.75Å; E1480-Y2078 HydrophobicContact CG-CG 3.81Å; E1480-Y2078 WeakPolarHBondContact OE1-CD2 3.26Å; E1480-Y2078 WeakPolarHBondContact OE1-CE2 3.43Å
1481	E	30.4	Very low	30.9	Very low	167 Å²	167	137.8 Å²	137.8	78%	0.78	72%	0.721	S	S	*	*			trans	74.2	102.8	176.1	-65.1	-169.8	141.6	0	0	114.3
1482	T	28.9	Very low	30.3	Very low	124.8 Å²	124.8	136.5 Å²	136.5	77%	0.766	72%	0.715	S	S	*	*			trans	-153.8	118.3	130.1	32.2	0	0	0	0	112.6	E1480	E1480-T1482 PolarHBondContact O-N 2.74Å
1483	E	28.7	Very low	29.8	Very low	172.6 Å²	172.6	139.1 Å²	139.1	81%	0.807	72%	0.717	S	S	*	*			trans	-139	139.6	157.6	-82.1	-170.8	145.7	0	0	113.2	P1300 Y1513	P1300-E1483 HydrophobicContact CB-CG 4.06Å; P1300-E1483 HydrophobicContact CG-CG 4.21Å; E1483-Y1513 WeakPolarHBondContact CB-OH 3.15Å; E1483-Y1513 WeakPolarHBondContact O-CE2 3.44Å
1484	G	29.1	Very low	29.7	Very low	62.6 Å²	62.6	138.9 Å²	138.9	65%	0.645	72%	0.716	S	S	*	*			trans	142.5	95.9	163.7	0	0	0	0	0	115.6
1485	L	29.7	Very low	29.6	Very low	153 Å²	153	138 Å²	138	80%	0.801	72%	0.716	S	S	*	*				174.8	135.3	116.7	-80.4	161.1	0	0	0	113.3	K2108	L1485-K2108 HydrophobicContact CD1-CG 4.44Å
1486	R	27.7	Very low	29.5	Very low	208.6 Å²	208.6	138.4 Å²	138.4	79%	0.787	72%	0.717	S	S	*	*				142.6	129.7	123.6	-104.3	171.9	173.3	-174.9	-3.7	113.2	G2128	R1486-G2128 PolarHBondContact NH2-O 3.48Å
1487	F	28.9	Very low	29.3	Very low	178.4 Å²	178.4	138.8 Å²	138.8	78%	0.782	71%	0.714	S	S	*	*			trans	-58.1	164.6	134	-55	-79.8	0	0	0	112.5	K1301	K1301-F1487 HydrophobicContact CB-CE1 4.39Å; K1301-F1487 HydrophobicContact CD-CE1 4.28Å
1488	P	29.7	Very low	29.1	Very low	108.6 Å²	108.6	137.9 Å²	137.9	71%	0.705	72%	0.715	S	S	*	*				-112	157.8	62.9	20.1	-5	0	0	0	113.9
1489	D	29.7	Very low	29	Very low	139 Å²	139	142.5 Å²	142.5	74%	0.743	73%	0.725	S	S	*	*			trans	43.5	147.5	137.6	-53.9	-40.2	0	0	0	119.2	N1491 N1545	D1489-N1491 PolarHBondContact O-N 2.91Å; D1489-N1545 VanDerWaalsContact C-ND2 3.31Å; D1489-N1545 WeakPolarHBondContact O-CB 2.97Å; D1489-N1545 PolarHBondContact O-ND2 2.89Å; D1489-N1545 VanDerWaalsContact O-ND2 3.17Å
1490	E	30.2	Very low	28.7	Very low	150.6 Å²	150.6	140 Å²	140	70%	0.704	72%	0.721	S	S	*	*			trans	89.9	120.7	138	-71.3	-179.7	174.5	0	0	118	N1545	E1490-N1545 PolarHBondContact N-ND2 2.88Å; E1490-N1545 PolarHBondContact O-ND2 2.82Å
1491	N	29	Very low	28.6	Very low	111.4 Å²	111.4	137.2 Å²	137.2	60%	0.596	72%	0.719	S	S	*	*				65.2	140.5	127.1	-56.3	-18.9	0	0	0	121.1	D1489 N1566 N1567	D1489-N1491 PolarHBondContact O-N 2.91Å; N1491-N1566 CarbonylContact O-C 3.57Å; N1491-N1567 WeakPolarHBondContact CA-ND2 3.39Å; N1491-N1567 PolarHBondContact N-ND2 2.78Å; N1491-N1567 VanDerWaalsContact N-ND2 3.1Å; N1491-N1567 PolarHBondContact O-N 2.8Å
1492	E	29.1	Very low	28.6	Very low	131.4 Å²	131.4	136.8 Å²	136.8	61%	0.614	72%	0.717	S	S	*	*			cis	155.9	127.4	30.6	-98.9	179.4	158.7	0	0	113.6	P1510 N1566 K1621	E1492-P1510 VanDerWaalsContact OE1-CB 3.24Å; E1492-P1510 WeakPolarHBondContact OE1-CB 3.37Å; E1492-P1510 VanDerWaalsContact OE1-CG 3.26Å; E1492-P1510 WeakPolarHBondContact OE1-CG 3.46Å; E1492-P1510 WeakPolarHBondContact OE2-CG 3.39Å; E1492-N1566 CarbonylContact C-O 3.58Å; E1492-N1566 VanDerWaalsContact C-O 3.26Å; E1492-N1566 CarbonylContact O-C 3.6Å; E1492-K1621 WeakPolarHBondContact OE1-CE 3.49Å; E1492-K1621 IonicContact OE1-NZ 3.14Å; E1492-K1621 PolarHBondContact OE1-NZ 2.8Å
1493	I	29.6	Very low	28.6	Very low	137.4 Å²	137.4	139 Å²	139	71%	0.705	72%	0.716	S	S	*	*			trans	76.5	128.2	138	-50.9	166.1	0	0	0	115.6	V1568	I1493-V1568 HydrophobicContact CB-CG2 4.2Å; I1493-V1568 HydrophobicContact CG2-CG2 4.22Å
1494	E	29.6	Very low	28.7	Very low	169.8 Å²	169.8	136.9 Å²	136.9	79%	0.793	71%	0.71	S	S	*	*				-100.8	153.4	124.7	-83.3	159.6	175.5	0	0	116.3
1495	D	28.4	Very low	28.8	Very low	130.2 Å²	130.2	141.1 Å²	141.1	70%	0.696	71%	0.713	S	S	*	*				162.4	156	112.9	-123.1	-16.7	0	0	0	116.3	R1541	D1495-R1541 PolarHBondContact O-NH1 2.82Å; D1495-R1541 PolarHBondContact O-NH2 2.83Å
1496	T	28.5	Very low	28.7	Very low	98 Å²	98	140.1 Å²	140.1	60%	0.601	71%	0.709	S	S	*	*			trans	108.8	113.3	150.4	41.4	0	0	0	0	117.1	T1498	T1496-T1498 PolarHBondContact O-N 3.05Å
1497	N	26.1	Very low	28.7	Very low	138.4 Å²	138.4	137 Å²	137	74%	0.74	71%	0.708	S	S	*	*			trans	26.3	132.1	135.4	-69.1	-54.6	0	0	0	119.5	L1564	N1497-L1564 WeakPolarHBondContact O-CD2 3.47Å
1498	T	27	Very low	28.8	Very low	109 Å²	109	134 Å²	134	67%	0.669	70%	0.704	S	S	*	*				155.8	128.9	107.1	-15.8	0	0	0	0	116.8	T1496 N1567 W1569	T1496-T1498 PolarHBondContact O-N 3.05Å; T1498-N1567 VanDerWaalsContact CB-C 3.44Å; T1498-N1567 VanDerWaalsContact CB-O 3.27Å; T1498-N1567 WeakPolarHBondContact CB-O 3.39Å; T1498-N1567 HydrophobicContact CG2-CB 3.8Å; T1498-N1567 WeakPolarHBondContact CG2-O 3.28Å; T1498-N1567 WeakPolarHBondContact OG1-CA 3.12Å; T1498-N1567 WeakPolarHBondContact OG1-CB 3.25Å; T1498-N1567 PolarHBondContact OG1-O 3.22Å; T1498-W1569 VanDerWaalsContact O-CD1 3.32Å
1499	K	26.3	Very low	28.7	Very low	175.8 Å²	175.8	135.7 Å²	135.7	76%	0.764	70%	0.7	S	S	*	*			trans	39.3	117.9	144.9	-74.3	174	-174.5	169.3	0	119.5	N1567 V1568 W1569	K1499-N1567 WeakPolarHBondContact CD-O 3.31Å; K1499-N1567 PolarHBondContact NZ-O 2.76Å; K1499-N1567 VanDerWaalsContact NZ-O 3.14Å; K1499-V1568 HydrophobicContact CB-CG1 4.39Å; K1499-V1568 HydrophobicContact CD-CG2 4.15Å; K1499-V1568 CarbonylContact O-C 3.48Å; K1499-V1568 WeakPolarHBondContact O-CA 3.3Å; K1499-W1569 PolarHBondContact O-N 3.15Å
1500	T	25.9	Very low	28.6	Very low	116 Å²	116	134.4 Å²	134.4	71%	0.712	70%	0.699	S	S	*	*				101.9	132.7	114.9	-39.9	0	0	0	0	114.9	E1502 V1568	T1500-E1502 HydrophobicContact CG2-CG 4.36Å; T1500-V1568 WeakPolarHBondContact OG1-CG1 3.25Å
1501	S	27.4	Very low	28.5	Very low	97.6 Å²	97.6	133.4 Å²	133.4	68%	0.683	70%	0.698	S	S	*	*				-103.6	148.2	121.4	59.2	0	0	0	0	116	K1535	S1501-K1535 PolarHBondContact O-NZ 3.14Å
1502	E	30.9	Very low	28.4	Very low	159.8 Å²	159.8	132.2 Å²	132.2	75%	0.747	70%	0.698	S	S	*	*			trans	45.5	115.8	148.7	-61.3	-170.2	130.8	0	0	116.8	T1500	T1500-E1502 HydrophobicContact CG2-CG 4.36Å
1503	K	29.2	Very low	28.4	Very low	171.4 Å²	171.4	133.3 Å²	133.3	75%	0.745	70%	0.698	S	S	*	*				109.5	134.1	126.8	-86.2	177.6	179.6	164.9	0	115.7
1504	N	30.6	Very low	28.4	Very low	128.4 Å²	128.4	131.7 Å²	131.7	69%	0.687	70%	0.696	S	S	*	*			trans	71.4	118	135.9	-75.9	15.5	0	0	0	118.7
1505	E	30.4	Very low	28.6	Very low	150.2 Å²	150.2	128.5 Å²	128.5	70%	0.702	69%	0.69	S	S	*	*			trans	56.2	115.5	141.7	-68.1	173.8	164.1	0	0	117.7	K1535 Y1537	E1505-K1535 HydrophobicContact CB-CD 3.68Å; E1505-K1535 HydrophobicContact CG-CD 3.57Å; E1505-K1535 WeakPolarHBondContact OE1-CB 3.28Å; E1505-K1535 WeakPolarHBondContact OE1-CD 3.49Å; E1505-Y1537 HydrophobicContact CB-CE1 4.33Å; E1505-Y1537 WeakPolarHBondContact OE1-CD1 3.25Å; E1505-Y1537 VanDerWaalsContact OE2-CD1 3.22Å; E1505-Y1537 WeakPolarHBondContact OE2-CD1 3.33Å; E1505-Y1537 VanDerWaalsContact OE2-CE1 3.27Å; E1505-Y1537 WeakPolarHBondContact OE2-CE1 3.46Å
1506	D	29	Very low	29.2	Very low	132.8 Å²	132.8	129.1 Å²	129.1	71%	0.71	69%	0.687	S	S	*	*			trans	-173.8	131.8	144.9	-81.2	-29.6	0	0	0	116.3	K1535 N2003	D1506-K1535 VanDerWaalsContact N-CE 3.31Å; D1506-K1535 IonicContact OD2-NZ 3.8Å; D1506-K1535 PolarHBondContact OD2-NZ 2.85Å; D1506-N2003 PolarHBondContact OD1-ND2 2.89Å
1507	D	27.8	Very low	30.6	Very low	143.6 Å²	143.6	131 Å²	131	77%	0.768	68%	0.683	S	S	*	*			trans	87.9	96.6	154.2	-96.2	-7.4	0	0	0	117.8	N2003	D1507-N2003 PolarHBondContact OD1-ND2 3.03Å
1508	V	30.3	Very low	32.6	Very low	114.2 Å²	114.2	124.7 Å²	124.7	69%	0.692	65%	0.65	S	S	*	*			trans	-135.2	119.9	160.1	-175.9	0	0	0	0	112	P1510 Y1537 V1623 I1624	V1508-P1510 WeakPolarHBondContact O-CD 3.18Å; V1508-Y1537 HydrophobicContact CG2-CE1 4.37Å; V1508-Y1537 WeakPolarHBondContact CG2-OH 3.49Å; V1508-V1623 HydrophobicContact CG1-CG1 3.96Å; V1508-I1624 WeakPolarHBondContact CG1-O 3.49Å
1509	K	27.8	Very low	35.3	Very low	144.8 Å²	144.8	122.1 Å²	122.1	63%	0.63	64%	0.636	S	S	*	*			trans	-93	130.7	166.5	-87.4	167.3	-173.1	158.5	0	111.6	A1305 D1306 L1511 F1631	A1305-K1509 WeakPolarHBondContact O-CE 3.4Å; A1305-K1509 PolarHBondContact O-NZ 3.28Å; D1306-K1509 IonicContact OD1-NZ 3.8Å; D1306-K1509 PolarHBondContact OD1-NZ 2.79Å; D1306-K1509 IonicContact OD2-NZ 3.71Å; D1306-K1509 PolarHBondContact OD2-NZ 2.77Å; K1509-L1511 PolarHBondContact O-N 2.84Å; K1509-F1631 WeakPolarHBondContact O-CZ 3.36Å
1510	P	28	Very low	38.2	Very low	110.6 Å²	110.6	114.1 Å²	114.1	72%	0.718	60%	0.601	S	S	*	*			trans	-80.1	133.5	171.9	21.1	-18.3	0	0	0	112.5	E1492 V1508 S1512	E1492-P1510 VanDerWaalsContact OE1-CB 3.24Å; E1492-P1510 WeakPolarHBondContact OE1-CB 3.37Å; E1492-P1510 VanDerWaalsContact OE1-CG 3.26Å; E1492-P1510 WeakPolarHBondContact OE1-CG 3.46Å; E1492-P1510 WeakPolarHBondContact OE2-CG 3.39Å; V1508-P1510 WeakPolarHBondContact O-CD 3.18Å; P1510-S1512 PolarHBondContact O-N 3.46Å
1511	L	27.2	Very low	41	Very low	131 Å²	131	114.2 Å²	114.2	69%	0.686	59%	0.588	S	S	*	*			trans	-89.6	125.7	173	-92.1	142.5	0	0	0	110.6	K1509 Y1513 K1621 F1631 V1633	K1509-L1511 PolarHBondContact O-N 2.84Å; L1511-Y1513 HydrophobicContact CD2-CE2 4.1Å; L1511-Y1513 HydrophobicContact CG-CE2 4.47Å; L1511-Y1513 PolarHBondContact O-N 3.01Å; L1511-K1621 WeakPolarHBondContact O-CG 3.19Å; L1511-F1631 HydrophobicContact CD1-CD2 4.27Å; L1511-F1631 HydrophobicContact CD1-CE2 3.54Å; L1511-F1631 HydrophobicContact CD1-CZ 4.05Å; L1511-V1633 HydrophobicContact CD1-CG1 4.32Å
1512	S	27.7	Very low	43.9	Very low	85.8 Å²	85.8	111.4 Å²	111.4	60%	0.6	57%	0.566	S	S	*	*			trans	-107.4	112.8	-178.3	168.2	0	0	0	0	112.1	P1510	P1510-S1512 PolarHBondContact O-N 3.46Å
1513	Y	29.6	Very low	46.5	Very low	154.4 Å²	154.4	104 Å²	104	61%	0.605	53%	0.531	S	S	*	.			trans	-111.9	118.3	170.9	-68.4	-75.7	0	0	0	112.2	E1483 L1511 P1515 V1633	E1483-Y1513 WeakPolarHBondContact CB-OH 3.15Å; E1483-Y1513 WeakPolarHBondContact O-CE2 3.44Å; L1511-Y1513 HydrophobicContact CD2-CE2 4.1Å; L1511-Y1513 HydrophobicContact CG-CE2 4.47Å; L1511-Y1513 PolarHBondContact O-N 3.01Å; Y1513-P1515 WeakPolarHBondContact O-CD 3.46Å; Y1513-V1633 PolarHBondContact OH-O 2.86Å
1514	P	29.3	Very low	49.1	Very low	103.6 Å²	103.6	98.1 Å²	98.1	67%	0.673	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-71.9	139.2	175.8	28.6	-33.3	0	0	0	111.8	K1516	P1514-K1516 PolarHBondContact O-N 2.93Å
1515	P	32.3	Very low	51.6	Low	102.6 Å²	102.6	92 Å²	92	67%	0.666	47%	0.474	S	S	*	.	P	Polyproline II helix	trans	-66.2	136.5	-177.4	25.6	-33.7	0	0	0	112.5	Y1513 R1517	Y1513-P1515 WeakPolarHBondContact O-CD 3.46Å; P1515-R1517 PolarHBondContact O-N 3.22Å
1516	K	42.6	Very low	54	Low	143.6 Å²	143.6	86.5 Å²	86.5	62%	0.624	45%	0.45	S	S	*	.	P	Polyproline II helix	trans	-71.9	119.5	-179.6	-68.5	179	-179.7	175	0	110.8	P1514 G1518 T1635 H1637 T1640	P1514-K1516 PolarHBondContact O-N 2.93Å; K1516-G1518 PolarHBondContact O-N 2.8Å; K1516-T1635 PolarHBondContact NZ-O 2.8Å; K1516-H1637 HydrophobicContact CB-CB 3.97Å; K1516-T1640 PolarHBondContact O-OG1 3.06Å
1517	R	56.5	Low	56.6	Low	137.2 Å²	137.2	80.2 Å²	80.2	52%	0.518	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	127.1	175.6	-59.8	-178.4	-174.1	171.8	1.7	110.6	P1515 R1618 H1637 V1662	P1515-R1517 PolarHBondContact O-N 3.22Å; R1517-R1618 VanDerWaalsContact O-CD 3.23Å; R1517-R1618 WeakPolarHBondContact O-CD 3.31Å; R1517-R1618 PolarHBondContact O-NE 2.87Å; R1517-R1618 PolarHBondContact O-NH1 3.36Å; R1517-R1618 PolarHBondContact O-NH2 2.84Å; R1517-H1637 HydrophobicContact CB-CB 4.05Å; R1517-V1662 HydrophobicContact CG-CG1 4.34Å
1518	G	69.4	Low	59.2	Low	5.8 Å²	5.8	75.8 Å²	75.8	6%	0.06	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	-168.1	172.9	0	0	0	0	0	112.8	K1516 R1618 H1637 D1638 T1640	K1516-G1518 PolarHBondContact O-N 2.8Å; G1518-R1618 VanDerWaalsContact O-CG 3.28Å; G1518-R1618 WeakPolarHBondContact O-CG 3.36Å; G1518-H1637 PolarHBondContact O-CD2 2.85Å; G1518-D1638 CarbonylContact C-O 3.59Å; G1518-D1638 WeakPolarHBondContact CA-O 3.46Å; G1518-D1638 PolarHBondContact N-O 3Å; G1518-T1640 PolarHBondContact N-OG1 3.07Å
1519	P	82.6	Confident	61.8	Low	55 Å²	55	70.4 Å²	70.4	36%	0.357	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	149.9	-179.1	5.6	-7.8	0	0	0	113.7	T1617 H1637 D1638	P1519-T1617 CarbonylContact C-O 3.43Å; P1519-T1617 VanDerWaalsContact CA-O 3.3Å; P1519-T1617 WeakPolarHBondContact CA-O 3.27Å; P1519-T1617 HydrophobicContact CB-CG2 4.18Å; P1519-T1617 HydrophobicContact CG-CG2 4.08Å; P1519-H1637 CarbonylContact O-C 3.44Å; P1519-H1637 VanDerWaalsContact O-CA 3.24Å; P1519-H1637 WeakPolarHBondContact O-CA 3.23Å; P1519-H1637 WeakPolarHBondContact O-CB 3.48Å; P1519-D1638 HydrophobicContact CG-CB 4.23Å; P1519-D1638 PolarHBondContact O-N 3.21Å
1520	L	88.1	Confident	64.4	Low	7 Å²	7	67.4 Å²	67.4	4%	0.037	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	130.6	172.7	179.4	70.4	0	0	0	110.4	L1522 I1523 M1542 V1594 L1614 T1617 A1619	L1520-L1522 WeakPolarHBondContact CD1-O 3.49Å; L1520-I1523 HydrophobicContact CD1-CG1 4.18Å; L1520-I1523 HydrophobicContact CD2-CD1 4.22Å; L1520-I1523 HydrophobicContact CD2-CG1 4.24Å; L1520-M1542 HydrophobicContact CB-CE 4.44Å; L1520-M1542 HydrophobicContact CD2-CE 4.28Å; L1520-M1542 HydrophobicContact CD2-SD 4.29Å; L1520-V1594 HydrophobicContact CD2-CG2 3.95Å; L1520-V1594 HydrophobicContact CG-CB 4.43Å; L1520-V1594 HydrophobicContact CG-CG2 4.13Å; L1520-V1594 WeakPolarHBondContact O-CB 3.41Å; L1520-V1594 VanDerWaalsContact O-CG1 3.28Å; L1520-V1594 WeakPolarHBondContact O-CG1 3.32Å; L1520-L1614 HydrophobicContact CD2-CD1 3.97Å; L1520-T1617 WeakPolarHBondContact CB-O 3.43Å; L1520-T1617 PolarHBondContact N-O 3.06Å; L1520-A1619 HydrophobicContact CD1-CB 3.9Å; L1520-A1619 HydrophobicContact CD2-CB 3.96Å; L1520-A1619 HydrophobicContact CG-CB 4.44Å
1521	R	84.8	Confident	66.8	Low	119.4 Å²	119.4	66.5 Å²	66.5	45%	0.451	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	-33.5	174.6	-96.9	-151.9	-179	-178.2	6.7	113.7	V1594 L1636 D1638 Y1661	R1521-V1594 WeakPolarHBondContact O-CA 3.39Å; R1521-V1594 WeakPolarHBondContact O-CB 3.15Å; R1521-V1594 PolarHBondContact O-N 3.07Å; R1521-L1636 HydrophobicContact CB-CD2 4.32Å; R1521-L1636 HydrophobicContact CB-CG 4.4Å; R1521-L1636 PolarHBondContact N-O 2.94Å; R1521-D1638 WeakPolarHBondContact CD-OD1 3.31Å; R1521-D1638 WeakPolarHBondContact CD-OD2 3.3Å; R1521-D1638 VanDerWaalsContact CG-OD1 3.22Å; R1521-D1638 WeakPolarHBondContact CG-OD1 3.48Å; R1521-D1638 WeakPolarHBondContact CG-OD2 3.2Å; R1521-D1638 VanDerWaalsContact CZ-CG 3.47Å; R1521-D1638 IonicContact CZ-OD1 3.35Å; R1521-D1638 IonicContact CZ-OD2 3.83Å; R1521-D1638 IonicContact NE-OD1 2.84Å; R1521-D1638 PolarHBondContact NE-OD1 3.32Å; R1521-D1638 IonicContact NE-OD2 3.05Å; R1521-D1638 PolarHBondContact NE-OD2 2.8Å; R1521-D1638 IonicContact NH1-OD1 2.88Å; R1521-D1638 PolarHBondContact NH1-OD1 2.74Å; R1521-D1638 VanDerWaalsContact NH2-CG 3.3Å; R1521-D1638 IonicContact NH2-OD1 3.6Å; R1521-D1638 PolarHBondContact NH2-OD1 3.32Å; R1521-D1638 IonicContact NH2-OD2 3.29Å; R1521-D1638 PolarHBondContact NH2-OD2 2.81Å; R1521-Y1661 HydrophobicContact CG-CE1 4.46Å
1522	L	87	Confident	69.2	Low	38.6 Å²	38.6	67.2 Å²	67.2	20%	0.202	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	140.9	-170.7	-154.8	76.2	0	0	0	112	L1520 H1524 L1591 A1592 K1593 T1635 L1636 E1682 F1683	L1520-L1522 WeakPolarHBondContact CD1-O 3.49Å; L1522-H1524 HydrophobicContact CD2-CB 4.31Å; L1522-L1591 HydrophobicContact CD1-CD1 3.74Å; L1522-L1591 HydrophobicContact CD1-CD2 4.46Å; L1522-L1591 HydrophobicContact CD1-CG 4.13Å; L1522-L1591 HydrophobicContact CD2-CD1 3.94Å; L1522-L1591 HydrophobicContact CG-CD1 3.83Å; L1522-A1592 CarbonylContact C-O 3.58Å; L1522-A1592 WeakPolarHBondContact CA-O 3.28Å; L1522-K1593 HydrophobicContact CD1-CB 4.38Å; L1522-T1635 CarbonylContact O-C 3.5Å; L1522-T1635 WeakPolarHBondContact O-CA 3.27Å; L1522-L1636 HydrophobicContact CB-CB 3.84Å; L1522-L1636 HydrophobicContact CB-CD2 4.45Å; L1522-L1636 PolarHBondContact N-O 2.87Å; L1522-L1636 VanDerWaalsContact N-O 3.11Å; L1522-L1636 PolarHBondContact O-N 3.14Å; L1522-E1682 WeakPolarHBondContact CD1-OE2 3.39Å; L1522-F1683 HydrophobicContact CD2-CE2 3.33Å; L1522-F1683 HydrophobicContact CD2-CZ 3.4Å
1523	I	87.3	Confident	71.8	Confident	5 Å²	5	63.8 Å²	63.8	3%	0.026	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	122.4	156.8	-47.5	178	0	0	0	107	L1520 M1538 V1540 L1591 A1592 V1622 V1633 N1634 T1635	L1520-I1523 HydrophobicContact CD1-CG1 4.18Å; L1520-I1523 HydrophobicContact CD2-CD1 4.22Å; L1520-I1523 HydrophobicContact CD2-CG1 4.24Å; I1523-M1538 HydrophobicContact CG2-SD 4.35Å; I1523-V1540 HydrophobicContact CD1-CB 4.41Å; I1523-V1540 HydrophobicContact CD1-CG1 4.08Å; I1523-V1540 HydrophobicContact CD1-CG2 3.5Å; I1523-V1540 VanDerWaalsContact CD1-CG2 3.45Å; I1523-L1591 CarbonylContact O-C 3.54Å; I1523-L1591 WeakPolarHBondContact O-CA 3.33Å; I1523-A1592 HydrophobicContact CB-CB 4.04Å; I1523-A1592 HydrophobicContact CG1-CB 4.39Å; I1523-A1592 PolarHBondContact N-O 3Å; I1523-A1592 PolarHBondContact O-N 3.06Å; I1523-V1622 HydrophobicContact CD1-CG2 4.05Å; I1523-V1622 HydrophobicContact CG2-CG1 4.4Å; I1523-V1622 HydrophobicContact CG2-CG2 4.33Å; I1523-V1633 HydrophobicContact CG2-CG1 3.71Å; I1523-V1633 HydrophobicContact CG2-CG2 3.6Å; I1523-N1634 CarbonylContact C-O 3.5Å; I1523-N1634 VanDerWaalsContact CA-O 3.3Å; I1523-N1634 WeakPolarHBondContact CA-O 3.22Å; I1523-T1635 HydrophobicContact CG1-CG2 4.26Å; I1523-T1635 HydrophobicContact CG2-CG2 4.29Å
1524	H	83.7	Confident	74.4	Confident	46.2 Å²	46.2	58.7 Å²	58.7	21%	0.214	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	121.2	171.7	-177.7	-139.6	0	0	0	109	L1522 L1590 L1591 V1633 N1634 N1761	L1522-H1524 HydrophobicContact CD2-CB 4.31Å; H1524-L1590 CarbonylContact C-O 3.52Å; H1524-L1591 HydrophobicContact CB-CD1 3.74Å; H1524-V1633 CarbonylContact O-C 3.54Å; H1524-V1633 WeakPolarHBondContact O-CA 3.23Å; H1524-N1634 HydrophobicContact CB-CB 4.38Å; H1524-N1634 PolarHBondContact N-O 2.85Å; H1524-N1634 PolarHBondContact O-N 2.88Å; H1524-N1761 PolarHBondContact CE1-ND2 2.8Å
1525	A	82.4	Confident	77.1	Confident	0.8 Å²	0.8	56.4 Å²	56.4	1%	0.007	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	127.4	-178.9	0	0	0	0	0	111.5	V1527 N1589 L1590 I1624 V1632 V1633	A1525-V1527 HydrophobicContact CB-CG2 4.31Å; A1525-N1589 CarbonylContact O-C 3.57Å; A1525-N1589 WeakPolarHBondContact O-CA 3.4Å; A1525-L1590 HydrophobicContact CB-CB 4.43Å; A1525-L1590 PolarHBondContact N-O 3.22Å; A1525-L1590 PolarHBondContact O-N 2.88Å; A1525-I1624 HydrophobicContact CB-CD1 3.6Å; A1525-I1624 VanDerWaalsContact CB-CD1 3.46Å; A1525-V1632 CarbonylContact C-O 3.54Å; A1525-V1632 WeakPolarHBondContact CA-O 3.32Å; A1525-V1632 WeakPolarHBondContact CB-O 3.27Å; A1525-V1633 HydrophobicContact CB-CB 4.27Å; A1525-V1633 HydrophobicContact CB-CG1 4.47Å; A1525-V1633 HydrophobicContact CB-CG2 4.02Å
1526	T	81	Confident	79.8	Confident	34.8 Å²	34.8	51.6 Å²	51.6	21%	0.213	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	120.5	165.6	-55.4	0	0	0	0	107.4	N1589 F1631 V1632 L1671 N1761	T1526-N1589 VanDerWaalsContact CB-OD1 3.32Å; T1526-N1589 WeakPolarHBondContact CB-OD1 3.35Å; T1526-N1589 VanDerWaalsContact CG2-OD1 3.31Å; T1526-N1589 WeakPolarHBondContact CG2-OD1 3.38Å; T1526-N1589 PolarHBondContact OG1-OD1 2.88Å; T1526-F1631 CarbonylContact O-C 3.52Å; T1526-F1631 VanDerWaalsContact O-CA 3.27Å; T1526-F1631 WeakPolarHBondContact O-CA 3.24Å; T1526-F1631 WeakPolarHBondContact O-CB 3.25Å; T1526-V1632 PolarHBondContact N-O 3.1Å; T1526-V1632 PolarHBondContact O-N 3.03Å; T1526-L1671 HydrophobicContact CG2-CD2 3.78Å; T1526-N1761 WeakPolarHBondContact OG1-CB 3.24Å; T1526-N1761 PolarHBondContact OG1-ND2 2.85Å
1527	V	83.2	Confident	82.1	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	131.6	-174.3	-175.3	0	0	0	0	109.1	A1525 M1529 F1536 A1587 F1588 I1624 V1628 F1631	A1525-V1527 HydrophobicContact CB-CG2 4.31Å; V1527-M1529 HydrophobicContact CG1-SD 3.82Å; V1527-F1536 HydrophobicContact CB-CE2 4.4Å; V1527-F1536 HydrophobicContact CG1-CD2 4.14Å; V1527-F1536 HydrophobicContact CG1-CE2 3.82Å; V1527-F1536 HydrophobicContact CG2-CE2 3.98Å; V1527-F1536 HydrophobicContact CG2-CZ 4.33Å; V1527-A1587 CarbonylContact O-C 3.51Å; V1527-A1587 VanDerWaalsContact O-CA 3.22Å; V1527-A1587 WeakPolarHBondContact O-CA 3.43Å; V1527-A1587 WeakPolarHBondContact O-CB 3.4Å; V1527-F1588 HydrophobicContact CB-CD1 4.34Å; V1527-F1588 HydrophobicContact CB-CD2 4.37Å; V1527-F1588 HydrophobicContact CB-CE1 3.97Å; V1527-F1588 HydrophobicContact CB-CE2 4.1Å; V1527-F1588 HydrophobicContact CB-CZ 3.83Å; V1527-F1588 HydrophobicContact CG1-CE1 3.97Å; V1527-F1588 HydrophobicContact CG1-CE2 4.46Å; V1527-F1588 HydrophobicContact CG1-CZ 3.94Å; V1527-F1588 HydrophobicContact CG2-CE1 4.43Å; V1527-F1588 HydrophobicContact CG2-CE2 4.15Å; V1527-F1588 HydrophobicContact CG2-CZ 4.18Å; V1527-F1588 PolarHBondContact N-O 3Å; V1527-F1588 WeakPolarHBondContact O-CD1 3.26Å; V1527-F1588 PolarHBondContact O-N 3.14Å; V1527-I1624 HydrophobicContact CG1-CG2 4.3Å; V1527-I1624 HydrophobicContact CG2-CD1 4.08Å; V1527-I1624 HydrophobicContact CG2-CG2 4.34Å; V1527-V1628 HydrophobicContact CG1-CG1 3.96Å; V1527-V1628 HydrophobicContact CG1-CG2 4.06Å; V1527-F1631 HydrophobicContact CG1-CB 4.48Å; V1527-F1631 HydrophobicContact CG2-CB 4.22Å
1528	Q	81.9	Confident	83.7	Confident	51 Å²	51	40.4 Å²	40.4	24%	0.238	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	123.3	169.9	-133.7	179.3	-18.1	0	0	109.1	K1585 R1586 A1587 V1628 E1629 A1630 L1671 I1757	Q1528-K1585 WeakPolarHBondContact CG-O 3.42Å; Q1528-K1585 PolarHBondContact NE2-O 2.95Å; Q1528-R1586 CarbonylContact C-O 3.5Å; Q1528-R1586 VanDerWaalsContact CA-O 3.23Å; Q1528-R1586 WeakPolarHBondContact CA-O 3.41Å; Q1528-R1586 WeakPolarHBondContact CG-O 3.4Å; Q1528-A1587 HydrophobicContact CB-CB 4.27Å; Q1528-A1587 HydrophobicContact CG-CB 4.24Å; Q1528-V1628 CarbonylContact O-C 3.53Å; Q1528-V1628 WeakPolarHBondContact O-CA 3.4Å; Q1528-V1628 WeakPolarHBondContact O-CG1 3.29Å; Q1528-E1629 VanDerWaalsContact CD-OE2 3.26Å; Q1528-E1629 HydrophobicContact CG-CB 4.27Å; Q1528-E1629 PolarHBondContact NE2-OE2 3.15Å; Q1528-E1629 PolarHBondContact O-N 3.07Å; Q1528-A1630 WeakPolarHBondContact CA-O 3.42Å; Q1528-A1630 HydrophobicContact CB-CB 4.29Å; Q1528-A1630 WeakPolarHBondContact CB-O 3.36Å; Q1528-A1630 PolarHBondContact N-O 2.95Å; Q1528-A1630 PolarHBondContact O-N 3.02Å; Q1528-L1671 HydrophobicContact CB-CD1 3.57Å; Q1528-L1671 HydrophobicContact CB-CD2 4.25Å; Q1528-L1671 HydrophobicContact CG-CD1 4.15Å; Q1528-I1757 HydrophobicContact CG-CD1 4.28Å
1529	M	84.8	Confident	84.6	Confident	1 Å²	1	41.3 Å²	41.3	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	149.4	179.9	-59	-55.9	-67.4	0	0	111.2	V1527 P1533 K1535 F1536 M1554 L1582 R1586 F1588 D1627 V1628	V1527-M1529 HydrophobicContact CG1-SD 3.82Å; M1529-P1533 HydrophobicContact CB-CB 4.19Å; M1529-P1533 HydrophobicContact CB-CG 4.06Å; M1529-P1533 HydrophobicContact CE-CB 3.54Å; M1529-P1533 VanDerWaalsContact CE-CB 3.42Å; M1529-P1533 HydrophobicContact CE-CG 4.25Å; M1529-P1533 HydrophobicContact CG-CG 4.45Å; M1529-K1535 WeakPolarHBondContact CE-O 3.48Å; M1529-F1536 HydrophobicContact CE-CB 3.92Å; M1529-F1536 HydrophobicContact CE-CD2 4.36Å; M1529-F1536 HydrophobicContact SD-CB 4.47Å; M1529-F1536 HydrophobicContact SD-CD2 4.15Å; M1529-M1554 HydrophobicContact CE-CE 4.17Å; M1529-M1554 HydrophobicContact CE-CG 4.36Å; M1529-M1554 HydrophobicContact CE-SD 4.41Å; M1529-M1554 HydrophobicContact CG-CE 4.34Å; M1529-L1582 HydrophobicContact CB-CD1 4.33Å; M1529-L1582 HydrophobicContact CB-CD2 4.46Å; M1529-L1582 HydrophobicContact CG-CD1 4.35Å; M1529-L1582 HydrophobicContact CG-CD2 3.78Å; M1529-R1586 HydrophobicContact CB-CB 4.47Å; M1529-R1586 PolarHBondContact N-O 3.09Å; M1529-R1586 WeakPolarHBondContact O-CB 3.12Å; M1529-R1586 PolarHBondContact O-NE 3.46Å; M1529-F1588 HydrophobicContact CG-CD1 4.36Å; M1529-F1588 HydrophobicContact CG-CE1 3.85Å; M1529-F1588 HydrophobicContact SD-CE1 3.78Å; M1529-F1588 HydrophobicContact SD-CZ 4.38Å; M1529-D1627 CarbonylContact C-O 3.56Å; M1529-D1627 WeakPolarHBondContact CA-O 3.4Å; M1529-D1627 HydrophobicContact CE-CB 4.39Å; M1529-D1627 VanDerWaalsContact CE-O 3.28Å; M1529-D1627 WeakPolarHBondContact CE-O 3.34Å; M1529-V1628 HydrophobicContact CE-CG2 4.29Å; M1529-V1628 HydrophobicContact SD-CG2 3.94Å
1530	Q	82.2	Confident	85	Confident	81 Å²	81	38.8 Å²	38.8	38%	0.379	20%	0.197	S	C	.	.	P	Polyproline II helix	trans	-63.8	163.5	166.3	-64.3	178.5	25.1	0	0	110.4	D1532 P1533 D1627 V1628 E1629	Q1530-D1532 VanDerWaalsContact C-N 3.33Å; Q1530-D1532 PolarHBondContact O-N 3.5Å; Q1530-P1533 WeakPolarHBondContact O-CD 3.31Å; Q1530-D1627 HydrophobicContact CB-CB 4.35Å; Q1530-D1627 WeakPolarHBondContact CB-O 3.46Å; Q1530-D1627 HydrophobicContact CG-CB 4.46Å; Q1530-D1627 WeakPolarHBondContact CG-O 3.33Å; Q1530-D1627 PolarHBondContact N-O 2.98Å; Q1530-V1628 PolarHBondContact NE2-O 2.84Å; Q1530-E1629 HydrophobicContact CG-CB 4.09Å
1531	P	78.7	Confident	84.8	Confident	92 Å²	92	42.2 Å²	42.2	60%	0.597	21%	0.21	S	C	*	.	S	Bend	trans	-56.3	144.9	171.9	-23.6	34.4	0	0	0	112.8
1532	D	78.5	Confident	84.9	Confident	145.6 Å²	145.6	36.6 Å²	36.6	78%	0.779	19%	0.189	S	C	*	.	S	Bend	trans	41.9	58.6	-179.7	-93.6	-10.5	0	0	0	114.1	Q1530 S1534 K1555	Q1530-D1532 VanDerWaalsContact C-N 3.33Å; Q1530-D1532 PolarHBondContact O-N 3.5Å; D1532-S1534 PolarHBondContact O-N 3.13Å; D1532-K1555 WeakPolarHBondContact OD1-CE 3.42Å; D1532-K1555 IonicContact OD1-NZ 2.73Å; D1532-K1555 WeakPolarHBondContact OD2-CE 3.41Å; D1532-K1555 IonicContact OD2-NZ 3.78Å; D1532-K1555 PolarHBondContact OD2-NZ 2.8Å
1533	P	81.9	Confident	84.5	Confident	15 Å²	15	35.5 Å²	35.5	10%	0.097	18%	0.183	C	C	.	.			trans	-69.6	134.9	-172.6	31.3	-34.3	0	0	0	110.8	M1529 Q1530 M1554 L1582 D1627	M1529-P1533 HydrophobicContact CB-CB 4.19Å; M1529-P1533 HydrophobicContact CB-CG 4.06Å; M1529-P1533 HydrophobicContact CE-CB 3.54Å; M1529-P1533 VanDerWaalsContact CE-CB 3.42Å; M1529-P1533 HydrophobicContact CE-CG 4.25Å; M1529-P1533 HydrophobicContact CG-CG 4.45Å; Q1530-P1533 WeakPolarHBondContact O-CD 3.31Å; P1533-M1554 HydrophobicContact CB-CB 4.43Å; P1533-M1554 HydrophobicContact CB-CE 4.38Å; P1533-M1554 HydrophobicContact CB-CG 4.28Å; P1533-M1554 HydrophobicContact CG-CB 4.48Å; P1533-M1554 HydrophobicContact CG-CE 4.01Å; P1533-M1554 HydrophobicContact CG-CG 4.48Å; P1533-M1554 VanDerWaalsContact O-CB 3.23Å; P1533-M1554 WeakPolarHBondContact O-CB 3.4Å; P1533-M1554 WeakPolarHBondContact O-CG 3.17Å; P1533-L1582 HydrophobicContact CG-CD1 4.48Å; P1533-D1627 HydrophobicContact CB-CB 3.93Å
1534	S	84.1	Confident	83.8	Confident	47.6 Å²	47.6	41.3 Å²	41.3	33%	0.333	21%	0.214	S	C	.	.			trans	-99.2	-34.3	176.5	74.3	0	0	0	0	112.8	D1532 M1554 D1627	D1532-S1534 PolarHBondContact O-N 3.13Å; S1534-M1554 WeakPolarHBondContact O-CB 3.25Å; S1534-M1554 PolarHBondContact O-N 2.91Å; S1534-D1627 VanDerWaalsContact CA-OD2 3.29Å; S1534-D1627 WeakPolarHBondContact CA-OD2 3.43Å; S1534-D1627 VanDerWaalsContact CB-OD2 3.32Å; S1534-D1627 WeakPolarHBondContact CB-OD2 3.28Å; S1534-D1627 PolarHBondContact N-OD2 3.06Å; S1534-D1627 PolarHBondContact OG-OD2 3.01Å
1535	K	86.7	Confident	83.1	Confident	55.2 Å²	55.2	44 Å²	44	24%	0.24	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	148.3	-175.9	57.7	179.1	177.6	-158.5	0	113.2	E1231 D1232 S1501 E1505 D1506 M1529 T1552 G1626 D1627	E1231-K1535 WeakPolarHBondContact OE2-CD 3.49Å; E1231-K1535 IonicContact OE2-NZ 3.02Å; D1232-K1535 IonicContact OD1-NZ 3.51Å; D1232-K1535 PolarHBondContact OD1-NZ 2.8Å; D1232-K1535 IonicContact OD2-NZ 3.38Å; D1232-K1535 PolarHBondContact OD2-NZ 2.8Å; S1501-K1535 PolarHBondContact O-NZ 3.14Å; E1505-K1535 HydrophobicContact CB-CD 3.68Å; E1505-K1535 HydrophobicContact CG-CD 3.57Å; E1505-K1535 WeakPolarHBondContact OE1-CB 3.28Å; E1505-K1535 WeakPolarHBondContact OE1-CD 3.49Å; D1506-K1535 VanDerWaalsContact N-CE 3.31Å; D1506-K1535 IonicContact OD2-NZ 3.8Å; D1506-K1535 PolarHBondContact OD2-NZ 2.85Å; M1529-K1535 WeakPolarHBondContact CE-O 3.48Å; K1535-T1552 CarbonylContact C-O 3.5Å; K1535-T1552 VanDerWaalsContact CA-O 3.25Å; K1535-T1552 WeakPolarHBondContact CA-O 3.39Å; K1535-G1626 CarbonylContact O-C 3.52Å; K1535-G1626 WeakPolarHBondContact O-CA 3.28Å; K1535-D1627 VanDerWaalsContact CE-OD1 3.3Å; K1535-D1627 WeakPolarHBondContact CE-OD1 3.26Å; K1535-D1627 HydrophobicContact CG-CB 4.39Å; K1535-D1627 VanDerWaalsContact CG-CG 3.44Å; K1535-D1627 WeakPolarHBondContact CG-OD1 3.25Å; K1535-D1627 WeakPolarHBondContact CG-OD2 3.38Å; K1535-D1627 PolarHBondContact N-OD2 3.07Å; K1535-D1627 IonicContact NZ-OD1 2.87Å; K1535-D1627 PolarHBondContact NZ-OD1 3.41Å; K1535-D1627 IonicContact NZ-OD2 3.27Å; K1535-D1627 PolarHBondContact O-N 2.93Å
1536	F	89.2	Confident	83.1	Confident	1.2 Å²	1.2	45.3 Å²	45.3	1%	0.005	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	143.7	167	163.9	-96.9	0	0	0	108.7	V1527 M1529 M1538 N1551 T1552 M1554 W1559 F1588 L1590 I1624 G1625 V1628	V1527-F1536 HydrophobicContact CB-CE2 4.4Å; V1527-F1536 HydrophobicContact CG1-CD2 4.14Å; V1527-F1536 HydrophobicContact CG1-CE2 3.82Å; V1527-F1536 HydrophobicContact CG2-CE2 3.98Å; V1527-F1536 HydrophobicContact CG2-CZ 4.33Å; M1529-F1536 HydrophobicContact CE-CB 3.92Å; M1529-F1536 HydrophobicContact CE-CD2 4.36Å; M1529-F1536 HydrophobicContact SD-CB 4.47Å; M1529-F1536 HydrophobicContact SD-CD2 4.15Å; F1536-M1538 HydrophobicContact CE1-CB 4.45Å; F1536-M1538 HydrophobicContact CZ-CB 4.28Å; F1536-N1551 CarbonylContact O-C 3.56Å; F1536-T1552 PolarHBondContact N-O 3.14Å; F1536-T1552 WeakPolarHBondContact O-CA 3.37Å; F1536-T1552 WeakPolarHBondContact O-CB 3.43Å; F1536-T1552 PolarHBondContact O-N 2.94Å; F1536-M1554 HydrophobicContact CB-CG 4.34Å; F1536-M1554 HydrophobicContact CB-SD 4.06Å; F1536-W1559 AromaticContact CD1-CH2 3.97Å; F1536-W1559 HydrophobicContact CD1-CH2 4.12Å; F1536-W1559 HydrophobicContact CD1-CZ2 4.45Å; F1536-W1559 HydrophobicContact CD1-CZ3 4.42Å; F1536-W1559 AromaticContact CE1-CH2 3.74Å; F1536-W1559 HydrophobicContact CE1-CH2 3.93Å; F1536-W1559 HydrophobicContact CE1-CZ3 4.1Å; F1536-F1588 HydrophobicContact CD1-CZ 4.44Å; F1536-F1588 AromaticContact CD2-CZ 3.97Å; F1536-F1588 HydrophobicContact CD2-CZ 4.09Å; F1536-F1588 HydrophobicContact CE1-CZ 4.36Å; F1536-F1588 HydrophobicContact CE2-CE2 4.49Å; F1536-F1588 AromaticContact CE2-CZ 3.92Å; F1536-F1588 HydrophobicContact CE2-CZ 3.96Å; F1536-F1588 HydrophobicContact CG-CZ 4.34Å; F1536-F1588 HydrophobicContact CZ-CE2 4.38Å; F1536-F1588 AromaticContact CZ-CZ 3.94Å; F1536-F1588 HydrophobicContact CZ-CZ 4.11Å; F1536-L1590 HydrophobicContact CE1-CD2 4.12Å; F1536-L1590 HydrophobicContact CZ-CD2 3.88Å; F1536-I1624 HydrophobicContact CD2-CG2 4.46Å; F1536-I1624 HydrophobicContact CE2-CG2 3.7Å; F1536-I1624 HydrophobicContact CZ-CG2 4.42Å; F1536-G1625 CarbonylContact C-O 3.46Å; F1536-G1625 WeakPolarHBondContact CA-O 3.24Å; F1536-V1628 HydrophobicContact CD2-CG2 3.94Å; F1536-V1628 HydrophobicContact CE2-CG2 4.35Å
1537	Y	89.9	Confident	83.3	Confident	46.2 Å²	46.2	43.8 Å²	43.8	18%	0.181	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	153.6	168.5	61.6	-102.3	0	0	0	113.1	E1505 V1508 I1539 I1550 N1551 I1624 G1625	E1505-Y1537 HydrophobicContact CB-CE1 4.33Å; E1505-Y1537 WeakPolarHBondContact OE1-CD1 3.25Å; E1505-Y1537 VanDerWaalsContact OE2-CD1 3.22Å; E1505-Y1537 WeakPolarHBondContact OE2-CD1 3.33Å; E1505-Y1537 VanDerWaalsContact OE2-CE1 3.27Å; E1505-Y1537 WeakPolarHBondContact OE2-CE1 3.46Å; V1508-Y1537 HydrophobicContact CG2-CE1 4.37Å; V1508-Y1537 WeakPolarHBondContact CG2-OH 3.49Å; Y1537-I1539 HydrophobicContact CD2-CD1 4.15Å; Y1537-I1539 HydrophobicContact CD2-CG1 4.04Å; Y1537-I1539 HydrophobicContact CE2-CD1 4.09Å; Y1537-I1539 HydrophobicContact CE2-CG1 4.41Å; Y1537-I1550 VanDerWaalsContact CA-O 3.26Å; Y1537-I1550 WeakPolarHBondContact CA-O 3.26Å; Y1537-I1550 WeakPolarHBondContact CB-O 3.43Å; Y1537-N1551 WeakPolarHBondContact CB-OD1 3.35Å; Y1537-I1624 CarbonylContact O-C 3.56Å; Y1537-I1624 WeakPolarHBondContact O-CA 3.41Å; Y1537-G1625 VanDerWaalsContact CE1-C 3.47Å; Y1537-G1625 PolarHBondContact N-O 2.79Å; Y1537-G1625 PolarHBondContact O-N 2.96Å
1538	M	90.8	Very high	83.7	Confident	1 Å²	1	43.8 Å²	43.8	1%	0.005	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	127.8	167.5	178.2	178.6	71.1	0	0	109.6	I1523 F1536 V1540 W1548 R1549 I1550 L1590 A1592 L1601 V1622 V1623 I1624	I1523-M1538 HydrophobicContact CG2-SD 4.35Å; F1536-M1538 HydrophobicContact CE1-CB 4.45Å; F1536-M1538 HydrophobicContact CZ-CB 4.28Å; M1538-V1540 HydrophobicContact CE-CG2 4.43Å; M1538-V1540 HydrophobicContact CG-CG2 4.48Å; M1538-W1548 HydrophobicContact CE-CZ3 4.19Å; M1538-R1549 CarbonylContact O-C 3.51Å; M1538-R1549 VanDerWaalsContact O-CA 3.27Å; M1538-R1549 WeakPolarHBondContact O-CA 3.37Å; M1538-I1550 HydrophobicContact CB-CG2 3.8Å; M1538-I1550 HydrophobicContact CE-CG2 4Å; M1538-I1550 PolarHBondContact N-O 3.06Å; M1538-I1550 VanDerWaalsContact N-O 3.08Å; M1538-I1550 PolarHBondContact O-N 3.09Å; M1538-L1590 HydrophobicContact CE-CD2 4.02Å; M1538-L1590 HydrophobicContact SD-CD2 4.06Å; M1538-A1592 HydrophobicContact CE-CB 4.46Å; M1538-L1601 HydrophobicContact CE-CD2 4.46Å; M1538-V1622 HydrophobicContact CG-CG1 3.9Å; M1538-V1622 HydrophobicContact SD-CG1 4.1Å; M1538-V1623 CarbonylContact C-O 3.53Å; M1538-V1623 VanDerWaalsContact CA-O 3.32Å; M1538-V1623 WeakPolarHBondContact CA-O 3.33Å; M1538-I1624 HydrophobicContact CB-CG1 4.2Å; M1538-I1624 HydrophobicContact CG-CD1 4.5Å; M1538-I1624 HydrophobicContact CG-CG1 3.98Å; M1538-I1624 HydrophobicContact SD-CD1 4.39Å; M1538-I1624 HydrophobicContact SD-CG1 4.38Å
1539	I	88.8	Confident	84.2	Confident	23.8 Å²	23.8	43.4 Å²	43.4	12%	0.122	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	126	177.3	-53.2	171.8	0	0	0	108.5	I1223 Y1537 R1541 W1548 R1549 W1569 V1622 V1623	I1223-I1539 HydrophobicContact CD1-CD1 4.11Å; Y1537-I1539 HydrophobicContact CD2-CD1 4.15Å; Y1537-I1539 HydrophobicContact CD2-CG1 4.04Å; Y1537-I1539 HydrophobicContact CE2-CD1 4.09Å; Y1537-I1539 HydrophobicContact CE2-CG1 4.41Å; I1539-R1541 HydrophobicContact CG2-CG 4.43Å; I1539-W1548 CarbonylContact C-O 3.38Å; I1539-W1548 WeakPolarHBondContact CA-O 3.39Å; I1539-R1549 HydrophobicContact CB-CB 4.36Å; I1539-R1549 HydrophobicContact CG1-CB 3.84Å; I1539-R1549 HydrophobicContact CG2-CB 4.43Å; I1539-W1569 HydrophobicContact CG2-CH2 4.11Å; I1539-W1569 HydrophobicContact CG2-CZ2 4.34Å; I1539-V1622 CarbonylContact O-C 3.49Å; I1539-V1622 WeakPolarHBondContact O-CA 3.35Å; I1539-V1623 HydrophobicContact CB-CB 4.4Å; I1539-V1623 PolarHBondContact N-O 3.18Å; I1539-V1623 PolarHBondContact O-N 3.09Å
1540	V	89.1	Confident	84.5	Confident	1.4 Å²	1.4	43.4 Å²	43.4	1%	0.008	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	106.2	173.7	-172.2	0	0	0	0	107.7	I1523 M1538 M1542 A1547 W1548 A1619 V1622	I1523-V1540 HydrophobicContact CD1-CB 4.41Å; I1523-V1540 HydrophobicContact CD1-CG1 4.08Å; I1523-V1540 HydrophobicContact CD1-CG2 3.5Å; I1523-V1540 VanDerWaalsContact CD1-CG2 3.45Å; M1538-V1540 HydrophobicContact CE-CG2 4.43Å; M1538-V1540 HydrophobicContact CG-CG2 4.48Å; V1540-M1542 HydrophobicContact CG1-CG 4.09Å; V1540-M1542 HydrophobicContact CG1-SD 3.71Å; V1540-M1542 VanDerWaalsContact CG1-SD 3.51Å; V1540-M1542 WeakPolarHBondContact CG1-SD 3.4Å; V1540-M1542 PolarHBondContact O-N 3.07Å; V1540-A1547 CarbonylContact O-C 3.58Å; V1540-A1547 VanDerWaalsContact O-CA 3.3Å; V1540-A1547 WeakPolarHBondContact O-CA 3.28Å; V1540-W1548 HydrophobicContact CG2-CE3 4.16Å; V1540-W1548 PolarHBondContact N-O 2.85Å; V1540-W1548 PolarHBondContact O-N 2.93Å; V1540-A1619 HydrophobicContact CG1-CB 3.7Å; V1540-V1622 HydrophobicContact CG1-CG2 4.34Å; V1540-V1622 HydrophobicContact CG2-CG1 4.4Å; V1540-V1622 HydrophobicContact CG2-CG2 4.45Å
1541	R	85.1	Confident	84.8	Confident	80.4 Å²	80.4	41 Å²	41	30%	0.303	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	129.4	165.4	-81.9	-171.4	179.5	175.1	-2.2	108.3	N1202 D1495 I1539 N1545 A1547 A1619 E1620 K1621	N1202-R1541 PolarHBondContact OD1-NH1 2.81Å; N1202-R1541 PolarHBondContact OD1-NH2 2.75Å; D1495-R1541 PolarHBondContact O-NH1 2.82Å; D1495-R1541 PolarHBondContact O-NH2 2.83Å; I1539-R1541 HydrophobicContact CG2-CG 4.43Å; R1541-N1545 PolarHBondContact NH2-OD1 3.1Å; R1541-A1547 HydrophobicContact CG-CB 4.36Å; R1541-A1619 CarbonylContact O-C 3.43Å; R1541-A1619 WeakPolarHBondContact O-CA 3.28Å; R1541-E1620 PolarHBondContact O-N 3.12Å; R1541-K1621 HydrophobicContact CB-CB 4.25Å; R1541-K1621 WeakPolarHBondContact CB-O 3.45Å; R1541-K1621 HydrophobicContact CG-CB 4.37Å; R1541-K1621 PolarHBondContact N-O 3Å; R1541-K1621 PolarHBondContact O-N 2.81Å
1542	M	85.6	Confident	85.3	Confident	1.6 Å²	1.6	36.9 Å²	36.9	1%	0.008	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	174.5	-177.9	-59.9	-103.6	-32.1	0	0	110.1	L1520 V1540 T1546 L1614 P1615 G1616 R1618 A1619	L1520-M1542 HydrophobicContact CB-CE 4.44Å; L1520-M1542 HydrophobicContact CD2-CE 4.28Å; L1520-M1542 HydrophobicContact CD2-SD 4.29Å; V1540-M1542 HydrophobicContact CG1-CG 4.09Å; V1540-M1542 HydrophobicContact CG1-SD 3.71Å; V1540-M1542 VanDerWaalsContact CG1-SD 3.51Å; V1540-M1542 WeakPolarHBondContact CG1-SD 3.4Å; V1540-M1542 PolarHBondContact O-N 3.07Å; M1542-T1546 WeakPolarHBondContact CA-O 3.2Å; M1542-T1546 WeakPolarHBondContact CB-OG1 3.36Å; M1542-T1546 PolarHBondContact N-O 3.22Å; M1542-T1546 VanDerWaalsContact O-O 3.13Å; M1542-L1614 HydrophobicContact CE-CB 4.09Å; M1542-L1614 HydrophobicContact CE-CD1 3.98Å; M1542-L1614 HydrophobicContact CE-CG 4.32Å; M1542-L1614 HydrophobicContact SD-CB 3.8Å; M1542-L1614 HydrophobicContact SD-CD1 4.29Å; M1542-L1614 HydrophobicContact SD-CD2 4.19Å; M1542-L1614 HydrophobicContact SD-CG 4.31Å; M1542-P1615 HydrophobicContact CG-CG 4.36Å; M1542-P1615 HydrophobicContact SD-CG 4.12Å; M1542-G1616 VanDerWaalsContact CE-C 3.48Å; M1542-G1616 VanDerWaalsContact CE-O 3.27Å; M1542-G1616 WeakPolarHBondContact CE-O 3.28Å; M1542-R1618 CarbonylContact C-O 3.51Å; M1542-R1618 VanDerWaalsContact CA-O 3.26Å; M1542-R1618 WeakPolarHBondContact CA-O 3.24Å; M1542-R1618 VanDerWaalsContact CB-O 3.25Å; M1542-R1618 WeakPolarHBondContact CB-O 3.44Å; M1542-A1619 HydrophobicContact SD-CB 3.96Å
1543	D	79.5	Confident	85.7	Confident	15.4 Å²	15.4	33.5 Å²	33.5	8%	0.082	17%	0.17	C	C	.	.	S	Bend	trans	-55.5	162.7	169.7	50.4	-18.6	0	0	0	113	N1545 T1546 G1616 T1617 R1618 E1620	D1543-N1545 VanDerWaalsContact C-N 3.29Å; D1543-N1545 PolarHBondContact O-N 3.03Å; D1543-T1546 PolarHBondContact O-N 3.11Å; D1543-T1546 VanDerWaalsContact O-N 3.12Å; D1543-T1546 PolarHBondContact O-OG1 3.02Å; D1543-G1616 VanDerWaalsContact OD1-C 3.29Å; D1543-G1616 WeakPolarHBondContact OD1-CA 3.27Å; D1543-T1617 VanDerWaalsContact CG-N 3.31Å; D1543-T1617 PolarHBondContact OD1-N 3Å; D1543-T1617 VanDerWaalsContact OD1-N 3.15Å; D1543-T1617 VanDerWaalsContact OD2-CA 3.29Å; D1543-T1617 WeakPolarHBondContact OD2-CA 3.18Å; D1543-T1617 WeakPolarHBondContact OD2-CB 3.12Å; D1543-T1617 PolarHBondContact OD2-N 3.07Å; D1543-T1617 PolarHBondContact OD2-OG1 2.91Å; D1543-R1618 HydrophobicContact CB-CB 4.29Å; D1543-R1618 PolarHBondContact N-O 2.92Å; D1543-R1618 VanDerWaalsContact N-O 3.13Å; D1543-R1618 PolarHBondContact OD1-N 2.92Å; D1543-R1618 PolarHBondContact OD2-N 3.02Å; D1543-E1620 WeakPolarHBondContact CA-OE1 3.18Å
1544	N	73.3	Confident	85.8	Confident	125.2 Å²	125.2	33.2 Å²	33.2	67%	0.67	17%	0.167	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.5	33.8	-179.2	-57.4	-21.5	0	0	0	114	T1546 K1873 Y1875	N1544-T1546 HydrophobicContact CB-CG2 4.43Å; N1544-T1546 WeakPolarHBondContact O-CG2 3.18Å; N1544-T1546 PolarHBondContact O-N 3.06Å; N1544-T1546 VanDerWaalsContact O-N 3.11Å; N1544-K1873 HydrophobicContact CB-CD 4.17Å; N1544-K1873 VanDerWaalsContact O-CD 3.26Å; N1544-K1873 WeakPolarHBondContact O-CD 3.36Å; N1544-K1873 PolarHBondContact O-NZ 3.47Å; N1544-Y1875 VanDerWaalsContact OD1-CD2 3.31Å; N1544-Y1875 WeakPolarHBondContact OD1-CD2 3.03Å
1545	N	68.6	Low	85.7	Confident	103.4 Å²	103.4	38.4 Å²	38.4	55%	0.553	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.4	20	-175.7	-87.3	-16.2	0	0	0	114.6	N1224 D1489 E1490 R1541 D1543	N1224-N1545 PolarHBondContact ND2-O 3.25Å; N1224-N1545 VanDerWaalsContact ND2-O 3.08Å; D1489-N1545 VanDerWaalsContact C-ND2 3.31Å; D1489-N1545 WeakPolarHBondContact O-CB 2.97Å; D1489-N1545 PolarHBondContact O-ND2 2.89Å; D1489-N1545 VanDerWaalsContact O-ND2 3.17Å; E1490-N1545 PolarHBondContact N-ND2 2.88Å; E1490-N1545 PolarHBondContact O-ND2 2.82Å; R1541-N1545 PolarHBondContact NH2-OD1 3.1Å; D1543-N1545 VanDerWaalsContact C-N 3.29Å; D1543-N1545 PolarHBondContact O-N 3.03Å
1546	T	81.9	Confident	85.6	Confident	28.4 Å²	28.4	39.2 Å²	39.2	17%	0.174	19%	0.194	C	C	.	.			trans	-86.2	157.9	176.7	65.5	0	0	0	0	111.2	M1542 D1543 N1544 P1615 G1616	M1542-T1546 WeakPolarHBondContact CA-O 3.2Å; M1542-T1546 WeakPolarHBondContact CB-OG1 3.36Å; M1542-T1546 PolarHBondContact N-O 3.22Å; M1542-T1546 VanDerWaalsContact O-O 3.13Å; D1543-T1546 PolarHBondContact O-N 3.11Å; D1543-T1546 VanDerWaalsContact O-N 3.12Å; D1543-T1546 PolarHBondContact O-OG1 3.02Å; N1544-T1546 HydrophobicContact CB-CG2 4.43Å; N1544-T1546 WeakPolarHBondContact O-CG2 3.18Å; N1544-T1546 PolarHBondContact O-N 3.06Å; N1544-T1546 VanDerWaalsContact O-N 3.11Å; T1546-P1615 HydrophobicContact CG2-CB 4.1Å; T1546-G1616 PolarHBondContact OG1-N 3.35Å
1547	A	85.7	Confident	85.5	Confident	2.6 Å²	2.6	41.5 Å²	41.5	2%	0.021	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	152.1	174.3	0	0	0	0	0	111.4	V1540 R1541 T1563 L1564 W1569	V1540-A1547 CarbonylContact O-C 3.58Å; V1540-A1547 VanDerWaalsContact O-CA 3.3Å; V1540-A1547 WeakPolarHBondContact O-CA 3.28Å; R1541-A1547 HydrophobicContact CG-CB 4.36Å; A1547-T1563 WeakPolarHBondContact O-CA 3.44Å; A1547-L1564 HydrophobicContact CB-CB 3.91Å; A1547-L1564 HydrophobicContact CB-CD2 4.06Å; A1547-L1564 WeakPolarHBondContact O-CB 3.32Å; A1547-L1564 PolarHBondContact O-N 2.96Å; A1547-W1569 HydrophobicContact CB-CH2 3.66Å; A1547-W1569 HydrophobicContact CB-CZ2 4.28Å; A1547-W1569 HydrophobicContact CB-CZ3 4.36Å; A1547-W1569 WeakPolarHBondContact O-CZ3 3.23Å
1548	W	91.9	Very high	85.4	Confident	1.6 Å²	1.6	45.3 Å²	45.3	1%	0.006	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	133.5	175.4	-176.9	86.9	0	0	0	108.5	M1538 I1539 V1540 I1550 P1561 E1562 Q1572 V1599 L1601 Y1612 L1614 P1615	M1538-W1548 HydrophobicContact CE-CZ3 4.19Å; I1539-W1548 CarbonylContact C-O 3.38Å; I1539-W1548 WeakPolarHBondContact CA-O 3.39Å; V1540-W1548 HydrophobicContact CG2-CE3 4.16Å; V1540-W1548 PolarHBondContact N-O 2.85Å; V1540-W1548 PolarHBondContact O-N 2.93Å; W1548-I1550 HydrophobicContact CH2-CB 3.77Å; W1548-I1550 HydrophobicContact CH2-CG1 4.5Å; W1548-I1550 HydrophobicContact CH2-CG2 4.03Å; W1548-I1550 HydrophobicContact CZ2-CB 4.43Å; W1548-I1550 HydrophobicContact CZ3-CB 3.96Å; W1548-I1550 HydrophobicContact CZ3-CG2 3.82Å; W1548-P1561 HydrophobicContact CZ2-CB 3.91Å; W1548-E1562 CarbonylContact C-O 3.56Å; W1548-E1562 WeakPolarHBondContact CA-O 3.26Å; W1548-Q1572 VanDerWaalsContact CD1-OE1 3.3Å; W1548-V1599 HydrophobicContact CH2-CG1 4.06Å; W1548-V1599 HydrophobicContact CZ2-CG1 3.75Å; W1548-V1599 HydrophobicContact CZ3-CG1 4.49Å; W1548-L1601 HydrophobicContact CH2-CD1 4.21Å; W1548-L1601 HydrophobicContact CH2-CD2 4.15Å; W1548-L1601 HydrophobicContact CH2-CG 4.43Å; W1548-Y1612 HydrophobicContact CZ2-CD2 4.41Å; W1548-L1614 HydrophobicContact CB-CD2 3.91Å; W1548-L1614 HydrophobicContact CD2-CD2 3.7Å; W1548-L1614 HydrophobicContact CE3-CD2 4.12Å; W1548-L1614 HydrophobicContact CG-CD2 3.6Å; W1548-P1615 HydrophobicContact CB-CG 4.43Å
1549	R	91.8	Very high	85.4	Confident	42.6 Å²	42.6	45.3 Å²	45.3	16%	0.161	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	150	174.4	74.1	-178.4	179.9	174	4.1	111.4	E1228 M1538 I1539 N1551 P1561 E1562 W1569	E1228-R1549 IonicContact OE2-CZ 2.75Å; E1228-R1549 IonicContact OE2-NH1 3.32Å; E1228-R1549 PolarHBondContact OE2-NH1 3.31Å; M1538-R1549 CarbonylContact O-C 3.51Å; M1538-R1549 VanDerWaalsContact O-CA 3.27Å; M1538-R1549 WeakPolarHBondContact O-CA 3.37Å; I1539-R1549 HydrophobicContact CB-CB 4.36Å; I1539-R1549 HydrophobicContact CG1-CB 3.84Å; I1539-R1549 HydrophobicContact CG2-CB 4.43Å; R1549-N1551 WeakPolarHBondContact CD-ND2 3.18Å; R1549-N1551 WeakPolarHBondContact CD-OD1 2.99Å; R1549-N1551 VanDerWaalsContact CZ-ND2 3.26Å; R1549-N1551 PolarHBondContact NE-ND2 3.06Å; R1549-N1551 VanDerWaalsContact NE-ND2 3.14Å; R1549-P1561 CarbonylContact O-C 3.52Å; R1549-P1561 WeakPolarHBondContact O-CA 3.31Å; R1549-E1562 HydrophobicContact CG-CB 3.9Å; R1549-E1562 HydrophobicContact CG-CG 4.48Å; R1549-E1562 IonicContact CZ-OE1 3.48Å; R1549-E1562 IonicContact CZ-OE2 3.01Å; R1549-E1562 PolarHBondContact N-O 3.07Å; R1549-E1562 IonicContact NE-OE1 2.93Å; R1549-E1562 IonicContact NE-OE2 3.07Å; R1549-E1562 PolarHBondContact NE-OE2 3.02Å; R1549-E1562 VanDerWaalsContact NH2-CD 3.31Å; R1549-E1562 IonicContact NH2-OE1 2.72Å; R1549-E1562 PolarHBondContact NH2-OE1 3.1Å; R1549-E1562 IonicContact NH2-OE2 3.39Å; R1549-E1562 PolarHBondContact NH2-OE2 3.23Å; R1549-E1562 PolarHBondContact O-N 3.04Å; R1549-W1569 HydrophobicContact CB-CE3 4.39Å; R1549-W1569 HydrophobicContact CB-CH2 3.79Å; R1549-W1569 HydrophobicContact CB-CZ2 4.39Å; R1549-W1569 HydrophobicContact CB-CZ3 3.78Å; R1549-W1569 HydrophobicContact CG-CD2 4.15Å; R1549-W1569 HydrophobicContact CG-CE3 3.66Å; R1549-W1569 HydrophobicContact CG-CH2 3.87Å; R1549-W1569 HydrophobicContact CG-CZ2 4.34Å; R1549-W1569 HydrophobicContact CG-CZ3 3.52Å; R1549-W1569 VanDerWaalsContact CG-CZ3 3.49Å; R1549-W1569 VanDerWaalsContact CZ-CD1 3.49Å; R1549-W1569 VanDerWaalsContact N-CZ3 3.33Å
1550	I	91.3	Very high	85.5	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	113.1	169.9	-178.7	69.4	0	0	0	108	Y1537 M1538 W1548 W1559 P1561 F1576 L1601	Y1537-I1550 VanDerWaalsContact CA-O 3.26Å; Y1537-I1550 WeakPolarHBondContact CA-O 3.26Å; Y1537-I1550 WeakPolarHBondContact CB-O 3.43Å; M1538-I1550 HydrophobicContact CB-CG2 3.8Å; M1538-I1550 HydrophobicContact CE-CG2 4Å; M1538-I1550 PolarHBondContact N-O 3.06Å; M1538-I1550 VanDerWaalsContact N-O 3.08Å; M1538-I1550 PolarHBondContact O-N 3.09Å; W1548-I1550 HydrophobicContact CH2-CB 3.77Å; W1548-I1550 HydrophobicContact CH2-CG1 4.5Å; W1548-I1550 HydrophobicContact CH2-CG2 4.03Å; W1548-I1550 HydrophobicContact CZ2-CB 4.43Å; W1548-I1550 HydrophobicContact CZ3-CB 3.96Å; W1548-I1550 HydrophobicContact CZ3-CG2 3.82Å; I1550-W1559 HydrophobicContact CD1-CB 4.21Å; I1550-W1559 HydrophobicContact CD1-CE3 4.04Å; I1550-W1559 HydrophobicContact CG1-CE3 3.54Å; I1550-W1559 VanDerWaalsContact CG1-CE3 3.47Å; I1550-W1559 HydrophobicContact CG1-CZ3 4.02Å; I1550-P1561 HydrophobicContact CD1-CB 3.85Å; I1550-P1561 HydrophobicContact CD1-CG 4.27Å; I1550-F1576 HydrophobicContact CD1-CE1 4.27Å; I1550-L1601 HydrophobicContact CB-CD1 4.42Å; I1550-L1601 HydrophobicContact CD1-CD1 4.06Å; I1550-L1601 HydrophobicContact CG1-CD1 3.78Å; I1550-L1601 HydrophobicContact CG2-CD1 4.45Å
1551	N	89	Confident	85.6	Confident	29.8 Å²	29.8	45.3 Å²	45.3	16%	0.159	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100	140	178.9	-64.1	-33.8	0	0	0	109.5	F1536 Y1537 R1549 W1559 T1560 E1562	F1536-N1551 CarbonylContact O-C 3.56Å; Y1537-N1551 WeakPolarHBondContact CB-OD1 3.35Å; R1549-N1551 WeakPolarHBondContact CD-ND2 3.18Å; R1549-N1551 WeakPolarHBondContact CD-OD1 2.99Å; R1549-N1551 VanDerWaalsContact CZ-ND2 3.26Å; R1549-N1551 PolarHBondContact NE-ND2 3.06Å; R1549-N1551 VanDerWaalsContact NE-ND2 3.14Å; N1551-W1559 CarbonylContact O-C 3.56Å; N1551-W1559 WeakPolarHBondContact O-CA 3.16Å; N1551-T1560 PolarHBondContact N-O 2.83Å; N1551-T1560 PolarHBondContact O-N 3.12Å; N1551-E1562 VanDerWaalsContact ND2-CD 3.31Å; N1551-E1562 PolarHBondContact ND2-OE1 3.12Å; N1551-E1562 VanDerWaalsContact ND2-OE1 3.09Å; N1551-E1562 PolarHBondContact ND2-OE2 3Å
1552	T	87.8	Confident	85.8	Confident	6 Å²	6	42.6 Å²	42.6	4%	0.037	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	121.2	-178.8	-57.6	0	0	0	0	110.5	K1535 F1536 M1554 R1558 W1559	K1535-T1552 CarbonylContact C-O 3.5Å; K1535-T1552 VanDerWaalsContact CA-O 3.25Å; K1535-T1552 WeakPolarHBondContact CA-O 3.39Å; F1536-T1552 PolarHBondContact N-O 3.14Å; F1536-T1552 WeakPolarHBondContact O-CA 3.37Å; F1536-T1552 WeakPolarHBondContact O-CB 3.43Å; F1536-T1552 PolarHBondContact O-N 2.94Å; T1552-M1554 HydrophobicContact CG2-CG 4.38Å; T1552-M1554 HydrophobicContact CG2-SD 3.83Å; T1552-M1554 PolarHBondContact O-N 3.37Å; T1552-R1558 WeakPolarHBondContact CA-O 3.07Å; T1552-W1559 HydrophobicContact CG2-CD2 4.03Å; T1552-W1559 VanDerWaalsContact CG2-CE2 3.5Å; T1552-W1559 HydrophobicContact CG2-CE3 4.49Å; T1552-W1559 HydrophobicContact CG2-CG 4.16Å; T1552-W1559 HydrophobicContact CG2-CH2 4.41Å; T1552-W1559 HydrophobicContact CG2-CZ2 3.97Å; T1552-W1559 VanDerWaalsContact OG1-CE2 3.31Å; T1552-W1559 WeakPolarHBondContact OG1-CH2 3.42Å; T1552-W1559 WeakPolarHBondContact OG1-CZ3 3.46Å
1553	N	87.2	Confident	85.9	Confident	74.8 Å²	74.8	43.1 Å²	43.1	40%	0.4	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	111.5	166	179.1	-53.7	0	0	0	108.1	K1555 T1556 Q1557 R1558	N1553-K1555 VanDerWaalsContact C-N 3.32Å; N1553-K1555 PolarHBondContact O-N 3.19Å; N1553-K1555 WeakPolarHBondContact OD1-CB 3.36Å; N1553-K1555 PolarHBondContact OD1-N 2.91Å; N1553-K1555 VanDerWaalsContact OD1-N 3.11Å; N1553-T1556 VanDerWaalsContact CB-OG1 3.29Å; N1553-T1556 WeakPolarHBondContact CB-OG1 3.35Å; N1553-T1556 VanDerWaalsContact CG-OG1 3.25Å; N1553-T1556 PolarHBondContact O-N 3.07Å; N1553-T1556 PolarHBondContact O-OG1 3.15Å; N1553-T1556 WeakPolarHBondContact OD1-CB 3.23Å; N1553-T1556 WeakPolarHBondContact OD1-CG2 3.35Å; N1553-T1556 PolarHBondContact OD1-N 2.87Å; N1553-T1556 PolarHBondContact OD1-OG1 2.93Å; N1553-Q1557 CarbonylContact O-C 3.59Å; N1553-Q1557 VanDerWaalsContact O-CA 3.25Å; N1553-Q1557 WeakPolarHBondContact O-CA 3.39Å; N1553-Q1557 PolarHBondContact O-N 2.94Å; N1553-R1558 PolarHBondContact N-O 3Å; N1553-R1558 PolarHBondContact O-N 2.98Å
1554	M	84.1	Confident	85.9	Confident	8.4 Å²	8.4	43.1 Å²	43.1	4%	0.041	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-32.5	-172.8	-63	-65.4	-69.8	0	0	112.1	M1529 P1533 S1534 F1536 T1552 T1556 Q1557 L1580 L1582 N1583	M1529-M1554 HydrophobicContact CE-CE 4.17Å; M1529-M1554 HydrophobicContact CE-CG 4.36Å; M1529-M1554 HydrophobicContact CE-SD 4.41Å; M1529-M1554 HydrophobicContact CG-CE 4.34Å; P1533-M1554 HydrophobicContact CB-CB 4.43Å; P1533-M1554 HydrophobicContact CB-CE 4.38Å; P1533-M1554 HydrophobicContact CB-CG 4.28Å; P1533-M1554 HydrophobicContact CG-CB 4.48Å; P1533-M1554 HydrophobicContact CG-CE 4.01Å; P1533-M1554 HydrophobicContact CG-CG 4.48Å; P1533-M1554 VanDerWaalsContact O-CB 3.23Å; P1533-M1554 WeakPolarHBondContact O-CB 3.4Å; P1533-M1554 WeakPolarHBondContact O-CG 3.17Å; S1534-M1554 WeakPolarHBondContact O-CB 3.25Å; S1534-M1554 PolarHBondContact O-N 2.91Å; F1536-M1554 HydrophobicContact CB-CG 4.34Å; F1536-M1554 HydrophobicContact CB-SD 4.06Å; T1552-M1554 HydrophobicContact CG2-CG 4.38Å; T1552-M1554 HydrophobicContact CG2-SD 3.83Å; T1552-M1554 PolarHBondContact O-N 3.37Å; M1554-T1556 PolarHBondContact O-N 3.23Å; M1554-Q1557 VanDerWaalsContact O-CG 3.26Å; M1554-Q1557 WeakPolarHBondContact O-CG 3.41Å; M1554-Q1557 PolarHBondContact O-N 2.81Å; M1554-L1580 HydrophobicContact CE-CB 4.03Å; M1554-L1580 HydrophobicContact CE-CD2 3.51Å; M1554-L1580 HydrophobicContact CE-CG 4.41Å; M1554-L1580 HydrophobicContact SD-CD2 3.94Å; M1554-L1582 HydrophobicContact CE-CB 3.74Å; M1554-L1582 HydrophobicContact CE-CD1 4.04Å; M1554-L1582 HydrophobicContact SD-CD1 4.34Å; M1554-N1583 PolarHBondContact O-ND2 2.83Å; M1554-N1583 PolarHBondContact O-OD1 3.14Å; M1554-N1583 VanDerWaalsContact O-OD1 3.11Å
1555	K	82	Confident	85.6	Confident	156.6 Å²	156.6	40.2 Å²	40.2	68%	0.681	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-39.2	178.4	-63.7	-172.6	177	-173.6	0	112.3	D1532 N1553	D1532-K1555 WeakPolarHBondContact OD1-CE 3.42Å; D1532-K1555 IonicContact OD1-NZ 2.73Å; D1532-K1555 WeakPolarHBondContact OD2-CE 3.41Å; D1532-K1555 IonicContact OD2-NZ 3.78Å; D1532-K1555 PolarHBondContact OD2-NZ 2.8Å; N1553-K1555 VanDerWaalsContact C-N 3.32Å; N1553-K1555 PolarHBondContact O-N 3.19Å; N1553-K1555 WeakPolarHBondContact OD1-CB 3.36Å; N1553-K1555 PolarHBondContact OD1-N 2.91Å; N1553-K1555 VanDerWaalsContact OD1-N 3.11Å
1556	T	85.7	Confident	85.1	Confident	73.8 Å²	73.8	41 Å²	41	45%	0.453	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94	-10.2	177.8	62	0	0	0	0	113.8	N1553 M1554 R1558 K1577	N1553-T1556 VanDerWaalsContact CB-OG1 3.29Å; N1553-T1556 WeakPolarHBondContact CB-OG1 3.35Å; N1553-T1556 VanDerWaalsContact CG-OG1 3.25Å; N1553-T1556 PolarHBondContact O-N 3.07Å; N1553-T1556 PolarHBondContact O-OG1 3.15Å; N1553-T1556 WeakPolarHBondContact OD1-CB 3.23Å; N1553-T1556 WeakPolarHBondContact OD1-CG2 3.35Å; N1553-T1556 PolarHBondContact OD1-N 2.87Å; N1553-T1556 PolarHBondContact OD1-OG1 2.93Å; M1554-T1556 PolarHBondContact O-N 3.23Å; T1556-R1558 PolarHBondContact O-N 3.06Å; T1556-R1558 WeakPolarHBondContact OG1-CB 3.29Å; T1556-R1558 PolarHBondContact OG1-N 2.74Å; T1556-K1577 WeakPolarHBondContact O-CE 3.46Å
1557	Q	85.6	Confident	84.2	Confident	48.6 Å²	48.6	42.9 Å²	42.9	23%	0.227	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.7	26.7	-172.3	-59	173.3	-4.3	0	0	113.6	N1553 M1554 K1577 S1578 N1583	N1553-Q1557 CarbonylContact O-C 3.59Å; N1553-Q1557 VanDerWaalsContact O-CA 3.25Å; N1553-Q1557 WeakPolarHBondContact O-CA 3.39Å; N1553-Q1557 PolarHBondContact O-N 2.94Å; M1554-Q1557 VanDerWaalsContact O-CG 3.26Å; M1554-Q1557 WeakPolarHBondContact O-CG 3.41Å; M1554-Q1557 PolarHBondContact O-N 2.81Å; Q1557-K1577 HydrophobicContact CB-CG 4.24Å; Q1557-K1577 VanDerWaalsContact O-CA 3.32Å; Q1557-K1577 WeakPolarHBondContact O-CA 3.39Å; Q1557-K1577 WeakPolarHBondContact O-CG 3.39Å; Q1557-S1578 PolarHBondContact O-N 3.05Å; Q1557-N1583 WeakPolarHBondContact CG-OD1 3.49Å; Q1557-N1583 VanDerWaalsContact NE2-CG 3.34Å; Q1557-N1583 PolarHBondContact NE2-OD1 3.28Å
1558	R	89	Confident	83.1	Confident	126.8 Å²	126.8	46.1 Å²	46.1	48%	0.478	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	127.8	179.7	-172.1	174.6	-178.3	145.8	-0.2	110.6	T1552 N1553 T1556 S1575 F1576 K1577	T1552-R1558 WeakPolarHBondContact CA-O 3.07Å; N1553-R1558 PolarHBondContact N-O 3Å; N1553-R1558 PolarHBondContact O-N 2.98Å; T1556-R1558 PolarHBondContact O-N 3.06Å; T1556-R1558 WeakPolarHBondContact OG1-CB 3.29Å; T1556-R1558 PolarHBondContact OG1-N 2.74Å; R1558-S1575 VanDerWaalsContact CZ-OG 3.23Å; R1558-S1575 PolarHBondContact NE-OG 3.2Å; R1558-S1575 VanDerWaalsContact NE-OG 3.14Å; R1558-S1575 PolarHBondContact NH2-OG 2.96Å; R1558-F1576 WeakPolarHBondContact CA-O 3.45Å; R1558-K1577 HydrophobicContact CB-CG 4.4Å; R1558-K1577 HydrophobicContact CG-CG 4.48Å
1559	W	90.9	Very high	82.4	Confident	0.8 Å²	0.8	48.2 Å²	48.2	0%	0.003	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	122.6	-179.5	-72.4	66.6	0	0	0	109.6	F1536 I1550 N1551 T1552 P1561 S1575 F1576 S1578 L1580 L1582 L1590 L1601 V1603 I1608	F1536-W1559 AromaticContact CD1-CH2 3.97Å; F1536-W1559 HydrophobicContact CD1-CH2 4.12Å; F1536-W1559 HydrophobicContact CD1-CZ2 4.45Å; F1536-W1559 HydrophobicContact CD1-CZ3 4.42Å; F1536-W1559 AromaticContact CE1-CH2 3.74Å; F1536-W1559 HydrophobicContact CE1-CH2 3.93Å; F1536-W1559 HydrophobicContact CE1-CZ3 4.1Å; I1550-W1559 HydrophobicContact CD1-CB 4.21Å; I1550-W1559 HydrophobicContact CD1-CE3 4.04Å; I1550-W1559 HydrophobicContact CG1-CE3 3.54Å; I1550-W1559 VanDerWaalsContact CG1-CE3 3.47Å; I1550-W1559 HydrophobicContact CG1-CZ3 4.02Å; N1551-W1559 CarbonylContact O-C 3.56Å; N1551-W1559 WeakPolarHBondContact O-CA 3.16Å; T1552-W1559 HydrophobicContact CG2-CD2 4.03Å; T1552-W1559 VanDerWaalsContact CG2-CE2 3.5Å; T1552-W1559 HydrophobicContact CG2-CE3 4.49Å; T1552-W1559 HydrophobicContact CG2-CG 4.16Å; T1552-W1559 HydrophobicContact CG2-CH2 4.41Å; T1552-W1559 HydrophobicContact CG2-CZ2 3.97Å; T1552-W1559 VanDerWaalsContact OG1-CE2 3.31Å; T1552-W1559 WeakPolarHBondContact OG1-CH2 3.42Å; T1552-W1559 WeakPolarHBondContact OG1-CZ3 3.46Å; W1559-P1561 WeakPolarHBondContact O-CD 3.01Å; W1559-S1575 CarbonylContact O-C 3.37Å; W1559-S1575 VanDerWaalsContact O-CA 3.29Å; W1559-S1575 WeakPolarHBondContact O-CA 3.45Å; W1559-S1575 VanDerWaalsContact O-CB 3.24Å; W1559-S1575 WeakPolarHBondContact O-CB 3.31Å; W1559-F1576 HydrophobicContact CB-CD1 3.91Å; W1559-F1576 HydrophobicContact CB-CD2 4.01Å; W1559-F1576 HydrophobicContact CB-CE1 3.48Å; W1559-F1576 VanDerWaalsContact CB-CE1 3.45Å; W1559-F1576 HydrophobicContact CB-CE2 3.57Å; W1559-F1576 HydrophobicContact CB-CG 4.17Å; W1559-F1576 HydrophobicContact CB-CZ 3.28Å; W1559-F1576 AromaticContact CD1-CE2 3.9Å; W1559-F1576 HydrophobicContact CD2-CE2 4.2Å; W1559-F1576 AromaticContact CD2-CZ 3.9Å; W1559-F1576 HydrophobicContact CD2-CZ 3.98Å; W1559-F1576 AromaticContact CE3-CZ 3.92Å; W1559-F1576 HydrophobicContact CE3-CZ 4.06Å; W1559-F1576 HydrophobicContact CG-CD2 4.41Å; W1559-F1576 HydrophobicContact CG-CE1 4.35Å; W1559-F1576 AromaticContact CG-CE2 3.7Å; W1559-F1576 HydrophobicContact CG-CE2 3.7Å; W1559-F1576 AromaticContact CG-CZ 3.67Å; W1559-F1576 HydrophobicContact CG-CZ 3.67Å; W1559-F1576 PolarHBondContact N-O 3.01Å; W1559-F1576 PolarHBondContact O-N 3.12Å; W1559-F1576 VanDerWaalsContact O-N 3.1Å; W1559-S1578 PolarHBondContact NE1-O 3.24Å; W1559-L1580 HydrophobicContact CH2-CD1 3.53Å; W1559-L1580 HydrophobicContact CZ2-CD1 3.32Å; W1559-L1582 HydrophobicContact CH2-CD1 4.38Å; W1559-L1582 HydrophobicContact CZ2-CD1 3.64Å; W1559-L1590 HydrophobicContact CH2-CD1 4.31Å; W1559-L1590 HydrophobicContact CZ3-CD1 4.29Å; W1559-L1601 HydrophobicContact CE3-CD1 4.06Å; W1559-L1601 HydrophobicContact CZ3-CD1 4.14Å; W1559-V1603 HydrophobicContact CH2-CG2 4.31Å; W1559-V1603 HydrophobicContact CZ2-CG2 4.45Å; W1559-I1608 HydrophobicContact CD2-CD1 3.98Å; W1559-I1608 HydrophobicContact CE3-CD1 3.94Å; W1559-I1608 HydrophobicContact CH2-CD1 3.89Å; W1559-I1608 HydrophobicContact CZ2-CD1 3.86Å; W1559-I1608 HydrophobicContact CZ3-CD1 3.92Å
1560	T	90	Very high	81.7	Confident	23.6 Å²	23.6	49.7 Å²	49.7	15%	0.145	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	100.5	-170.7	-53	0	0	0	0	109.8	N1551 E1562 Q1571 S1575	N1551-T1560 PolarHBondContact N-O 2.83Å; N1551-T1560 PolarHBondContact O-N 3.12Å; T1560-E1562 HydrophobicContact CG2-CG 4.06Å; T1560-E1562 WeakPolarHBondContact CG2-OE1 3.2Å; T1560-Q1571 HydrophobicContact CG2-CG 3.78Å; T1560-Q1571 VanDerWaalsContact CG2-OE1 3.32Å; T1560-S1575 WeakPolarHBondContact OG1-CB 3.42Å
1561	P	91.4	Very high	81.2	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	139.1	174.4	26.4	-24.3	0	0	0	110.9	W1548 R1549 I1550 W1559 Q1571 Q1572 I1574 Y1612	W1548-P1561 HydrophobicContact CZ2-CB 3.91Å; R1549-P1561 CarbonylContact O-C 3.52Å; R1549-P1561 WeakPolarHBondContact O-CA 3.31Å; I1550-P1561 HydrophobicContact CD1-CB 3.85Å; I1550-P1561 HydrophobicContact CD1-CG 4.27Å; W1559-P1561 WeakPolarHBondContact O-CD 3.01Å; P1561-Q1571 WeakPolarHBondContact O-CG 3.42Å; P1561-Q1572 HydrophobicContact CB-CB 4.48Å; P1561-Q1572 HydrophobicContact CG-CB 4.25Å; P1561-Q1572 PolarHBondContact O-N 3.12Å; P1561-I1574 WeakPolarHBondContact CG-O 3.45Å; P1561-Y1612 HydrophobicContact CB-CD1 4.16Å; P1561-Y1612 HydrophobicContact CB-CE1 4.27Å; P1561-Y1612 HydrophobicContact CB-CG 4.36Å; P1561-Y1612 HydrophobicContact CG-CD1 3.64Å; P1561-Y1612 HydrophobicContact CG-CD2 4.27Å; P1561-Y1612 HydrophobicContact CG-CE1 3.29Å; P1561-Y1612 VanDerWaalsContact CG-CE1 3.45Å; P1561-Y1612 HydrophobicContact CG-CE2 4.02Å; P1561-Y1612 HydrophobicContact CG-CG 4.16Å; P1561-Y1612 VanDerWaalsContact CG-CZ 3.48Å
1562	E	89.8	Confident	80.3	Confident	24.8 Å²	24.8	54.7 Å²	54.7	12%	0.116	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	147.2	-175.8	-57.4	168.6	-147.1	0	0	110	W1548 R1549 N1551 T1560 W1569 V1570 Q1571	W1548-E1562 CarbonylContact C-O 3.56Å; W1548-E1562 WeakPolarHBondContact CA-O 3.26Å; R1549-E1562 HydrophobicContact CG-CB 3.9Å; R1549-E1562 HydrophobicContact CG-CG 4.48Å; R1549-E1562 IonicContact CZ-OE1 3.48Å; R1549-E1562 IonicContact CZ-OE2 3.01Å; R1549-E1562 PolarHBondContact N-O 3.07Å; R1549-E1562 IonicContact NE-OE1 2.93Å; R1549-E1562 IonicContact NE-OE2 3.07Å; R1549-E1562 PolarHBondContact NE-OE2 3.02Å; R1549-E1562 VanDerWaalsContact NH2-CD 3.31Å; R1549-E1562 IonicContact NH2-OE1 2.72Å; R1549-E1562 PolarHBondContact NH2-OE1 3.1Å; R1549-E1562 IonicContact NH2-OE2 3.39Å; R1549-E1562 PolarHBondContact NH2-OE2 3.23Å; R1549-E1562 PolarHBondContact O-N 3.04Å; N1551-E1562 VanDerWaalsContact ND2-CD 3.31Å; N1551-E1562 PolarHBondContact ND2-OE1 3.12Å; N1551-E1562 VanDerWaalsContact ND2-OE1 3.09Å; N1551-E1562 PolarHBondContact ND2-OE2 3Å; T1560-E1562 HydrophobicContact CG2-CG 4.06Å; T1560-E1562 WeakPolarHBondContact CG2-OE1 3.2Å; E1562-W1569 HydrophobicContact CB-CB 4.47Å; E1562-W1569 HydrophobicContact CB-CE3 4.05Å; E1562-W1569 WeakPolarHBondContact O-CZ3 3.37Å; E1562-W1569 WeakPolarHBondContact OE2-CB 3.46Å; E1562-V1570 CarbonylContact C-O 3.54Å; E1562-V1570 VanDerWaalsContact CA-O 3.26Å; E1562-V1570 WeakPolarHBondContact CA-O 3.26Å; E1562-Q1571 HydrophobicContact CG-CB 4.3Å; E1562-Q1571 HydrophobicContact CG-CG 4.39Å
1563	T	87.4	Confident	79.3	Confident	11.2 Å²	11.2	62.4 Å²	62.4	7%	0.069	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	139.3	178.4	-68.7	0	0	0	0	110.1	A1547 V1565 V1570 Q1572 P1615	A1547-T1563 WeakPolarHBondContact O-CA 3.44Å; T1563-V1565 HydrophobicContact CG2-CG2 3.91Å; T1563-V1565 PolarHBondContact O-N 2.98Å; T1563-V1570 PolarHBondContact N-O 3.07Å; T1563-V1570 PolarHBondContact O-N 3.09Å; T1563-Q1572 WeakPolarHBondContact OG1-CG 3.36Å; T1563-Q1572 PolarHBondContact OG1-NE2 3.02Å; T1563-Q1572 VanDerWaalsContact OG1-NE2 3.11Å; T1563-P1615 HydrophobicContact CG2-CB 3.81Å; T1563-P1615 HydrophobicContact CG2-CG 3.93Å
1564	L	80.5	Confident	78.6	Confident	16.8 Å²	16.8	65.2 Å²	65.2	9%	0.088	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	103.7	174.4	-167.2	75.6	0	0	0	109.3	N1203 N1224 N1497 A1547 N1567 V1568 W1569	N1203-L1564 WeakPolarHBondContact ND2-CD1 3.37Å; N1224-L1564 HydrophobicContact CB-CD2 3.86Å; N1224-L1564 WeakPolarHBondContact ND2-CD2 3.26Å; N1497-L1564 WeakPolarHBondContact O-CD2 3.47Å; A1547-L1564 HydrophobicContact CB-CB 3.91Å; A1547-L1564 HydrophobicContact CB-CD2 4.06Å; A1547-L1564 WeakPolarHBondContact O-CB 3.32Å; A1547-L1564 PolarHBondContact O-N 2.96Å; L1564-N1567 VanDerWaalsContact CD1-C 3.45Å; L1564-N1567 WeakPolarHBondContact CD1-O 3.37Å; L1564-V1568 CarbonylContact C-O 3.46Å; L1564-V1568 WeakPolarHBondContact CA-O 3.4Å; L1564-W1569 HydrophobicContact CB-CD2 4.32Å; L1564-W1569 HydrophobicContact CB-CE3 4.07Å; L1564-W1569 HydrophobicContact CB-CH2 4.1Å; L1564-W1569 HydrophobicContact CB-CZ2 4.33Å; L1564-W1569 HydrophobicContact CB-CZ3 3.92Å; L1564-W1569 HydrophobicContact CD1-CD2 3.9Å; L1564-W1569 HydrophobicContact CD1-CE3 4.39Å; L1564-W1569 HydrophobicContact CD1-CG 4.13Å; L1564-W1569 HydrophobicContact CD1-CH2 4.42Å; L1564-W1569 HydrophobicContact CD1-CZ2 4.18Å; L1564-W1569 VanDerWaalsContact N-CE3 3.26Å; L1564-W1569 VanDerWaalsContact N-CZ3 3.3Å
1565	V	66.5	Low	78.6	Confident	64 Å²	64	65.4 Å²	65.4	39%	0.388	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	123.5	177.4	-177.1	0	0	0	0	107.8	T1563 N1567 V1568 V1570	T1563-V1565 HydrophobicContact CG2-CG2 3.91Å; T1563-V1565 PolarHBondContact O-N 2.98Å; V1565-N1567 VanDerWaalsContact C-N 3.25Å; V1565-N1567 CarbonylContact O-C 3.52Å; V1565-N1567 PolarHBondContact O-N 3.11Å; V1565-V1568 PolarHBondContact N-O 3.13Å; V1565-V1568 WeakPolarHBondContact O-CA 3.4Å; V1565-V1568 WeakPolarHBondContact O-CB 3.39Å; V1565-V1568 PolarHBondContact O-N 3.14Å; V1565-V1568 VanDerWaalsContact O-O 3.06Å; V1565-V1570 HydrophobicContact CB-CB 4.4Å; V1565-V1570 HydrophobicContact CB-CG2 4.13Å; V1565-V1570 HydrophobicContact CG2-CB 4.33Å; V1565-V1570 HydrophobicContact CG2-CG2 4.22Å
1566	N	57.9	Low	78.9	Confident	119.8 Å²	119.8	59.1 Å²	59.1	64%	0.641	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.8	39.8	-179.7	-58.9	-10.5	0	0	0	113.5	N1491 E1492 V1568 Q1871	N1491-N1566 CarbonylContact O-C 3.57Å; E1492-N1566 CarbonylContact C-O 3.58Å; E1492-N1566 VanDerWaalsContact C-O 3.26Å; E1492-N1566 CarbonylContact O-C 3.6Å; N1566-V1568 PolarHBondContact O-N 2.93Å; N1566-V1568 VanDerWaalsContact O-N 3.14Å; N1566-Q1871 VanDerWaalsContact OD1-CD 3.27Å; N1566-Q1871 PolarHBondContact OD1-NE2 2.85Å; N1566-Q1871 PolarHBondContact OD1-OE1 2.83Å
1567	N	62.8	Low	78.8	Confident	68.4 Å²	68.4	62.6 Å²	62.6	37%	0.366	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.5	20.8	-171.9	-74.1	-21.9	0	0	0	115.9	N1203 N1224 V1226 N1491 T1498 K1499 L1564 V1565	N1203-N1567 PolarHBondContact ND2-O 2.94Å; N1203-N1567 VanDerWaalsContact ND2-O 3.1Å; N1224-N1567 WeakPolarHBondContact CB-OD1 3.45Å; N1224-N1567 PolarHBondContact O-ND2 2.9Å; N1224-N1567 PolarHBondContact O-OD1 2.88Å; V1226-N1567 WeakPolarHBondContact CG1-O 3.38Å; V1226-N1567 HydrophobicContact CG2-CB 3.33Å; V1226-N1567 WeakPolarHBondContact CG2-O 3.39Å; V1226-N1567 WeakPolarHBondContact CG2-OD1 3.36Å; N1491-N1567 WeakPolarHBondContact CA-ND2 3.39Å; N1491-N1567 PolarHBondContact N-ND2 2.78Å; N1491-N1567 VanDerWaalsContact N-ND2 3.1Å; N1491-N1567 PolarHBondContact O-N 2.8Å; T1498-N1567 VanDerWaalsContact CB-C 3.44Å; T1498-N1567 VanDerWaalsContact CB-O 3.27Å; T1498-N1567 WeakPolarHBondContact CB-O 3.39Å; T1498-N1567 HydrophobicContact CG2-CB 3.8Å; T1498-N1567 WeakPolarHBondContact CG2-O 3.28Å; T1498-N1567 WeakPolarHBondContact OG1-CA 3.12Å; T1498-N1567 WeakPolarHBondContact OG1-CB 3.25Å; T1498-N1567 PolarHBondContact OG1-O 3.22Å; K1499-N1567 WeakPolarHBondContact CD-O 3.31Å; K1499-N1567 PolarHBondContact NZ-O 2.76Å; K1499-N1567 VanDerWaalsContact NZ-O 3.14Å; L1564-N1567 VanDerWaalsContact CD1-C 3.45Å; L1564-N1567 WeakPolarHBondContact CD1-O 3.37Å; V1565-N1567 VanDerWaalsContact C-N 3.25Å; V1565-N1567 CarbonylContact O-C 3.52Å; V1565-N1567 PolarHBondContact O-N 3.11Å
1568	V	61.7	Low	78.6	Confident	69 Å²	69	60.7 Å²	60.7	42%	0.418	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	139.8	170.6	-179.8	0	0	0	0	109.4	I1493 K1499 T1500 L1564 V1565 N1566 V1570	I1493-V1568 HydrophobicContact CB-CG2 4.2Å; I1493-V1568 HydrophobicContact CG2-CG2 4.22Å; K1499-V1568 HydrophobicContact CB-CG1 4.39Å; K1499-V1568 HydrophobicContact CD-CG2 4.15Å; K1499-V1568 CarbonylContact O-C 3.48Å; K1499-V1568 WeakPolarHBondContact O-CA 3.3Å; T1500-V1568 WeakPolarHBondContact OG1-CG1 3.25Å; L1564-V1568 CarbonylContact C-O 3.46Å; L1564-V1568 WeakPolarHBondContact CA-O 3.4Å; V1565-V1568 PolarHBondContact N-O 3.13Å; V1565-V1568 WeakPolarHBondContact O-CA 3.4Å; V1565-V1568 WeakPolarHBondContact O-CB 3.39Å; V1565-V1568 PolarHBondContact O-N 3.14Å; V1565-V1568 VanDerWaalsContact O-O 3.06Å; N1566-V1568 PolarHBondContact O-N 2.93Å; N1566-V1568 VanDerWaalsContact O-N 3.14Å; V1568-V1570 HydrophobicContact CB-CG2 4.43Å; V1568-V1570 HydrophobicContact CG1-CG2 4.42Å; V1568-V1570 PolarHBondContact O-N 3.1Å
1569	W	77.6	Confident	78.1	Confident	47.2 Å²	47.2	58.4 Å²	58.4	18%	0.179	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	116.7	172.4	-72.5	105.2	0	0	0	110.7	E1228 T1498 K1499 I1539 A1547 R1549 E1562 L1564	E1228-W1569 PolarHBondContact OE1-NE1 3.21Å; E1228-W1569 PolarHBondContact OE2-NE1 3.29Å; E1228-W1569 VanDerWaalsContact OE2-NE1 3.1Å; T1498-W1569 VanDerWaalsContact O-CD1 3.32Å; K1499-W1569 PolarHBondContact O-N 3.15Å; I1539-W1569 HydrophobicContact CG2-CH2 4.11Å; I1539-W1569 HydrophobicContact CG2-CZ2 4.34Å; A1547-W1569 HydrophobicContact CB-CH2 3.66Å; A1547-W1569 HydrophobicContact CB-CZ2 4.28Å; A1547-W1569 HydrophobicContact CB-CZ3 4.36Å; A1547-W1569 WeakPolarHBondContact O-CZ3 3.23Å; R1549-W1569 HydrophobicContact CB-CE3 4.39Å; R1549-W1569 HydrophobicContact CB-CH2 3.79Å; R1549-W1569 HydrophobicContact CB-CZ2 4.39Å; R1549-W1569 HydrophobicContact CB-CZ3 3.78Å; R1549-W1569 HydrophobicContact CG-CD2 4.15Å; R1549-W1569 HydrophobicContact CG-CE3 3.66Å; R1549-W1569 HydrophobicContact CG-CH2 3.87Å; R1549-W1569 HydrophobicContact CG-CZ2 4.34Å; R1549-W1569 HydrophobicContact CG-CZ3 3.52Å; R1549-W1569 VanDerWaalsContact CG-CZ3 3.49Å; R1549-W1569 VanDerWaalsContact CZ-CD1 3.49Å; R1549-W1569 VanDerWaalsContact N-CZ3 3.33Å; E1562-W1569 HydrophobicContact CB-CB 4.47Å; E1562-W1569 HydrophobicContact CB-CE3 4.05Å; E1562-W1569 WeakPolarHBondContact O-CZ3 3.37Å; E1562-W1569 WeakPolarHBondContact OE2-CB 3.46Å; L1564-W1569 HydrophobicContact CB-CD2 4.32Å; L1564-W1569 HydrophobicContact CB-CE3 4.07Å; L1564-W1569 HydrophobicContact CB-CH2 4.1Å; L1564-W1569 HydrophobicContact CB-CZ2 4.33Å; L1564-W1569 HydrophobicContact CB-CZ3 3.92Å; L1564-W1569 HydrophobicContact CD1-CD2 3.9Å; L1564-W1569 HydrophobicContact CD1-CE3 4.39Å; L1564-W1569 HydrophobicContact CD1-CG 4.13Å; L1564-W1569 HydrophobicContact CD1-CH2 4.42Å; L1564-W1569 HydrophobicContact CD1-CZ2 4.18Å; L1564-W1569 VanDerWaalsContact N-CE3 3.26Å; L1564-W1569 VanDerWaalsContact N-CZ3 3.3Å
1570	V	77.7	Confident	77.2	Confident	73.8 Å²	73.8	59.4 Å²	59.4	45%	0.447	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	126.1	179.5	-177.4	0	0	0	0	109.2	E1562 T1563 V1565 V1568 Q1572	E1562-V1570 CarbonylContact C-O 3.54Å; E1562-V1570 VanDerWaalsContact CA-O 3.26Å; E1562-V1570 WeakPolarHBondContact CA-O 3.26Å; T1563-V1570 PolarHBondContact N-O 3.07Å; T1563-V1570 PolarHBondContact O-N 3.09Å; V1565-V1570 HydrophobicContact CB-CB 4.4Å; V1565-V1570 HydrophobicContact CB-CG2 4.13Å; V1565-V1570 HydrophobicContact CG2-CB 4.33Å; V1565-V1570 HydrophobicContact CG2-CG2 4.22Å; V1568-V1570 HydrophobicContact CB-CG2 4.43Å; V1568-V1570 HydrophobicContact CG1-CG2 4.42Å; V1568-V1570 PolarHBondContact O-N 3.1Å; V1570-Q1572 PolarHBondContact O-N 3Å
1571	Q	80.6	Confident	76.2	Confident	97.4 Å²	97.4	61.1 Å²	61.1	46%	0.455	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	131.2	179.3	-167.1	-174.5	-62.3	0	0	111.6	T1560 P1561 E1562 K1573 S1575	T1560-Q1571 HydrophobicContact CG2-CG 3.78Å; T1560-Q1571 VanDerWaalsContact CG2-OE1 3.32Å; P1561-Q1571 WeakPolarHBondContact O-CG 3.42Å; E1562-Q1571 HydrophobicContact CG-CB 4.3Å; E1562-Q1571 HydrophobicContact CG-CG 4.39Å; Q1571-K1573 PolarHBondContact NE2-O 2.92Å; Q1571-S1575 PolarHBondContact NE2-OG 3.13Å; Q1571-S1575 PolarHBondContact OE1-OG 3.07Å
1572	Q	70.8	Confident	75.2	Confident	37.4 Å²	37.4	61.8 Å²	61.8	18%	0.175	32%	0.321	C	S	.	.			trans	-87.2	120.1	175.1	-70	-165.2	-42.9	0	0	111	W1548 P1561 T1563 V1570 I1574 Y1612 T1613	W1548-Q1572 VanDerWaalsContact CD1-OE1 3.3Å; P1561-Q1572 HydrophobicContact CB-CB 4.48Å; P1561-Q1572 HydrophobicContact CG-CB 4.25Å; P1561-Q1572 PolarHBondContact O-N 3.12Å; T1563-Q1572 WeakPolarHBondContact OG1-CG 3.36Å; T1563-Q1572 PolarHBondContact OG1-NE2 3.02Å; T1563-Q1572 VanDerWaalsContact OG1-NE2 3.11Å; V1570-Q1572 PolarHBondContact O-N 3Å; Q1572-I1574 PolarHBondContact O-N 3.02Å; Q1572-Y1612 HydrophobicContact CB-CD1 4.12Å; Q1572-Y1612 VanDerWaalsContact O-CE1 3.26Å; Q1572-Y1612 WeakPolarHBondContact O-CE1 3.32Å; Q1572-T1613 PolarHBondContact NE2-O 2.91Å; Q1572-T1613 VanDerWaalsContact NE2-O 3.15Å; Q1572-T1613 PolarHBondContact OE1-O 2.91Å
1573	K	66.1	Low	74	Confident	168 Å²	168	63.8 Å²	63.8	73%	0.73	33%	0.332	S	S	*	.	S	Bend	trans	37.2	-149.8	-178.4	-69.4	-177.8	175.6	177.2	0	112.5	Q1571 Y1612	Q1571-K1573 PolarHBondContact NE2-O 2.92Å; K1573-Y1612 HydrophobicContact CB-CD1 4.48Å; K1573-Y1612 HydrophobicContact CB-CE1 4.06Å
1574	I	72.3	Confident	72.7	Confident	133 Å²	133	69.9 Å²	69.9	68%	0.682	36%	0.364	S	S	*	.	P	Polyproline II helix	trans	-85.1	125	-177.6	-54.8	173.5	0	0	0	109.1	P1561 Q1572 F1576 P1610 Y1612	P1561-I1574 WeakPolarHBondContact CG-O 3.45Å; Q1572-I1574 PolarHBondContact O-N 3.02Å; I1574-F1576 PolarHBondContact O-N 3.25Å; I1574-P1610 HydrophobicContact CG2-CG 4.07Å; I1574-Y1612 HydrophobicContact CB-CE1 4.37Å; I1574-Y1612 WeakPolarHBondContact O-CE1 3.38Å; I1574-Y1612 PolarHBondContact O-OH 3.28Å
1575	S	83.2	Confident	71.9	Confident	13.2 Å²	13.2	74.2 Å²	74.2	9%	0.092	38%	0.382	C	S	.	.	P	Polyproline II helix	trans	-71.9	135.7	168.6	13.7	0	0	0	0	110.1	R1558 W1559 T1560 Q1571	R1558-S1575 VanDerWaalsContact CZ-OG 3.23Å; R1558-S1575 PolarHBondContact NE-OG 3.2Å; R1558-S1575 VanDerWaalsContact NE-OG 3.14Å; R1558-S1575 PolarHBondContact NH2-OG 2.96Å; W1559-S1575 CarbonylContact O-C 3.37Å; W1559-S1575 VanDerWaalsContact O-CA 3.29Å; W1559-S1575 WeakPolarHBondContact O-CA 3.45Å; W1559-S1575 VanDerWaalsContact O-CB 3.24Å; W1559-S1575 WeakPolarHBondContact O-CB 3.31Å; T1560-S1575 WeakPolarHBondContact OG1-CB 3.42Å; Q1571-S1575 PolarHBondContact NE2-OG 3.13Å; Q1571-S1575 PolarHBondContact OE1-OG 3.07Å
1576	F	88.4	Confident	72.3	Confident	22.6 Å²	22.6	77.6 Å²	77.6	10%	0.099	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	157.3	-173.3	64.7	-81.7	0	0	0	111.8	I1550 R1558 W1559 I1574 L1601 I1608 S1609 Y1612	I1550-F1576 HydrophobicContact CD1-CE1 4.27Å; R1558-F1576 WeakPolarHBondContact CA-O 3.45Å; W1559-F1576 HydrophobicContact CB-CD1 3.91Å; W1559-F1576 HydrophobicContact CB-CD2 4.01Å; W1559-F1576 HydrophobicContact CB-CE1 3.48Å; W1559-F1576 VanDerWaalsContact CB-CE1 3.45Å; W1559-F1576 HydrophobicContact CB-CE2 3.57Å; W1559-F1576 HydrophobicContact CB-CG 4.17Å; W1559-F1576 HydrophobicContact CB-CZ 3.28Å; W1559-F1576 AromaticContact CD1-CE2 3.9Å; W1559-F1576 HydrophobicContact CD2-CE2 4.2Å; W1559-F1576 AromaticContact CD2-CZ 3.9Å; W1559-F1576 HydrophobicContact CD2-CZ 3.98Å; W1559-F1576 AromaticContact CE3-CZ 3.92Å; W1559-F1576 HydrophobicContact CE3-CZ 4.06Å; W1559-F1576 HydrophobicContact CG-CD2 4.41Å; W1559-F1576 HydrophobicContact CG-CE1 4.35Å; W1559-F1576 AromaticContact CG-CE2 3.7Å; W1559-F1576 HydrophobicContact CG-CE2 3.7Å; W1559-F1576 AromaticContact CG-CZ 3.67Å; W1559-F1576 HydrophobicContact CG-CZ 3.67Å; W1559-F1576 PolarHBondContact N-O 3.01Å; W1559-F1576 PolarHBondContact O-N 3.12Å; W1559-F1576 VanDerWaalsContact O-N 3.1Å; I1574-F1576 PolarHBondContact O-N 3.25Å; F1576-L1601 HydrophobicContact CZ-CD1 4.39Å; F1576-I1608 WeakPolarHBondContact CD2-O 3.37Å; F1576-I1608 HydrophobicContact CE2-CB 4.17Å; F1576-I1608 HydrophobicContact CE2-CD1 4.05Å; F1576-I1608 HydrophobicContact CE2-CG1 4.14Å; F1576-I1608 WeakPolarHBondContact CE2-O 3.42Å; F1576-I1608 HydrophobicContact CZ-CD1 4.24Å; F1576-I1608 HydrophobicContact CZ-CG1 4.4Å; F1576-S1609 VanDerWaalsContact CE1-CB 3.49Å; F1576-Y1612 HydrophobicContact CD1-CE2 4.36Å; F1576-Y1612 WeakPolarHBondContact CD1-OH 3.42Å; F1576-Y1612 HydrophobicContact CE1-CE2 4.17Å
1577	K	85.2	Confident	73.5	Confident	149.2 Å²	149.2	73.5 Å²	73.5	65%	0.649	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96	133.7	167.6	-152.9	179.6	-179.4	-179.5	0	108.8	T1556 Q1557 R1558	T1556-K1577 WeakPolarHBondContact O-CE 3.46Å; Q1557-K1577 HydrophobicContact CB-CG 4.24Å; Q1557-K1577 VanDerWaalsContact O-CA 3.32Å; Q1557-K1577 WeakPolarHBondContact O-CA 3.39Å; Q1557-K1577 WeakPolarHBondContact O-CG 3.39Å; R1558-K1577 HydrophobicContact CB-CG 4.4Å; R1558-K1577 HydrophobicContact CG-CG 4.48Å
1578	S	81.6	Confident	74.5	Confident	8.2 Å²	8.2	70.4 Å²	70.4	6%	0.057	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-77.2	131.4	175.4	175.5	0	0	0	0	110.3	Q1557 W1559 L1580 I1608	Q1557-S1578 PolarHBondContact O-N 3.05Å; W1559-S1578 PolarHBondContact NE1-O 3.24Å; S1578-L1580 WeakPolarHBondContact CB-O 3.38Å; S1578-L1580 PolarHBondContact O-N 2.97Å; S1578-L1580 PolarHBondContact OG-N 2.97Å; S1578-L1580 VanDerWaalsContact OG-N 3.07Å; S1578-L1580 PolarHBondContact OG-O 3.07Å; S1578-I1608 VanDerWaalsContact OG-CG2 3.32Å; S1578-I1608 WeakPolarHBondContact OG-CG2 3.3Å
1579	P	76.6	Confident	75.5	Confident	78.8 Å²	78.8	69.4 Å²	69.4	51%	0.512	35%	0.347	S	S	.	.	S	Bend	trans	-72.2	9.7	170.1	31.7	-35.5	0	0	0	112.2	P1581 I1608	P1579-P1581 VanDerWaalsContact O-CD 3.24Å; P1579-P1581 WeakPolarHBondContact O-CD 3.39Å; P1579-I1608 HydrophobicContact CG-CG2 4.25Å
1580	L	72.6	Confident	76.1	Confident	20.8 Å²	20.8	67.3 Å²	67.3	11%	0.109	34%	0.339	C	S	.	.	S	Bend	trans	-113	121.7	174.4	-84.2	166.7	0	0	0	110.4	M1554 W1559 S1578 L1582 F1588 V1603 R1606 I1608	M1554-L1580 HydrophobicContact CE-CB 4.03Å; M1554-L1580 HydrophobicContact CE-CD2 3.51Å; M1554-L1580 HydrophobicContact CE-CG 4.41Å; M1554-L1580 HydrophobicContact SD-CD2 3.94Å; W1559-L1580 HydrophobicContact CH2-CD1 3.53Å; W1559-L1580 HydrophobicContact CZ2-CD1 3.32Å; S1578-L1580 WeakPolarHBondContact CB-O 3.38Å; S1578-L1580 PolarHBondContact O-N 2.97Å; S1578-L1580 PolarHBondContact OG-N 2.97Å; S1578-L1580 VanDerWaalsContact OG-N 3.07Å; S1578-L1580 PolarHBondContact OG-O 3.07Å; L1580-L1582 HydrophobicContact CD2-CD2 3.78Å; L1580-L1582 HydrophobicContact CD2-CG 4.5Å; L1580-L1582 HydrophobicContact CG-CD2 4.39Å; L1580-L1582 PolarHBondContact O-N 2.93Å; L1580-F1588 HydrophobicContact CD1-CD1 4.45Å; L1580-F1588 HydrophobicContact CD1-CD2 3.87Å; L1580-F1588 HydrophobicContact CD1-CE1 4.33Å; L1580-F1588 HydrophobicContact CD1-CE2 3.71Å; L1580-F1588 HydrophobicContact CD1-CG 4.22Å; L1580-F1588 HydrophobicContact CD1-CZ 3.95Å; L1580-F1588 HydrophobicContact CD2-CD1 3.77Å; L1580-F1588 HydrophobicContact CD2-CE1 3.62Å; L1580-F1588 HydrophobicContact CD2-CE2 4.46Å; L1580-F1588 HydrophobicContact CD2-CG 4.28Å; L1580-F1588 HydrophobicContact CD2-CZ 3.98Å; L1580-F1588 HydrophobicContact CG-CD1 4.27Å; L1580-F1588 HydrophobicContact CG-CD2 4.42Å; L1580-F1588 HydrophobicContact CG-CE1 4.39Å; L1580-F1588 HydrophobicContact CG-CG 4.28Å; L1580-F1588 HydrophobicContact CG-CZ 4.5Å; L1580-V1603 HydrophobicContact CD1-CB 4.26Å; L1580-V1603 HydrophobicContact CD1-CG1 4.13Å; L1580-V1603 HydrophobicContact CD1-CG2 4.33Å; L1580-V1603 WeakPolarHBondContact CD1-O 3.37Å; L1580-R1606 HydrophobicContact CD1-CB 4.14Å; L1580-I1608 HydrophobicContact CD1-CG2 4.29Å; L1580-I1608 HydrophobicContact CG-CG2 4.28Å
1581	P	69.4	Low	76.7	Confident	59 Å²	59	66.1 Å²	66.1	38%	0.383	33%	0.329	S	S	.	.			trans	-67.7	126.6	166.8	28.9	-33	0	0	0	109.7	P1579 D1584 V1603 N1604	P1579-P1581 VanDerWaalsContact O-CD 3.24Å; P1579-P1581 WeakPolarHBondContact O-CD 3.39Å; P1581-D1584 WeakPolarHBondContact CB-OD2 3.43Å; P1581-D1584 WeakPolarHBondContact CG-OD2 3.48Å; P1581-V1603 HydrophobicContact CG-CG1 4.01Å; P1581-N1604 HydrophobicContact CG-CB 4.42Å; P1581-N1604 PolarHBondContact O-ND2 2.86Å
1582	L	71.1	Confident	77.2	Confident	16 Å²	16	61.5 Å²	61.5	8%	0.084	31%	0.308	C	S	.	.			trans	-103.5	-8	175.5	-68.1	175.9	0	0	0	111.8	M1529 P1533 M1554 W1559 L1580 D1584 K1585 F1588 V1603	M1529-L1582 HydrophobicContact CB-CD1 4.33Å; M1529-L1582 HydrophobicContact CB-CD2 4.46Å; M1529-L1582 HydrophobicContact CG-CD1 4.35Å; M1529-L1582 HydrophobicContact CG-CD2 3.78Å; P1533-L1582 HydrophobicContact CG-CD1 4.48Å; M1554-L1582 HydrophobicContact CE-CB 3.74Å; M1554-L1582 HydrophobicContact CE-CD1 4.04Å; M1554-L1582 HydrophobicContact SD-CD1 4.34Å; W1559-L1582 HydrophobicContact CH2-CD1 4.38Å; W1559-L1582 HydrophobicContact CZ2-CD1 3.64Å; L1580-L1582 HydrophobicContact CD2-CD2 3.78Å; L1580-L1582 HydrophobicContact CD2-CG 4.5Å; L1580-L1582 HydrophobicContact CG-CD2 4.39Å; L1580-L1582 PolarHBondContact O-N 2.93Å; L1582-D1584 VanDerWaalsContact C-N 3.29Å; L1582-D1584 PolarHBondContact O-N 3.04Å; L1582-K1585 CarbonylContact O-C 3.56Å; L1582-K1585 WeakPolarHBondContact O-CA 3.47Å; L1582-K1585 PolarHBondContact O-N 2.89Å; L1582-F1588 HydrophobicContact CD1-CD1 3.95Å; L1582-F1588 HydrophobicContact CD1-CD2 4.39Å; L1582-F1588 HydrophobicContact CD1-CE1 3.71Å; L1582-F1588 HydrophobicContact CD1-CE2 4.16Å; L1582-F1588 HydrophobicContact CD1-CG 4.3Å; L1582-F1588 HydrophobicContact CD1-CZ 3.82Å; L1582-F1588 HydrophobicContact CD2-CB 4.01Å; L1582-F1588 HydrophobicContact CD2-CD1 3.9Å; L1582-F1588 HydrophobicContact CD2-CD2 4.39Å; L1582-F1588 HydrophobicContact CD2-CE1 4.42Å; L1582-F1588 HydrophobicContact CD2-CG 4.16Å; L1582-F1588 HydrophobicContact CG-CD1 4.45Å; L1582-V1603 HydrophobicContact CD2-CG1 3.81Å
1583	N	64.4	Low	78.2	Confident	65 Å²	65	64.5 Å²	64.5	35%	0.348	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-49.1	-177.3	-39.8	32.3	0	0	0	111.3	M1554 Q1557 K1585 R1586 A1587	M1554-N1583 PolarHBondContact O-ND2 2.83Å; M1554-N1583 PolarHBondContact O-OD1 3.14Å; M1554-N1583 VanDerWaalsContact O-OD1 3.11Å; Q1557-N1583 WeakPolarHBondContact CG-OD1 3.49Å; Q1557-N1583 VanDerWaalsContact NE2-CG 3.34Å; Q1557-N1583 PolarHBondContact NE2-OD1 3.28Å; N1583-K1585 VanDerWaalsContact C-N 3.26Å; N1583-K1585 PolarHBondContact O-N 3.01Å; N1583-K1585 WeakPolarHBondContact OD1-CA 3.35Å; N1583-K1585 WeakPolarHBondContact OD1-CB 3.4Å; N1583-K1585 PolarHBondContact OD1-N 2.75Å; N1583-R1586 WeakPolarHBondContact O-CA 3.48Å; N1583-R1586 PolarHBondContact O-N 3Å; N1583-R1586 PolarHBondContact OD1-N 2.97Å; N1583-A1587 VanDerWaalsContact CG-O 3.24Å; N1583-A1587 PolarHBondContact N-O 3.28Å; N1583-A1587 WeakPolarHBondContact OD1-CA 3.16Å; N1583-A1587 PolarHBondContact OD1-N 2.96Å; N1583-A1587 PolarHBondContact OD1-O 2.88Å
1584	D	59	Low	79.3	Confident	140.4 Å²	140.4	56.9 Å²	56.9	75%	0.751	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-7.4	179.5	-34.4	-44	0	0	0	113.3	P1581 L1582 R1586	P1581-D1584 WeakPolarHBondContact CB-OD2 3.43Å; P1581-D1584 WeakPolarHBondContact CG-OD2 3.48Å; L1582-D1584 VanDerWaalsContact C-N 3.29Å; L1582-D1584 PolarHBondContact O-N 3.04Å; D1584-R1586 VanDerWaalsContact C-N 3.3Å
1585	K	63.9	Low	79.9	Confident	107.2 Å²	107.2	53.9 Å²	53.9	47%	0.466	28%	0.276	S	S	.	.			trans	-115.4	85.6	-172.6	-67.4	-173.5	179	178.4	0	112.2	Q1528 L1582 N1583 A1587	Q1528-K1585 WeakPolarHBondContact CG-O 3.42Å; Q1528-K1585 PolarHBondContact NE2-O 2.95Å; L1582-K1585 CarbonylContact O-C 3.56Å; L1582-K1585 WeakPolarHBondContact O-CA 3.47Å; L1582-K1585 PolarHBondContact O-N 2.89Å; N1583-K1585 VanDerWaalsContact C-N 3.26Å; N1583-K1585 PolarHBondContact O-N 3.01Å; N1583-K1585 WeakPolarHBondContact OD1-CA 3.35Å; N1583-K1585 WeakPolarHBondContact OD1-CB 3.4Å; N1583-K1585 PolarHBondContact OD1-N 2.75Å; K1585-A1587 PolarHBondContact O-N 2.94Å
1586	R	75.9	Confident	80	Confident	134.8 Å²	134.8	60.5 Å²	60.5	51%	0.509	31%	0.311	S	S	.	.	S	Bend	trans	-38.9	-10.2	173	-86.7	-174.8	-166.5	-149.6	0.3	114.1	S1267 Q1528 M1529 N1583 D1584 E1629 I1757	S1267-R1586 PolarHBondContact OG-NH2 3.49Å; Q1528-R1586 CarbonylContact C-O 3.5Å; Q1528-R1586 VanDerWaalsContact CA-O 3.23Å; Q1528-R1586 WeakPolarHBondContact CA-O 3.41Å; Q1528-R1586 WeakPolarHBondContact CG-O 3.4Å; M1529-R1586 HydrophobicContact CB-CB 4.47Å; M1529-R1586 PolarHBondContact N-O 3.09Å; M1529-R1586 WeakPolarHBondContact O-CB 3.12Å; M1529-R1586 PolarHBondContact O-NE 3.46Å; N1583-R1586 WeakPolarHBondContact O-CA 3.48Å; N1583-R1586 PolarHBondContact O-N 3Å; N1583-R1586 PolarHBondContact OD1-N 2.97Å; D1584-R1586 VanDerWaalsContact C-N 3.3Å; R1586-E1629 IonicContact CZ-OE2 3.3Å; R1586-E1629 IonicContact NE-OE2 3.15Å; R1586-E1629 PolarHBondContact NE-OE2 2.76Å; R1586-E1629 IonicContact NH2-OE1 2.68Å; R1586-E1629 PolarHBondContact NH2-OE1 3.07Å; R1586-E1629 IonicContact NH2-OE2 3.11Å; R1586-E1629 PolarHBondContact NH2-OE2 3Å; R1586-I1757 HydrophobicContact CB-CG2 4.42Å
1587	A	81.8	Confident	79.9	Confident	33.8 Å²	33.8	65 Å²	65	28%	0.279	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	150.1	174.9	0	0	0	0	0	113.3	V1527 Q1528 N1583 K1585 I1757	V1527-A1587 CarbonylContact O-C 3.51Å; V1527-A1587 VanDerWaalsContact O-CA 3.22Å; V1527-A1587 WeakPolarHBondContact O-CA 3.43Å; V1527-A1587 WeakPolarHBondContact O-CB 3.4Å; Q1528-A1587 HydrophobicContact CB-CB 4.27Å; Q1528-A1587 HydrophobicContact CG-CB 4.24Å; N1583-A1587 VanDerWaalsContact CG-O 3.24Å; N1583-A1587 PolarHBondContact N-O 3.28Å; N1583-A1587 WeakPolarHBondContact OD1-CA 3.16Å; N1583-A1587 PolarHBondContact OD1-N 2.96Å; N1583-A1587 PolarHBondContact OD1-O 2.88Å; K1585-A1587 PolarHBondContact O-N 2.94Å; A1587-I1757 HydrophobicContact CB-CB 3.63Å; A1587-I1757 HydrophobicContact CB-CG2 3.68Å
1588	F	84.1	Confident	80.1	Confident	2.6 Å²	2.6	61.1 Å²	61.1	1%	0.011	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	153	172.4	63.2	-87.2	0	0	0	112.1	V1527 M1529 F1536 L1580 L1582 L1590 V1603 N1604	V1527-F1588 HydrophobicContact CB-CD1 4.34Å; V1527-F1588 HydrophobicContact CB-CD2 4.37Å; V1527-F1588 HydrophobicContact CB-CE1 3.97Å; V1527-F1588 HydrophobicContact CB-CE2 4.1Å; V1527-F1588 HydrophobicContact CB-CZ 3.83Å; V1527-F1588 HydrophobicContact CG1-CE1 3.97Å; V1527-F1588 HydrophobicContact CG1-CE2 4.46Å; V1527-F1588 HydrophobicContact CG1-CZ 3.94Å; V1527-F1588 HydrophobicContact CG2-CE1 4.43Å; V1527-F1588 HydrophobicContact CG2-CE2 4.15Å; V1527-F1588 HydrophobicContact CG2-CZ 4.18Å; V1527-F1588 PolarHBondContact N-O 3Å; V1527-F1588 WeakPolarHBondContact O-CD1 3.26Å; V1527-F1588 PolarHBondContact O-N 3.14Å; M1529-F1588 HydrophobicContact CG-CD1 4.36Å; M1529-F1588 HydrophobicContact CG-CE1 3.85Å; M1529-F1588 HydrophobicContact SD-CE1 3.78Å; M1529-F1588 HydrophobicContact SD-CZ 4.38Å; F1536-F1588 HydrophobicContact CD1-CZ 4.44Å; F1536-F1588 AromaticContact CD2-CZ 3.97Å; F1536-F1588 HydrophobicContact CD2-CZ 4.09Å; F1536-F1588 HydrophobicContact CE1-CZ 4.36Å; F1536-F1588 HydrophobicContact CE2-CE2 4.49Å; F1536-F1588 AromaticContact CE2-CZ 3.92Å; F1536-F1588 HydrophobicContact CE2-CZ 3.96Å; F1536-F1588 HydrophobicContact CG-CZ 4.34Å; F1536-F1588 HydrophobicContact CZ-CE2 4.38Å; F1536-F1588 AromaticContact CZ-CZ 3.94Å; F1536-F1588 HydrophobicContact CZ-CZ 4.11Å; L1580-F1588 HydrophobicContact CD1-CD1 4.45Å; L1580-F1588 HydrophobicContact CD1-CD2 3.87Å; L1580-F1588 HydrophobicContact CD1-CE1 4.33Å; L1580-F1588 HydrophobicContact CD1-CE2 3.71Å; L1580-F1588 HydrophobicContact CD1-CG 4.22Å; L1580-F1588 HydrophobicContact CD1-CZ 3.95Å; L1580-F1588 HydrophobicContact CD2-CD1 3.77Å; L1580-F1588 HydrophobicContact CD2-CE1 3.62Å; L1580-F1588 HydrophobicContact CD2-CE2 4.46Å; L1580-F1588 HydrophobicContact CD2-CG 4.28Å; L1580-F1588 HydrophobicContact CD2-CZ 3.98Å; L1580-F1588 HydrophobicContact CG-CD1 4.27Å; L1580-F1588 HydrophobicContact CG-CD2 4.42Å; L1580-F1588 HydrophobicContact CG-CE1 4.39Å; L1580-F1588 HydrophobicContact CG-CG 4.28Å; L1580-F1588 HydrophobicContact CG-CZ 4.5Å; L1582-F1588 HydrophobicContact CD1-CD1 3.95Å; L1582-F1588 HydrophobicContact CD1-CD2 4.39Å; L1582-F1588 HydrophobicContact CD1-CE1 3.71Å; L1582-F1588 HydrophobicContact CD1-CE2 4.16Å; L1582-F1588 HydrophobicContact CD1-CG 4.3Å; L1582-F1588 HydrophobicContact CD1-CZ 3.82Å; L1582-F1588 HydrophobicContact CD2-CB 4.01Å; L1582-F1588 HydrophobicContact CD2-CD1 3.9Å; L1582-F1588 HydrophobicContact CD2-CD2 4.39Å; L1582-F1588 HydrophobicContact CD2-CE1 4.42Å; L1582-F1588 HydrophobicContact CD2-CG 4.16Å; L1582-F1588 HydrophobicContact CG-CD1 4.45Å; F1588-L1590 HydrophobicContact CD2-CB 4.2Å; F1588-L1590 HydrophobicContact CE2-CB 4Å; F1588-V1603 HydrophobicContact CB-CG1 4.16Å; F1588-V1603 HydrophobicContact CD2-CG1 4.11Å; F1588-V1603 HydrophobicContact CD2-CG2 4.29Å; F1588-V1603 HydrophobicContact CG-CG1 4.3Å; F1588-N1604 WeakPolarHBondContact CA-OD1 3.41Å; F1588-N1604 WeakPolarHBondContact CB-ND2 3.27Å
1589	N	84.1	Confident	80.6	Confident	49.6 Å²	49.6	60.8 Å²	60.8	27%	0.265	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	120.7	168	-70	-42.8	0	0	0	109.3	A1525 T1526 V1603 N1604 D1674 N1760	A1525-N1589 CarbonylContact O-C 3.57Å; A1525-N1589 WeakPolarHBondContact O-CA 3.4Å; T1526-N1589 VanDerWaalsContact CB-OD1 3.32Å; T1526-N1589 WeakPolarHBondContact CB-OD1 3.35Å; T1526-N1589 VanDerWaalsContact CG2-OD1 3.31Å; T1526-N1589 WeakPolarHBondContact CG2-OD1 3.38Å; T1526-N1589 PolarHBondContact OG1-OD1 2.88Å; N1589-V1603 CarbonylContact O-C 3.57Å; N1589-V1603 VanDerWaalsContact O-CA 3.3Å; N1589-V1603 WeakPolarHBondContact O-CA 3.3Å; N1589-N1604 PolarHBondContact N-OD1 3.04Å; N1589-N1604 PolarHBondContact O-N 3.03Å; N1589-D1674 PolarHBondContact ND2-OD1 2.87Å; N1589-N1760 PolarHBondContact ND2-O 3.35Å
1590	L	89.3	Confident	81.3	Confident	1.6 Å²	1.6	58.4 Å²	58.4	1%	0.008	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	126.8	171.1	177.8	65.6	0	0	0	109.1	H1524 A1525 F1536 M1538 W1559 F1588 L1601 W1602 V1603	H1524-L1590 CarbonylContact C-O 3.52Å; A1525-L1590 HydrophobicContact CB-CB 4.43Å; A1525-L1590 PolarHBondContact N-O 3.22Å; A1525-L1590 PolarHBondContact O-N 2.88Å; F1536-L1590 HydrophobicContact CE1-CD2 4.12Å; F1536-L1590 HydrophobicContact CZ-CD2 3.88Å; M1538-L1590 HydrophobicContact CE-CD2 4.02Å; M1538-L1590 HydrophobicContact SD-CD2 4.06Å; W1559-L1590 HydrophobicContact CH2-CD1 4.31Å; W1559-L1590 HydrophobicContact CZ3-CD1 4.29Å; F1588-L1590 HydrophobicContact CD2-CB 4.2Å; F1588-L1590 HydrophobicContact CE2-CB 4Å; L1590-L1601 HydrophobicContact CD1-CB 4.33Å; L1590-L1601 HydrophobicContact CD1-CD2 4.39Å; L1590-W1602 CarbonylContact C-O 3.58Å; L1590-W1602 WeakPolarHBondContact CA-O 3.42Å; L1590-V1603 HydrophobicContact CD1-CG2 3.64Å
1591	L	90.5	Very high	82.2	Confident	48.6 Å²	48.6	57.4 Å²	57.4	25%	0.254	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	115.7	177.4	-174.4	76.2	0	0	0	108.7	L1522 I1523 H1524 L1601 W1602 Y1680	L1522-L1591 HydrophobicContact CD1-CD1 3.74Å; L1522-L1591 HydrophobicContact CD1-CD2 4.46Å; L1522-L1591 HydrophobicContact CD1-CG 4.13Å; L1522-L1591 HydrophobicContact CD2-CD1 3.94Å; L1522-L1591 HydrophobicContact CG-CD1 3.83Å; I1523-L1591 CarbonylContact O-C 3.54Å; I1523-L1591 WeakPolarHBondContact O-CA 3.33Å; H1524-L1591 HydrophobicContact CB-CD1 3.74Å; L1591-L1601 CarbonylContact O-C 3.48Å; L1591-L1601 WeakPolarHBondContact O-CA 3.45Å; L1591-W1602 HydrophobicContact CB-CB 4.23Å; L1591-W1602 PolarHBondContact N-O 2.9Å; L1591-W1602 PolarHBondContact O-N 2.96Å; L1591-Y1680 HydrophobicContact CD2-CD1 4.44Å; L1591-Y1680 HydrophobicContact CD2-CE1 3.85Å
1592	A	91.8	Very high	83.2	Confident	1.2 Å²	1.2	58.3 Å²	58.3	1%	0.01	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	103.3	170.1	0	0	0	0	0	108.3	L1522 I1523 M1538 V1599 E1600 L1601	L1522-A1592 CarbonylContact C-O 3.58Å; L1522-A1592 WeakPolarHBondContact CA-O 3.28Å; I1523-A1592 HydrophobicContact CB-CB 4.04Å; I1523-A1592 HydrophobicContact CG1-CB 4.39Å; I1523-A1592 PolarHBondContact N-O 3Å; I1523-A1592 PolarHBondContact O-N 3.06Å; M1538-A1592 HydrophobicContact CE-CB 4.46Å; A1592-V1599 HydrophobicContact CB-CG2 3.75Å; A1592-E1600 CarbonylContact C-O 3.56Å; A1592-E1600 WeakPolarHBondContact CA-O 3.38Å; A1592-L1601 HydrophobicContact CB-CD2 3.69Å
1593	K	90.1	Very high	84	Confident	101.6 Å²	101.6	57.5 Å²	57.5	44%	0.442	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	130.6	173.1	-175.7	-179.2	176.7	-179.2	0	108.3	L1522 V1599 E1600 E1682	L1522-K1593 HydrophobicContact CD1-CB 4.38Å; K1593-V1599 CarbonylContact O-C 3.4Å; K1593-V1599 WeakPolarHBondContact O-CA 3.36Å; K1593-E1600 PolarHBondContact N-O 2.95Å; K1593-E1600 PolarHBondContact O-N 3.01Å; K1593-E1682 WeakPolarHBondContact CE-OE1 3.42Å; K1593-E1682 IonicContact NZ-OE1 2.78Å; K1593-E1682 PolarHBondContact NZ-OE1 3.25Å
1594	V	90.1	Very high	84.8	Confident	7.6 Å²	7.6	56.8 Å²	56.8	5%	0.046	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	130.5	-179.5	-174.9	0	0	0	0	109.8	L1520 R1521 E1598 V1599 L1614	L1520-V1594 HydrophobicContact CD2-CG2 3.95Å; L1520-V1594 HydrophobicContact CG-CB 4.43Å; L1520-V1594 HydrophobicContact CG-CG2 4.13Å; L1520-V1594 WeakPolarHBondContact O-CB 3.41Å; L1520-V1594 VanDerWaalsContact O-CG1 3.28Å; L1520-V1594 WeakPolarHBondContact O-CG1 3.32Å; R1521-V1594 WeakPolarHBondContact O-CA 3.39Å; R1521-V1594 WeakPolarHBondContact O-CB 3.15Å; R1521-V1594 PolarHBondContact O-N 3.07Å; V1594-E1598 CarbonylContact C-O 3.55Å; V1594-E1598 VanDerWaalsContact CA-O 3.28Å; V1594-E1598 WeakPolarHBondContact CA-O 3.32Å; V1594-V1599 HydrophobicContact CG2-CB 4.2Å; V1594-V1599 HydrophobicContact CG2-CG2 4.04Å; V1594-L1614 HydrophobicContact CG1-CD1 3.82Å; V1594-L1614 HydrophobicContact CG2-CD1 3.87Å
1595	T	85.3	Confident	85.6	Confident	70.2 Å²	70.2	56.9 Å²	56.9	43%	0.431	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	122.2	176.5	-56.3	0	0	0	0	107.2	R1597 E1598	T1595-R1597 VanDerWaalsContact C-N 3.28Å; T1595-R1597 PolarHBondContact O-N 2.9Å; T1595-R1597 VanDerWaalsContact O-N 3.16Å; T1595-E1598 PolarHBondContact N-O 3.06Å; T1595-E1598 WeakPolarHBondContact O-CA 3.34Å; T1595-E1598 WeakPolarHBondContact O-CB 3.35Å; T1595-E1598 PolarHBondContact O-N 3.1Å
1596	D	84.1	Confident	86.4	Confident	151.6 Å²	151.6	60 Å²	60	81%	0.811	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	43.6	179.5	-53.4	-34.7	0	0	0	114.4	E1598	D1596-E1598 PolarHBondContact O-N 2.95Å; D1596-E1598 VanDerWaalsContact O-N 3.15Å
1597	R	86.1	Confident	87	Confident	117.8 Å²	117.8	57.4 Å²	57.4	45%	0.445	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.8	-5.7	-171.3	-52.4	-174.6	-174.4	-173.4	1.6	115.8	T1595 V1599 T1613 L1614 P1615 G1616 T1617	T1595-R1597 VanDerWaalsContact C-N 3.28Å; T1595-R1597 PolarHBondContact O-N 2.9Å; T1595-R1597 VanDerWaalsContact O-N 3.16Å; R1597-V1599 PolarHBondContact O-N 3.21Å; R1597-T1613 HydrophobicContact CB-CG2 4.47Å; R1597-L1614 HydrophobicContact CB-CB 4.47Å; R1597-L1614 VanDerWaalsContact O-CB 3.31Å; R1597-L1614 WeakPolarHBondContact O-CB 3.24Å; R1597-L1614 WeakPolarHBondContact O-CG 3.41Å; R1597-L1614 PolarHBondContact O-N 3.24Å; R1597-P1615 PolarHBondContact NH1-O 2.87Å; R1597-G1616 WeakPolarHBondContact CD-O 3.43Å; R1597-G1616 PolarHBondContact NE-O 2.8Å; R1597-T1617 VanDerWaalsContact CZ-CG2 3.5Å; R1597-T1617 VanDerWaalsContact NE-CG2 3.3Å; R1597-T1617 PolarHBondContact NH2-OG1 2.97Å
1598	E	89.8	Confident	87.3	Confident	66 Å²	66	56.3 Å²	56.3	31%	0.308	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	126.7	169.5	-58.5	-165.4	109.5	0	0	110.5	V1594 T1595 D1596 K1611 Y1612	V1594-E1598 CarbonylContact C-O 3.55Å; V1594-E1598 VanDerWaalsContact CA-O 3.28Å; V1594-E1598 WeakPolarHBondContact CA-O 3.32Å; T1595-E1598 PolarHBondContact N-O 3.06Å; T1595-E1598 WeakPolarHBondContact O-CA 3.34Å; T1595-E1598 WeakPolarHBondContact O-CB 3.35Å; T1595-E1598 PolarHBondContact O-N 3.1Å; D1596-E1598 PolarHBondContact O-N 2.95Å; D1596-E1598 VanDerWaalsContact O-N 3.15Å; E1598-K1611 HydrophobicContact CB-CD 4.29Å; E1598-K1611 WeakPolarHBondContact OE1-CD 3.42Å; E1598-K1611 VanDerWaalsContact OE2-CD 3.22Å; E1598-K1611 WeakPolarHBondContact OE2-CD 3.26Å; E1598-K1611 VanDerWaalsContact OE2-CE 3.25Å; E1598-K1611 WeakPolarHBondContact OE2-CE 3.12Å; E1598-K1611 IonicContact OE2-NZ 3.13Å; E1598-K1611 PolarHBondContact OE2-NZ 3.02Å; E1598-Y1612 CarbonylContact C-O 3.52Å; E1598-Y1612 VanDerWaalsContact CA-O 3.31Å; E1598-Y1612 WeakPolarHBondContact CA-O 3.17Å
1599	V	91.5	Very high	87.5	Confident	2.4 Å²	2.4	56.4 Å²	56.4	2%	0.015	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	134.5	173.9	64.8	0	0	0	0	111.4	W1548 A1592 K1593 V1594 R1597 L1601 K1611 Y1612 L1614	W1548-V1599 HydrophobicContact CH2-CG1 4.06Å; W1548-V1599 HydrophobicContact CZ2-CG1 3.75Å; W1548-V1599 HydrophobicContact CZ3-CG1 4.49Å; A1592-V1599 HydrophobicContact CB-CG2 3.75Å; K1593-V1599 CarbonylContact O-C 3.4Å; K1593-V1599 WeakPolarHBondContact O-CA 3.36Å; V1594-V1599 HydrophobicContact CG2-CB 4.2Å; V1594-V1599 HydrophobicContact CG2-CG2 4.04Å; R1597-V1599 PolarHBondContact O-N 3.21Å; V1599-L1601 HydrophobicContact CG2-CD2 4.23Å; V1599-K1611 WeakPolarHBondContact O-CA 3.42Å; V1599-Y1612 WeakPolarHBondContact CG1-O 3.39Å; V1599-Y1612 PolarHBondContact N-O 3.18Å; V1599-Y1612 PolarHBondContact O-N 3.04Å; V1599-Y1612 VanDerWaalsContact O-N 3.11Å; V1599-L1614 HydrophobicContact CB-CD1 4.21Å; V1599-L1614 HydrophobicContact CB-CD2 4.12Å; V1599-L1614 HydrophobicContact CB-CG 4.02Å; V1599-L1614 HydrophobicContact CG1-CD2 3.71Å; V1599-L1614 HydrophobicContact CG1-CG 4Å
1600	E	91.8	Very high	87.6	Confident	29 Å²	29	56.8 Å²	56.8	14%	0.136	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	128.8	170.8	-75.1	-167.7	174.5	0	0	110.2	A1592 K1593 W1602 K1607 K1611	A1592-E1600 CarbonylContact C-O 3.56Å; A1592-E1600 WeakPolarHBondContact CA-O 3.38Å; K1593-E1600 PolarHBondContact N-O 2.95Å; K1593-E1600 PolarHBondContact O-N 3.01Å; E1600-W1602 PolarHBondContact OE2-NE1 3.44Å; E1600-K1607 IonicContact OE1-NZ 3.18Å; E1600-K1607 PolarHBondContact OE1-NZ 3.12Å; E1600-K1607 VanDerWaalsContact OE2-CE 3.24Å; E1600-K1607 WeakPolarHBondContact OE2-CE 3.4Å; E1600-K1607 IonicContact OE2-NZ 3.16Å; E1600-K1607 PolarHBondContact OE2-NZ 3.17Å; E1600-K1611 HydrophobicContact CG-CG 3.68Å; E1600-K1611 WeakPolarHBondContact OE1-CD 3.3Å; E1600-K1611 VanDerWaalsContact OE1-CE 3.26Å; E1600-K1611 WeakPolarHBondContact OE1-CE 3.33Å; E1600-K1611 VanDerWaalsContact OE1-CG 3.31Å; E1600-K1611 WeakPolarHBondContact OE1-CG 3.32Å
1601	L	92	Very high	87.5	Confident	0.4 Å²	0.4	61.3 Å²	61.3	0%	0.002	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	131.2	178.9	-54.5	178.3	0	0	0	111.4	M1538 W1548 I1550 W1559 F1576 L1590 L1591 A1592 V1599 I1608 S1609	M1538-L1601 HydrophobicContact CE-CD2 4.46Å; W1548-L1601 HydrophobicContact CH2-CD1 4.21Å; W1548-L1601 HydrophobicContact CH2-CD2 4.15Å; W1548-L1601 HydrophobicContact CH2-CG 4.43Å; I1550-L1601 HydrophobicContact CB-CD1 4.42Å; I1550-L1601 HydrophobicContact CD1-CD1 4.06Å; I1550-L1601 HydrophobicContact CG1-CD1 3.78Å; I1550-L1601 HydrophobicContact CG2-CD1 4.45Å; W1559-L1601 HydrophobicContact CE3-CD1 4.06Å; W1559-L1601 HydrophobicContact CZ3-CD1 4.14Å; F1576-L1601 HydrophobicContact CZ-CD1 4.39Å; L1590-L1601 HydrophobicContact CD1-CB 4.33Å; L1590-L1601 HydrophobicContact CD1-CD2 4.39Å; L1591-L1601 CarbonylContact O-C 3.48Å; L1591-L1601 WeakPolarHBondContact O-CA 3.45Å; A1592-L1601 HydrophobicContact CB-CD2 3.69Å; V1599-L1601 HydrophobicContact CG2-CD2 4.23Å; L1601-I1608 HydrophobicContact CB-CD1 4.31Å; L1601-I1608 HydrophobicContact CB-CG1 3.95Å; L1601-I1608 WeakPolarHBondContact O-CG1 3.3Å; L1601-I1608 PolarHBondContact O-N 2.96Å; L1601-S1609 WeakPolarHBondContact CB-OG 3.35Å; L1601-S1609 PolarHBondContact N-OG 2.93Å; L1601-S1609 PolarHBondContact O-N 3.11Å
1602	W	90.7	Very high	87.4	Confident	76.2 Å²	76.2	59.3 Å²	59.3	29%	0.289	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	133.5	174.6	-62.5	64.4	0	0	0	109	L1590 L1591 E1600 R1606 K1607	L1590-W1602 CarbonylContact C-O 3.58Å; L1590-W1602 WeakPolarHBondContact CA-O 3.42Å; L1591-W1602 HydrophobicContact CB-CB 4.23Å; L1591-W1602 PolarHBondContact N-O 2.9Å; L1591-W1602 PolarHBondContact O-N 2.96Å; E1600-W1602 PolarHBondContact OE2-NE1 3.44Å; W1602-R1606 CarbonylContact C-O 3.54Å; W1602-R1606 VanDerWaalsContact CA-O 3.23Å; W1602-R1606 WeakPolarHBondContact CA-O 3.37Å; W1602-K1607 HydrophobicContact CD2-CB 3.79Å; W1602-K1607 HydrophobicContact CD2-CG 4.44Å; W1602-K1607 HydrophobicContact CE3-CB 3.99Å; W1602-K1607 HydrophobicContact CG-CB 4.38Å; W1602-K1607 HydrophobicContact CH2-CB 4.02Å; W1602-K1607 HydrophobicContact CZ2-CB 3.84Å; W1602-K1607 HydrophobicContact CZ2-CD 4.07Å; W1602-K1607 HydrophobicContact CZ2-CG 4.24Å; W1602-K1607 HydrophobicContact CZ3-CB 4.09Å
1603	V	86.5	Confident	87.2	Confident	0.6 Å²	0.6	62.7 Å²	62.7	0%	0.004	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	128.2	173.4	169.8	0	0	0	0	109.2	W1559 L1580 P1581 L1582 F1588 N1589 L1590 K1605 R1606 I1608	W1559-V1603 HydrophobicContact CH2-CG2 4.31Å; W1559-V1603 HydrophobicContact CZ2-CG2 4.45Å; L1580-V1603 HydrophobicContact CD1-CB 4.26Å; L1580-V1603 HydrophobicContact CD1-CG1 4.13Å; L1580-V1603 HydrophobicContact CD1-CG2 4.33Å; L1580-V1603 WeakPolarHBondContact CD1-O 3.37Å; P1581-V1603 HydrophobicContact CG-CG1 4.01Å; L1582-V1603 HydrophobicContact CD2-CG1 3.81Å; F1588-V1603 HydrophobicContact CB-CG1 4.16Å; F1588-V1603 HydrophobicContact CD2-CG1 4.11Å; F1588-V1603 HydrophobicContact CD2-CG2 4.29Å; F1588-V1603 HydrophobicContact CG-CG1 4.3Å; N1589-V1603 CarbonylContact O-C 3.57Å; N1589-V1603 VanDerWaalsContact O-CA 3.3Å; N1589-V1603 WeakPolarHBondContact O-CA 3.3Å; L1590-V1603 HydrophobicContact CD1-CG2 3.64Å; V1603-K1605 VanDerWaalsContact C-N 3.32Å; V1603-K1605 PolarHBondContact O-N 2.93Å; V1603-R1606 PolarHBondContact N-O 3.07Å; V1603-R1606 PolarHBondContact O-N 3.15Å; V1603-R1606 VanDerWaalsContact O-O 3.14Å; V1603-I1608 HydrophobicContact CB-CD1 4.34Å; V1603-I1608 HydrophobicContact CB-CG1 4.46Å; V1603-I1608 HydrophobicContact CB-CG2 3.99Å; V1603-I1608 HydrophobicContact CG2-CD1 3.53Å; V1603-I1608 VanDerWaalsContact CG2-CD1 3.46Å; V1603-I1608 HydrophobicContact CG2-CG1 4.14Å; V1603-I1608 HydrophobicContact CG2-CG2 4.38Å
1604	N	82	Confident	87.1	Confident	48.6 Å²	48.6	58.1 Å²	58.1	26%	0.26	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.4	49.6	-179.5	-63.4	-35.7	0	0	0	112.7	P1581 F1588 N1589 R1606	P1581-N1604 HydrophobicContact CG-CB 4.42Å; P1581-N1604 PolarHBondContact O-ND2 2.86Å; F1588-N1604 WeakPolarHBondContact CA-OD1 3.41Å; F1588-N1604 WeakPolarHBondContact CB-ND2 3.27Å; N1589-N1604 PolarHBondContact N-OD1 3.04Å; N1589-N1604 PolarHBondContact O-N 3.03Å; N1604-R1606 VanDerWaalsContact C-N 3.27Å; N1604-R1606 PolarHBondContact O-N 2.99Å
1605	K	76.4	Confident	87	Confident	144.2 Å²	144.2	59.5 Å²	59.5	63%	0.627	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.4	10	-178.7	-52.9	175.9	-179.5	175.1	0	116.2	T1328 V1603 L1705 D1803	T1328-K1605 PolarHBondContact OG1-NZ 2.88Å; V1603-K1605 VanDerWaalsContact C-N 3.32Å; V1603-K1605 PolarHBondContact O-N 2.93Å; K1605-L1705 PolarHBondContact NZ-O 3.08Å; K1605-D1803 WeakPolarHBondContact CD-OD1 3.37Å; K1605-D1803 WeakPolarHBondContact CD-OD2 3.37Å; K1605-D1803 VanDerWaalsContact CE-CG 3.42Å; K1605-D1803 WeakPolarHBondContact CE-OD1 3.2Å; K1605-D1803 WeakPolarHBondContact CE-OD2 3.07Å; K1605-D1803 IonicContact NZ-OD1 2.93Å; K1605-D1803 PolarHBondContact NZ-OD1 3.03Å; K1605-D1803 IonicContact NZ-OD2 2.76Å; K1605-D1803 PolarHBondContact NZ-OD2 3.07Å
1606	R	80.6	Confident	87	Confident	172 Å²	172	56.2 Å²	56.2	65%	0.649	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.4	133.7	171.3	-80.9	-179.2	174.8	-161.1	-1.8	111.1	L1580 W1602 V1603 N1604 I1608	L1580-R1606 HydrophobicContact CD1-CB 4.14Å; W1602-R1606 CarbonylContact C-O 3.54Å; W1602-R1606 VanDerWaalsContact CA-O 3.23Å; W1602-R1606 WeakPolarHBondContact CA-O 3.37Å; V1603-R1606 PolarHBondContact N-O 3.07Å; V1603-R1606 PolarHBondContact O-N 3.15Å; V1603-R1606 VanDerWaalsContact O-O 3.14Å; N1604-R1606 VanDerWaalsContact C-N 3.27Å; N1604-R1606 PolarHBondContact O-N 2.99Å; R1606-I1608 PolarHBondContact O-N 2.85Å
1607	K	88	Confident	87	Confident	79.4 Å²	79.4	51.2 Å²	51.2	35%	0.345	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	130.1	172.4	-173.6	170.7	176.6	165.4	0	109.4	E1600 W1602 S1609 P1932	E1600-K1607 IonicContact OE1-NZ 3.18Å; E1600-K1607 PolarHBondContact OE1-NZ 3.12Å; E1600-K1607 VanDerWaalsContact OE2-CE 3.24Å; E1600-K1607 WeakPolarHBondContact OE2-CE 3.4Å; E1600-K1607 IonicContact OE2-NZ 3.16Å; E1600-K1607 PolarHBondContact OE2-NZ 3.17Å; W1602-K1607 HydrophobicContact CD2-CB 3.79Å; W1602-K1607 HydrophobicContact CD2-CG 4.44Å; W1602-K1607 HydrophobicContact CE3-CB 3.99Å; W1602-K1607 HydrophobicContact CG-CB 4.38Å; W1602-K1607 HydrophobicContact CH2-CB 4.02Å; W1602-K1607 HydrophobicContact CZ2-CB 3.84Å; W1602-K1607 HydrophobicContact CZ2-CD 4.07Å; W1602-K1607 HydrophobicContact CZ2-CG 4.24Å; W1602-K1607 HydrophobicContact CZ3-CB 4.09Å; K1607-S1609 VanDerWaalsContact CE-O 3.27Å; K1607-S1609 WeakPolarHBondContact CE-O 3.42Å; K1607-P1932 HydrophobicContact CD-CB 4.05Å; K1607-P1932 HydrophobicContact CD-CG 4.06Å
1608	I	88	Confident	86.8	Confident	11.6 Å²	11.6	49.5 Å²	49.5	6%	0.059	23%	0.232	C	C	.	.			trans	-113	-24.6	177.4	59.9	158.9	0	0	0	113.1	W1559 F1576 S1578 P1579 L1580 L1601 V1603 R1606 R1933	W1559-I1608 HydrophobicContact CD2-CD1 3.98Å; W1559-I1608 HydrophobicContact CE3-CD1 3.94Å; W1559-I1608 HydrophobicContact CH2-CD1 3.89Å; W1559-I1608 HydrophobicContact CZ2-CD1 3.86Å; W1559-I1608 HydrophobicContact CZ3-CD1 3.92Å; F1576-I1608 WeakPolarHBondContact CD2-O 3.37Å; F1576-I1608 HydrophobicContact CE2-CB 4.17Å; F1576-I1608 HydrophobicContact CE2-CD1 4.05Å; F1576-I1608 HydrophobicContact CE2-CG1 4.14Å; F1576-I1608 WeakPolarHBondContact CE2-O 3.42Å; F1576-I1608 HydrophobicContact CZ-CD1 4.24Å; F1576-I1608 HydrophobicContact CZ-CG1 4.4Å; S1578-I1608 VanDerWaalsContact OG-CG2 3.32Å; S1578-I1608 WeakPolarHBondContact OG-CG2 3.3Å; P1579-I1608 HydrophobicContact CG-CG2 4.25Å; L1580-I1608 HydrophobicContact CD1-CG2 4.29Å; L1580-I1608 HydrophobicContact CG-CG2 4.28Å; L1601-I1608 HydrophobicContact CB-CD1 4.31Å; L1601-I1608 HydrophobicContact CB-CG1 3.95Å; L1601-I1608 WeakPolarHBondContact O-CG1 3.3Å; L1601-I1608 PolarHBondContact O-N 2.96Å; V1603-I1608 HydrophobicContact CB-CD1 4.34Å; V1603-I1608 HydrophobicContact CB-CG1 4.46Å; V1603-I1608 HydrophobicContact CB-CG2 3.99Å; V1603-I1608 HydrophobicContact CG2-CD1 3.53Å; V1603-I1608 VanDerWaalsContact CG2-CD1 3.46Å; V1603-I1608 HydrophobicContact CG2-CG1 4.14Å; V1603-I1608 HydrophobicContact CG2-CG2 4.38Å; R1606-I1608 PolarHBondContact O-N 2.85Å; I1608-R1933 PolarHBondContact O-NH1 2.69Å
1609	S	88	Confident	86.5	Confident	4.8 Å²	4.8	46.6 Å²	46.6	3%	0.034	22%	0.219	C	C	.	.	S	Bend	trans	-114.5	156	-170.6	82.8	0	0	0	0	114.1	F1576 L1601 K1607	F1576-S1609 VanDerWaalsContact CE1-CB 3.49Å; L1601-S1609 WeakPolarHBondContact CB-OG 3.35Å; L1601-S1609 PolarHBondContact N-OG 2.93Å; L1601-S1609 PolarHBondContact O-N 3.11Å; K1607-S1609 VanDerWaalsContact CE-O 3.27Å; K1607-S1609 WeakPolarHBondContact CE-O 3.42Å
1610	P	86.2	Confident	85.9	Confident	58 Å²	58	51.5 Å²	51.5	38%	0.377	24%	0.242	S	C	.	.			trans	-57	173.8	152	-22.5	33.6	0	0	0	112.7	I1574 Y1612	I1574-P1610 HydrophobicContact CG2-CG 4.07Å; P1610-Y1612 HydrophobicContact CB-CE2 3.93Å; P1610-Y1612 WeakPolarHBondContact CD-OH 3.33Å; P1610-Y1612 HydrophobicContact CG-CE2 4.27Å; P1610-Y1612 WeakPolarHBondContact CG-OH 3.37Å; P1610-Y1612 VanDerWaalsContact O-CD2 3.28Å; P1610-Y1612 WeakPolarHBondContact O-CD2 3.42Å; P1610-Y1612 VanDerWaalsContact O-CE2 3.28Å; P1610-Y1612 WeakPolarHBondContact O-CE2 3.34Å
1611	K	87.4	Confident	85.4	Confident	96.2 Å²	96.2	53.7 Å²	53.7	42%	0.418	25%	0.251	S	S	.	.			trans	-78.8	135.2	167.3	-72	179.7	162	-161.4	0	110.9	E1598 V1599 E1600	E1598-K1611 HydrophobicContact CB-CD 4.29Å; E1598-K1611 WeakPolarHBondContact OE1-CD 3.42Å; E1598-K1611 VanDerWaalsContact OE2-CD 3.22Å; E1598-K1611 WeakPolarHBondContact OE2-CD 3.26Å; E1598-K1611 VanDerWaalsContact OE2-CE 3.25Å; E1598-K1611 WeakPolarHBondContact OE2-CE 3.12Å; E1598-K1611 IonicContact OE2-NZ 3.13Å; E1598-K1611 PolarHBondContact OE2-NZ 3.02Å; V1599-K1611 WeakPolarHBondContact O-CA 3.42Å; E1600-K1611 HydrophobicContact CG-CG 3.68Å; E1600-K1611 WeakPolarHBondContact OE1-CD 3.3Å; E1600-K1611 VanDerWaalsContact OE1-CE 3.26Å; E1600-K1611 WeakPolarHBondContact OE1-CE 3.33Å; E1600-K1611 VanDerWaalsContact OE1-CG 3.31Å; E1600-K1611 WeakPolarHBondContact OE1-CG 3.32Å
1612	Y	88.5	Confident	84.9	Confident	5.4 Å²	5.4	54.6 Å²	54.6	2%	0.021	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	147.4	174.3	-61.7	-84.3	0	0	0	110.4	W1548 P1561 Q1572 K1573 I1574 F1576 E1598 V1599 P1610 L1614	W1548-Y1612 HydrophobicContact CZ2-CD2 4.41Å; P1561-Y1612 HydrophobicContact CB-CD1 4.16Å; P1561-Y1612 HydrophobicContact CB-CE1 4.27Å; P1561-Y1612 HydrophobicContact CB-CG 4.36Å; P1561-Y1612 HydrophobicContact CG-CD1 3.64Å; P1561-Y1612 HydrophobicContact CG-CD2 4.27Å; P1561-Y1612 HydrophobicContact CG-CE1 3.29Å; P1561-Y1612 VanDerWaalsContact CG-CE1 3.45Å; P1561-Y1612 HydrophobicContact CG-CE2 4.02Å; P1561-Y1612 HydrophobicContact CG-CG 4.16Å; P1561-Y1612 VanDerWaalsContact CG-CZ 3.48Å; Q1572-Y1612 HydrophobicContact CB-CD1 4.12Å; Q1572-Y1612 VanDerWaalsContact O-CE1 3.26Å; Q1572-Y1612 WeakPolarHBondContact O-CE1 3.32Å; K1573-Y1612 HydrophobicContact CB-CD1 4.48Å; K1573-Y1612 HydrophobicContact CB-CE1 4.06Å; I1574-Y1612 HydrophobicContact CB-CE1 4.37Å; I1574-Y1612 WeakPolarHBondContact O-CE1 3.38Å; I1574-Y1612 PolarHBondContact O-OH 3.28Å; F1576-Y1612 HydrophobicContact CD1-CE2 4.36Å; F1576-Y1612 WeakPolarHBondContact CD1-OH 3.42Å; F1576-Y1612 HydrophobicContact CE1-CE2 4.17Å; E1598-Y1612 CarbonylContact C-O 3.52Å; E1598-Y1612 VanDerWaalsContact CA-O 3.31Å; E1598-Y1612 WeakPolarHBondContact CA-O 3.17Å; V1599-Y1612 WeakPolarHBondContact CG1-O 3.39Å; V1599-Y1612 PolarHBondContact N-O 3.18Å; V1599-Y1612 PolarHBondContact O-N 3.04Å; V1599-Y1612 VanDerWaalsContact O-N 3.11Å; P1610-Y1612 HydrophobicContact CB-CE2 3.93Å; P1610-Y1612 WeakPolarHBondContact CD-OH 3.33Å; P1610-Y1612 HydrophobicContact CG-CE2 4.27Å; P1610-Y1612 WeakPolarHBondContact CG-OH 3.37Å; P1610-Y1612 VanDerWaalsContact O-CD2 3.28Å; P1610-Y1612 WeakPolarHBondContact O-CD2 3.42Å; P1610-Y1612 VanDerWaalsContact O-CE2 3.28Å; P1610-Y1612 WeakPolarHBondContact O-CE2 3.34Å; Y1612-L1614 PolarHBondContact O-N 2.94Å
1613	T	87.9	Confident	84.4	Confident	72.8 Å²	72.8	52.9 Å²	52.9	45%	0.447	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	119.1	-177.4	-47.1	0	0	0	0	110.3	Q1572 R1597	Q1572-T1613 PolarHBondContact NE2-O 2.91Å; Q1572-T1613 VanDerWaalsContact NE2-O 3.15Å; Q1572-T1613 PolarHBondContact OE1-O 2.91Å; R1597-T1613 HydrophobicContact CB-CG2 4.47Å
1614	L	89.3	Confident	84.2	Confident	5.2 Å²	5.2	53.2 Å²	53.2	3%	0.027	26%	0.256	C	S	.	.			trans	-70.5	141.3	173.1	-63.8	179	0	0	0	110.5	L1520 M1542 W1548 V1594 R1597 V1599 Y1612 G1616	L1520-L1614 HydrophobicContact CD2-CD1 3.97Å; M1542-L1614 HydrophobicContact CE-CB 4.09Å; M1542-L1614 HydrophobicContact CE-CD1 3.98Å; M1542-L1614 HydrophobicContact CE-CG 4.32Å; M1542-L1614 HydrophobicContact SD-CB 3.8Å; M1542-L1614 HydrophobicContact SD-CD1 4.29Å; M1542-L1614 HydrophobicContact SD-CD2 4.19Å; M1542-L1614 HydrophobicContact SD-CG 4.31Å; W1548-L1614 HydrophobicContact CB-CD2 3.91Å; W1548-L1614 HydrophobicContact CD2-CD2 3.7Å; W1548-L1614 HydrophobicContact CE3-CD2 4.12Å; W1548-L1614 HydrophobicContact CG-CD2 3.6Å; V1594-L1614 HydrophobicContact CG1-CD1 3.82Å; V1594-L1614 HydrophobicContact CG2-CD1 3.87Å; R1597-L1614 HydrophobicContact CB-CB 4.47Å; R1597-L1614 VanDerWaalsContact O-CB 3.31Å; R1597-L1614 WeakPolarHBondContact O-CB 3.24Å; R1597-L1614 WeakPolarHBondContact O-CG 3.41Å; R1597-L1614 PolarHBondContact O-N 3.24Å; V1599-L1614 HydrophobicContact CB-CD1 4.21Å; V1599-L1614 HydrophobicContact CB-CD2 4.12Å; V1599-L1614 HydrophobicContact CB-CG 4.02Å; V1599-L1614 HydrophobicContact CG1-CD2 3.71Å; V1599-L1614 HydrophobicContact CG1-CG 4Å; Y1612-L1614 PolarHBondContact O-N 2.94Å; L1614-G1616 VanDerWaalsContact C-N 3.3Å; L1614-G1616 PolarHBondContact O-N 2.97Å
1615	P	87.4	Confident	84.1	Confident	36.2 Å²	36.2	51.2 Å²	51.2	24%	0.235	25%	0.246	C	C	.	.	S	Bend	trans	-72.3	-27.6	-176.3	29.8	-36.8	0	0	0	113.4	M1542 T1546 W1548 T1563 R1597	M1542-P1615 HydrophobicContact CG-CG 4.36Å; M1542-P1615 HydrophobicContact SD-CG 4.12Å; T1546-P1615 HydrophobicContact CG2-CB 4.1Å; W1548-P1615 HydrophobicContact CB-CG 4.43Å; T1563-P1615 HydrophobicContact CG2-CB 3.81Å; T1563-P1615 HydrophobicContact CG2-CG 3.93Å; R1597-P1615 PolarHBondContact NH1-O 2.87Å
1616	G	84.9	Confident	84.5	Confident	2.6 Å²	2.6	45.1 Å²	45.1	3%	0.027	23%	0.225	C	C	.	.	S	Bend	trans	-116.4	-178.6	-179.7	0	0	0	0	0	113.6	M1542 D1543 T1546 R1597 L1614	M1542-G1616 VanDerWaalsContact CE-C 3.48Å; M1542-G1616 VanDerWaalsContact CE-O 3.27Å; M1542-G1616 WeakPolarHBondContact CE-O 3.28Å; D1543-G1616 VanDerWaalsContact OD1-C 3.29Å; D1543-G1616 WeakPolarHBondContact OD1-CA 3.27Å; T1546-G1616 PolarHBondContact OG1-N 3.35Å; R1597-G1616 WeakPolarHBondContact CD-O 3.43Å; R1597-G1616 PolarHBondContact NE-O 2.8Å; L1614-G1616 VanDerWaalsContact C-N 3.3Å; L1614-G1616 PolarHBondContact O-N 2.97Å
1617	T	83.6	Confident	84.7	Confident	46 Å²	46	38 Å²	38	28%	0.282	20%	0.2	S	C	.	.	S	Bend	trans	-95.6	-32	175.2	56.2	0	0	0	0	113.4	P1519 L1520 D1543 R1597	P1519-T1617 CarbonylContact C-O 3.43Å; P1519-T1617 VanDerWaalsContact CA-O 3.3Å; P1519-T1617 WeakPolarHBondContact CA-O 3.27Å; P1519-T1617 HydrophobicContact CB-CG2 4.18Å; P1519-T1617 HydrophobicContact CG-CG2 4.08Å; L1520-T1617 WeakPolarHBondContact CB-O 3.43Å; L1520-T1617 PolarHBondContact N-O 3.06Å; D1543-T1617 VanDerWaalsContact CG-N 3.31Å; D1543-T1617 PolarHBondContact OD1-N 3Å; D1543-T1617 VanDerWaalsContact OD1-N 3.15Å; D1543-T1617 VanDerWaalsContact OD2-CA 3.29Å; D1543-T1617 WeakPolarHBondContact OD2-CA 3.18Å; D1543-T1617 WeakPolarHBondContact OD2-CB 3.12Å; D1543-T1617 PolarHBondContact OD2-N 3.07Å; D1543-T1617 PolarHBondContact OD2-OG1 2.91Å; R1597-T1617 VanDerWaalsContact CZ-CG2 3.5Å; R1597-T1617 VanDerWaalsContact NE-CG2 3.3Å; R1597-T1617 PolarHBondContact NH2-OG1 2.97Å
1618	R	82.3	Confident	84.3	Confident	82.2 Å²	82.2	35 Å²	35	31%	0.31	19%	0.188	S	C	.	.	S	Bend	trans	-125.8	126.3	-167.7	-109.5	168.1	108.9	-163.2	-0.9	110.6	R1517 G1518 M1542 D1543 E1620	R1517-R1618 VanDerWaalsContact O-CD 3.23Å; R1517-R1618 WeakPolarHBondContact O-CD 3.31Å; R1517-R1618 PolarHBondContact O-NE 2.87Å; R1517-R1618 PolarHBondContact O-NH1 3.36Å; R1517-R1618 PolarHBondContact O-NH2 2.84Å; G1518-R1618 VanDerWaalsContact O-CG 3.28Å; G1518-R1618 WeakPolarHBondContact O-CG 3.36Å; M1542-R1618 CarbonylContact C-O 3.51Å; M1542-R1618 VanDerWaalsContact CA-O 3.26Å; M1542-R1618 WeakPolarHBondContact CA-O 3.24Å; M1542-R1618 VanDerWaalsContact CB-O 3.25Å; M1542-R1618 WeakPolarHBondContact CB-O 3.44Å; D1543-R1618 HydrophobicContact CB-CB 4.29Å; D1543-R1618 PolarHBondContact N-O 2.92Å; D1543-R1618 VanDerWaalsContact N-O 3.13Å; D1543-R1618 PolarHBondContact OD1-N 2.92Å; D1543-R1618 PolarHBondContact OD2-N 3.02Å; R1618-E1620 IonicContact CZ-OE1 3.07Å; R1618-E1620 IonicContact NE-OE1 3.02Å; R1618-E1620 PolarHBondContact NE-OE1 3.34Å; R1618-E1620 IonicContact NH2-OE1 3.27Å; R1618-E1620 PolarHBondContact NH2-OE1 3.26Å; R1618-E1620 PolarHBondContact O-N 2.97Å
1619	A	82.5	Confident	83.7	Confident	4.4 Å²	4.4	37.8 Å²	37.8	4%	0.036	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	130.6	163.8	0	0	0	0	0	110.9	L1520 V1540 R1541 M1542 V1622 T1635 H1637	L1520-A1619 HydrophobicContact CD1-CB 3.9Å; L1520-A1619 HydrophobicContact CD2-CB 3.96Å; L1520-A1619 HydrophobicContact CG-CB 4.44Å; V1540-A1619 HydrophobicContact CG1-CB 3.7Å; R1541-A1619 CarbonylContact O-C 3.43Å; R1541-A1619 WeakPolarHBondContact O-CA 3.28Å; M1542-A1619 HydrophobicContact SD-CB 3.96Å; A1619-V1622 HydrophobicContact CB-CG2 4.28Å; A1619-T1635 HydrophobicContact CB-CG2 4.3Å; A1619-H1637 PolarHBondContact N-NE2 3.06Å; A1619-H1637 VanDerWaalsContact N-NE2 3.19Å; A1619-H1637 PolarHBondContact O-CE1 2.92Å; A1619-H1637 VanDerWaalsContact O-CE1 3.29Å; A1619-H1637 PolarHBondContact O-NE2 3.05Å; A1619-H1637 VanDerWaalsContact O-NE2 3.1Å
1620	E	80.2	Confident	82.6	Confident	104.8 Å²	104.8	39.2 Å²	39.2	49%	0.49	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	-41	175.6	-58.2	-167	156.9	0	0	111.3	R1541 D1543 R1618 R1664	R1541-E1620 PolarHBondContact O-N 3.12Å; D1543-E1620 WeakPolarHBondContact CA-OE1 3.18Å; R1618-E1620 IonicContact CZ-OE1 3.07Å; R1618-E1620 IonicContact NE-OE1 3.02Å; R1618-E1620 PolarHBondContact NE-OE1 3.34Å; R1618-E1620 IonicContact NH2-OE1 3.27Å; R1618-E1620 PolarHBondContact NH2-OE1 3.26Å; R1618-E1620 PolarHBondContact O-N 2.97Å; E1620-R1664 PolarHBondContact O-NH1 3.31Å
1621	K	80.4	Confident	82.1	Confident	77 Å²	77	39.4 Å²	39.4	34%	0.335	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	136.3	175.9	-171.4	174	-177.8	174.2	0	110.3	P1273 E1492 L1511 R1541 V1623	P1273-K1621 PolarHBondContact O-NZ 2.75Å; P1273-K1621 VanDerWaalsContact O-NZ 3.13Å; E1492-K1621 WeakPolarHBondContact OE1-CE 3.49Å; E1492-K1621 IonicContact OE1-NZ 3.14Å; E1492-K1621 PolarHBondContact OE1-NZ 2.8Å; L1511-K1621 WeakPolarHBondContact O-CG 3.19Å; R1541-K1621 HydrophobicContact CB-CB 4.25Å; R1541-K1621 WeakPolarHBondContact CB-O 3.45Å; R1541-K1621 HydrophobicContact CG-CB 4.37Å; R1541-K1621 PolarHBondContact N-O 3Å; R1541-K1621 PolarHBondContact O-N 2.81Å; K1621-V1623 HydrophobicContact CD-CG2 4.33Å; K1621-V1623 HydrophobicContact CG-CG2 4.21Å
1622	V	81.7	Confident	81	Confident	18.2 Å²	18.2	37.5 Å²	37.5	11%	0.11	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	132	169.3	-174.1	0	0	0	0	108.9	I1523 M1538 I1539 V1540 A1619 I1624 V1633 T1635 I1666	I1523-V1622 HydrophobicContact CD1-CG2 4.05Å; I1523-V1622 HydrophobicContact CG2-CG1 4.4Å; I1523-V1622 HydrophobicContact CG2-CG2 4.33Å; M1538-V1622 HydrophobicContact CG-CG1 3.9Å; M1538-V1622 HydrophobicContact SD-CG1 4.1Å; I1539-V1622 CarbonylContact O-C 3.49Å; I1539-V1622 WeakPolarHBondContact O-CA 3.35Å; V1540-V1622 HydrophobicContact CG1-CG2 4.34Å; V1540-V1622 HydrophobicContact CG2-CG1 4.4Å; V1540-V1622 HydrophobicContact CG2-CG2 4.45Å; A1619-V1622 HydrophobicContact CB-CG2 4.28Å; V1622-I1624 HydrophobicContact CG1-CG1 4.49Å; V1622-V1633 HydrophobicContact CB-CG1 4.26Å; V1622-V1633 HydrophobicContact CB-CG2 4.21Å; V1622-V1633 HydrophobicContact CG1-CG1 3.97Å; V1622-V1633 HydrophobicContact CG1-CG2 3.91Å; V1622-V1633 HydrophobicContact CG2-CG1 4.45Å; V1622-V1633 HydrophobicContact CG2-CG2 4.44Å; V1622-T1635 HydrophobicContact CG2-CG2 3.63Å; V1622-I1666 HydrophobicContact CB-CD1 4.37Å
1623	V	80.8	Confident	80.2	Confident	40.2 Å²	40.2	38.5 Å²	38.5	24%	0.244	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	132.9	177.3	-177.4	0	0	0	0	108.1	V1508 M1538 I1539 K1621	V1508-V1623 HydrophobicContact CG1-CG1 3.96Å; M1538-V1623 CarbonylContact C-O 3.53Å; M1538-V1623 VanDerWaalsContact CA-O 3.32Å; M1538-V1623 WeakPolarHBondContact CA-O 3.33Å; I1539-V1623 HydrophobicContact CB-CB 4.4Å; I1539-V1623 PolarHBondContact N-O 3.18Å; I1539-V1623 PolarHBondContact O-N 3.09Å; K1621-V1623 HydrophobicContact CD-CG2 4.33Å; K1621-V1623 HydrophobicContact CG-CG2 4.21Å
1624	I	82.3	Confident	79.2	Confident	6.6 Å²	6.6	37.9 Å²	37.9	3%	0.034	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	140.7	172.8	-67.9	-179.5	0	0	0	108.1	V1508 A1525 V1527 F1536 Y1537 M1538 V1622 V1628 F1631 V1633	V1508-I1624 WeakPolarHBondContact CG1-O 3.49Å; A1525-I1624 HydrophobicContact CB-CD1 3.6Å; A1525-I1624 VanDerWaalsContact CB-CD1 3.46Å; V1527-I1624 HydrophobicContact CG1-CG2 4.3Å; V1527-I1624 HydrophobicContact CG2-CD1 4.08Å; V1527-I1624 HydrophobicContact CG2-CG2 4.34Å; F1536-I1624 HydrophobicContact CD2-CG2 4.46Å; F1536-I1624 HydrophobicContact CE2-CG2 3.7Å; F1536-I1624 HydrophobicContact CZ-CG2 4.42Å; Y1537-I1624 CarbonylContact O-C 3.56Å; Y1537-I1624 WeakPolarHBondContact O-CA 3.41Å; M1538-I1624 HydrophobicContact CB-CG1 4.2Å; M1538-I1624 HydrophobicContact CG-CD1 4.5Å; M1538-I1624 HydrophobicContact CG-CG1 3.98Å; M1538-I1624 HydrophobicContact SD-CD1 4.39Å; M1538-I1624 HydrophobicContact SD-CG1 4.38Å; V1622-I1624 HydrophobicContact CG1-CG1 4.49Å; I1624-V1628 HydrophobicContact CG2-CG1 4.34Å; I1624-V1628 HydrophobicContact CG2-CG2 4.2Å; I1624-F1631 HydrophobicContact CB-CB 4.39Å; I1624-F1631 HydrophobicContact CB-CD1 3.93Å; I1624-F1631 HydrophobicContact CB-CD2 3.98Å; I1624-F1631 HydrophobicContact CB-CE1 4.01Å; I1624-F1631 HydrophobicContact CB-CE2 4.06Å; I1624-F1631 HydrophobicContact CB-CG 3.91Å; I1624-F1631 HydrophobicContact CB-CZ 4.08Å; I1624-F1631 HydrophobicContact CD1-CB 4.37Å; I1624-F1631 HydrophobicContact CD1-CD2 4.11Å; I1624-F1631 HydrophobicContact CD1-CE2 4.44Å; I1624-F1631 HydrophobicContact CD1-CG 4.33Å; I1624-F1631 HydrophobicContact CG1-CD2 4.24Å; I1624-F1631 HydrophobicContact CG1-CE2 4.41Å; I1624-F1631 HydrophobicContact CG2-CB 4.24Å; I1624-F1631 HydrophobicContact CG2-CD1 3.92Å; I1624-F1631 HydrophobicContact CG2-CD2 4.39Å; I1624-F1631 HydrophobicContact CG2-CE1 4.34Å; I1624-F1631 HydrophobicContact CG2-CG 3.99Å; I1624-F1631 VanDerWaalsContact O-CE1 3.27Å; I1624-F1631 WeakPolarHBondContact O-CE1 3.3Å; I1624-V1633 HydrophobicContact CD1-CB 4.09Å; I1624-V1633 HydrophobicContact CD1-CG2 3.91Å; I1624-V1633 VanDerWaalsContact CD1-CG2 3.45Å; I1624-V1633 HydrophobicContact CG1-CG2 3.99Å
1625	G	79.5	Confident	78.6	Confident	6.4 Å²	6.4	39.6 Å²	39.6	7%	0.066	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.1	-165.2	-178.4	0	0	0	0	0	113.4	F1536 Y1537 V1628	F1536-G1625 CarbonylContact C-O 3.46Å; F1536-G1625 WeakPolarHBondContact CA-O 3.24Å; Y1537-G1625 VanDerWaalsContact CE1-C 3.47Å; Y1537-G1625 PolarHBondContact N-O 2.79Å; Y1537-G1625 PolarHBondContact O-N 2.96Å; G1625-V1628 VanDerWaalsContact O-CG2 3.3Å; G1625-V1628 WeakPolarHBondContact O-CG2 3.35Å
1626	G	84.5	Confident	78.1	Confident	16.4 Å²	16.4	40.8 Å²	40.8	17%	0.169	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	96	-147.4	-163.9	0	0	0	0	0	110	K1535 V1628	K1535-G1626 CarbonylContact O-C 3.52Å; K1535-G1626 WeakPolarHBondContact O-CA 3.28Å; G1626-V1628 PolarHBondContact O-N 3.06Å; G1626-V1628 VanDerWaalsContact O-N 3.1Å
1627	D	85.3	Confident	77.9	Confident	24 Å²	24	41.7 Å²	41.7	13%	0.128	22%	0.223	C	C	.	.	S	Bend	trans	-85.5	55.2	-177.1	-53.7	-28.4	0	0	0	110.1	M1529 Q1530 P1533 S1534 K1535	M1529-D1627 CarbonylContact C-O 3.56Å; M1529-D1627 WeakPolarHBondContact CA-O 3.4Å; M1529-D1627 HydrophobicContact CE-CB 4.39Å; M1529-D1627 VanDerWaalsContact CE-O 3.28Å; M1529-D1627 WeakPolarHBondContact CE-O 3.34Å; Q1530-D1627 HydrophobicContact CB-CB 4.35Å; Q1530-D1627 WeakPolarHBondContact CB-O 3.46Å; Q1530-D1627 HydrophobicContact CG-CB 4.46Å; Q1530-D1627 WeakPolarHBondContact CG-O 3.33Å; Q1530-D1627 PolarHBondContact N-O 2.98Å; P1533-D1627 HydrophobicContact CB-CB 3.93Å; S1534-D1627 VanDerWaalsContact CA-OD2 3.29Å; S1534-D1627 WeakPolarHBondContact CA-OD2 3.43Å; S1534-D1627 VanDerWaalsContact CB-OD2 3.32Å; S1534-D1627 WeakPolarHBondContact CB-OD2 3.28Å; S1534-D1627 PolarHBondContact N-OD2 3.06Å; S1534-D1627 PolarHBondContact OG-OD2 3.01Å; K1535-D1627 VanDerWaalsContact CE-OD1 3.3Å; K1535-D1627 WeakPolarHBondContact CE-OD1 3.26Å; K1535-D1627 HydrophobicContact CG-CB 4.39Å; K1535-D1627 VanDerWaalsContact CG-CG 3.44Å; K1535-D1627 WeakPolarHBondContact CG-OD1 3.25Å; K1535-D1627 WeakPolarHBondContact CG-OD2 3.38Å; K1535-D1627 PolarHBondContact N-OD2 3.07Å; K1535-D1627 IonicContact NZ-OD1 2.87Å; K1535-D1627 PolarHBondContact NZ-OD1 3.41Å; K1535-D1627 IonicContact NZ-OD2 3.27Å; K1535-D1627 PolarHBondContact O-N 2.93Å
1628	V	80.2	Confident	77.1	Confident	15.2 Å²	15.2	42.2 Å²	42.2	9%	0.092	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	127.8	-174.3	176.6	0	0	0	0	109.1	V1527 Q1528 M1529 Q1530 F1536 I1624 G1625 G1626 A1630 F1631	V1527-V1628 HydrophobicContact CG1-CG1 3.96Å; V1527-V1628 HydrophobicContact CG1-CG2 4.06Å; Q1528-V1628 CarbonylContact O-C 3.53Å; Q1528-V1628 WeakPolarHBondContact O-CA 3.4Å; Q1528-V1628 WeakPolarHBondContact O-CG1 3.29Å; M1529-V1628 HydrophobicContact CE-CG2 4.29Å; M1529-V1628 HydrophobicContact SD-CG2 3.94Å; Q1530-V1628 PolarHBondContact NE2-O 2.84Å; F1536-V1628 HydrophobicContact CD2-CG2 3.94Å; F1536-V1628 HydrophobicContact CE2-CG2 4.35Å; I1624-V1628 HydrophobicContact CG2-CG1 4.34Å; I1624-V1628 HydrophobicContact CG2-CG2 4.2Å; G1625-V1628 VanDerWaalsContact O-CG2 3.3Å; G1625-V1628 WeakPolarHBondContact O-CG2 3.35Å; G1626-V1628 PolarHBondContact O-N 3.06Å; G1626-V1628 VanDerWaalsContact O-N 3.1Å; V1628-A1630 VanDerWaalsContact CG1-O 3.3Å; V1628-A1630 WeakPolarHBondContact CG1-O 3.39Å; V1628-F1631 HydrophobicContact CG1-CB 4.3Å; V1628-F1631 HydrophobicContact CG1-CD1 3.92Å
1629	E	74.4	Confident	75.5	Confident	71.8 Å²	71.8	45.6 Å²	45.6	34%	0.336	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	-50.3	176.2	-174.4	175.7	-174.9	0	0	110.1	K1265 I1269 Q1528 Q1530 R1586	K1265-E1629 IonicContact NZ-OE1 3.29Å; K1265-E1629 PolarHBondContact NZ-OE1 2.88Å; K1265-E1629 IonicContact NZ-OE2 2.65Å; K1265-E1629 PolarHBondContact NZ-OE2 2.85Å; I1269-E1629 HydrophobicContact CD1-CG 4.13Å; Q1528-E1629 VanDerWaalsContact CD-OE2 3.26Å; Q1528-E1629 HydrophobicContact CG-CB 4.27Å; Q1528-E1629 PolarHBondContact NE2-OE2 3.15Å; Q1528-E1629 PolarHBondContact O-N 3.07Å; Q1530-E1629 HydrophobicContact CG-CB 4.09Å; R1586-E1629 IonicContact CZ-OE2 3.3Å; R1586-E1629 IonicContact NE-OE2 3.15Å; R1586-E1629 PolarHBondContact NE-OE2 2.76Å; R1586-E1629 IonicContact NH2-OE1 2.68Å; R1586-E1629 PolarHBondContact NH2-OE1 3.07Å; R1586-E1629 IonicContact NH2-OE2 3.11Å; R1586-E1629 PolarHBondContact NH2-OE2 3Å
1630	A	65.3	Low	73.6	Confident	32.8 Å²	32.8	48.9 Å²	48.9	27%	0.271	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	157.1	175.4	0	0	0	0	0	111.4	Q1528 V1628 S1668 L1671	Q1528-A1630 WeakPolarHBondContact CA-O 3.42Å; Q1528-A1630 HydrophobicContact CB-CB 4.29Å; Q1528-A1630 WeakPolarHBondContact CB-O 3.36Å; Q1528-A1630 PolarHBondContact N-O 2.95Å; Q1528-A1630 PolarHBondContact O-N 3.02Å; V1628-A1630 VanDerWaalsContact CG1-O 3.3Å; V1628-A1630 WeakPolarHBondContact CG1-O 3.39Å; A1630-S1668 WeakPolarHBondContact CA-O 3.46Å; A1630-S1668 VanDerWaalsContact CB-O 3.29Å; A1630-S1668 WeakPolarHBondContact CB-O 3.34Å; A1630-L1671 HydrophobicContact CB-CB 4.01Å; A1630-L1671 HydrophobicContact CB-CD1 4.15Å
1631	F	75.6	Confident	71.5	Confident	63.4 Å²	63.4	49.4 Å²	49.4	28%	0.278	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	159.6	169.1	66.9	-93.8	0	0	0	113	K1509 L1511 T1526 V1527 I1624 V1628 V1633 I1666 R1667 S1668	K1509-F1631 WeakPolarHBondContact O-CZ 3.36Å; L1511-F1631 HydrophobicContact CD1-CD2 4.27Å; L1511-F1631 HydrophobicContact CD1-CE2 3.54Å; L1511-F1631 HydrophobicContact CD1-CZ 4.05Å; T1526-F1631 CarbonylContact O-C 3.52Å; T1526-F1631 VanDerWaalsContact O-CA 3.27Å; T1526-F1631 WeakPolarHBondContact O-CA 3.24Å; T1526-F1631 WeakPolarHBondContact O-CB 3.25Å; V1527-F1631 HydrophobicContact CG1-CB 4.48Å; V1527-F1631 HydrophobicContact CG2-CB 4.22Å; I1624-F1631 HydrophobicContact CB-CB 4.39Å; I1624-F1631 HydrophobicContact CB-CD1 3.93Å; I1624-F1631 HydrophobicContact CB-CD2 3.98Å; I1624-F1631 HydrophobicContact CB-CE1 4.01Å; I1624-F1631 HydrophobicContact CB-CE2 4.06Å; I1624-F1631 HydrophobicContact CB-CG 3.91Å; I1624-F1631 HydrophobicContact CB-CZ 4.08Å; I1624-F1631 HydrophobicContact CD1-CB 4.37Å; I1624-F1631 HydrophobicContact CD1-CD2 4.11Å; I1624-F1631 HydrophobicContact CD1-CE2 4.44Å; I1624-F1631 HydrophobicContact CD1-CG 4.33Å; I1624-F1631 HydrophobicContact CG1-CD2 4.24Å; I1624-F1631 HydrophobicContact CG1-CE2 4.41Å; I1624-F1631 HydrophobicContact CG2-CB 4.24Å; I1624-F1631 HydrophobicContact CG2-CD1 3.92Å; I1624-F1631 HydrophobicContact CG2-CD2 4.39Å; I1624-F1631 HydrophobicContact CG2-CE1 4.34Å; I1624-F1631 HydrophobicContact CG2-CG 3.99Å; I1624-F1631 VanDerWaalsContact O-CE1 3.27Å; I1624-F1631 WeakPolarHBondContact O-CE1 3.3Å; V1628-F1631 HydrophobicContact CG1-CB 4.3Å; V1628-F1631 HydrophobicContact CG1-CD1 3.92Å; F1631-V1633 HydrophobicContact CD2-CB 4.41Å; F1631-V1633 HydrophobicContact CD2-CG1 4.28Å; F1631-V1633 HydrophobicContact CD2-CG2 3.83Å; F1631-V1633 HydrophobicContact CE2-CG1 4.08Å; F1631-V1633 HydrophobicContact CE2-CG2 4.23Å; F1631-I1666 HydrophobicContact CE2-CG2 4.07Å; F1631-R1667 CarbonylContact O-C 3.51Å; F1631-R1667 WeakPolarHBondContact O-CA 3.43Å; F1631-S1668 WeakPolarHBondContact CD1-OG 3.48Å; F1631-S1668 WeakPolarHBondContact CE1-OG 3.36Å; F1631-S1668 WeakPolarHBondContact CG-OG 3.32Å; F1631-S1668 PolarHBondContact N-O 2.8Å; F1631-S1668 PolarHBondContact N-OG 3.21Å; F1631-S1668 PolarHBondContact O-N 3.16Å
1632	V	64.4	Low	69.2	Low	56.6 Å²	56.6	51.3 Å²	51.3	34%	0.343	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	131.5	169.2	-177.9	0	0	0	0	107.2	A1525 T1526 T1665 I1666 R1667 L1671 D1673	A1525-V1632 CarbonylContact C-O 3.54Å; A1525-V1632 WeakPolarHBondContact CA-O 3.32Å; A1525-V1632 WeakPolarHBondContact CB-O 3.27Å; T1526-V1632 PolarHBondContact N-O 3.1Å; T1526-V1632 PolarHBondContact O-N 3.03Å; V1632-T1665 HydrophobicContact CG1-CG2 4.23Å; V1632-I1666 CarbonylContact C-O 3.58Å; V1632-I1666 WeakPolarHBondContact CA-O 3.41Å; V1632-R1667 HydrophobicContact CB-CG 4.3Å; V1632-R1667 HydrophobicContact CG1-CG 3.97Å; V1632-R1667 HydrophobicContact CG2-CB 4.49Å; V1632-R1667 HydrophobicContact CG2-CG 3.87Å; V1632-L1671 HydrophobicContact CG2-CB 4.33Å; V1632-D1673 HydrophobicContact CG1-CB 4.3Å
1633	V	71.5	Confident	66.9	Low	26 Å²	26	56.3 Å²	56.3	16%	0.158	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	131.6	179	104	0	0	0	0	111.1	L1511 Y1513 I1523 H1524 A1525 V1622 I1624 F1631 T1635 T1665 I1666	L1511-V1633 HydrophobicContact CD1-CG1 4.32Å; Y1513-V1633 PolarHBondContact OH-O 2.86Å; I1523-V1633 HydrophobicContact CG2-CG1 3.71Å; I1523-V1633 HydrophobicContact CG2-CG2 3.6Å; H1524-V1633 CarbonylContact O-C 3.54Å; H1524-V1633 WeakPolarHBondContact O-CA 3.23Å; A1525-V1633 HydrophobicContact CB-CB 4.27Å; A1525-V1633 HydrophobicContact CB-CG1 4.47Å; A1525-V1633 HydrophobicContact CB-CG2 4.02Å; V1622-V1633 HydrophobicContact CB-CG1 4.26Å; V1622-V1633 HydrophobicContact CB-CG2 4.21Å; V1622-V1633 HydrophobicContact CG1-CG1 3.97Å; V1622-V1633 HydrophobicContact CG1-CG2 3.91Å; V1622-V1633 HydrophobicContact CG2-CG1 4.45Å; V1622-V1633 HydrophobicContact CG2-CG2 4.44Å; I1624-V1633 HydrophobicContact CD1-CB 4.09Å; I1624-V1633 HydrophobicContact CD1-CG2 3.91Å; I1624-V1633 VanDerWaalsContact CD1-CG2 3.45Å; I1624-V1633 HydrophobicContact CG1-CG2 3.99Å; F1631-V1633 HydrophobicContact CD2-CB 4.41Å; F1631-V1633 HydrophobicContact CD2-CG1 4.28Å; F1631-V1633 HydrophobicContact CD2-CG2 3.83Å; F1631-V1633 HydrophobicContact CE2-CG1 4.08Å; F1631-V1633 HydrophobicContact CE2-CG2 4.23Å; V1633-T1635 HydrophobicContact CG1-CG2 4.36Å; V1633-T1665 CarbonylContact O-C 3.54Å; V1633-T1665 VanDerWaalsContact O-CA 3.26Å; V1633-T1665 WeakPolarHBondContact O-CA 3.14Å; V1633-I1666 HydrophobicContact CB-CB 4.29Å; V1633-I1666 PolarHBondContact N-O 3.42Å; V1633-I1666 PolarHBondContact O-N 2.8Å
1634	N	67.8	Low	64.7	Low	59.2 Å²	59.2	59.9 Å²	59.9	32%	0.317	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	131.5	176.6	-68.6	-52.3	0	0	0	109.5	I1523 H1524 R1663 R1664 T1665 D1673	I1523-N1634 CarbonylContact C-O 3.5Å; I1523-N1634 VanDerWaalsContact CA-O 3.3Å; I1523-N1634 WeakPolarHBondContact CA-O 3.22Å; H1524-N1634 HydrophobicContact CB-CB 4.38Å; H1524-N1634 PolarHBondContact N-O 2.85Å; H1524-N1634 PolarHBondContact O-N 2.88Å; N1634-R1663 VanDerWaalsContact CG-NH2 3.27Å; N1634-R1663 PolarHBondContact ND2-NH2 2.93Å; N1634-R1663 PolarHBondContact OD1-NE 3.29Å; N1634-R1663 PolarHBondContact OD1-NH2 2.85Å; N1634-R1664 CarbonylContact C-O 3.55Å; N1634-R1664 VanDerWaalsContact CA-O 3.26Å; N1634-R1664 WeakPolarHBondContact CA-O 3.36Å; N1634-T1665 WeakPolarHBondContact OD1-CB 3.43Å; N1634-T1665 VanDerWaalsContact OD1-CG2 3.32Å; N1634-T1665 WeakPolarHBondContact OD1-CG2 3.35Å; N1634-T1665 PolarHBondContact OD1-OG1 2.83Å; N1634-D1673 PolarHBondContact ND2-OD2 2.78Å; N1634-D1673 VanDerWaalsContact ND2-OD2 3.13Å
1635	T	76.4	Confident	62.4	Low	42.6 Å²	42.6	67 Å²	67	26%	0.261	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	136.2	174.3	57.2	0	0	0	0	110.9	K1516 L1522 I1523 A1619 V1622 V1633 R1663 R1664	K1516-T1635 PolarHBondContact NZ-O 2.8Å; L1522-T1635 CarbonylContact O-C 3.5Å; L1522-T1635 WeakPolarHBondContact O-CA 3.27Å; I1523-T1635 HydrophobicContact CG1-CG2 4.26Å; I1523-T1635 HydrophobicContact CG2-CG2 4.29Å; A1619-T1635 HydrophobicContact CB-CG2 4.3Å; V1622-T1635 HydrophobicContact CG2-CG2 3.63Å; V1633-T1635 HydrophobicContact CG1-CG2 4.36Å; T1635-R1663 CarbonylContact O-C 3.54Å; T1635-R1663 VanDerWaalsContact O-CA 3.3Å; T1635-R1663 WeakPolarHBondContact O-CA 3.5Å; T1635-R1664 PolarHBondContact N-O 3.19Å; T1635-R1664 PolarHBondContact O-N 2.96Å; T1635-R1664 WeakPolarHBondContact OG1-CB 3.34Å
1636	L	76.7	Confident	60.2	Low	60.6 Å²	60.6	75.4 Å²	75.4	32%	0.317	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	125.2	172.1	-172.5	70.8	0	0	0	109.5	R1521 L1522 Y1661 R1663 W1686	R1521-L1636 HydrophobicContact CB-CD2 4.32Å; R1521-L1636 HydrophobicContact CB-CG 4.4Å; R1521-L1636 PolarHBondContact N-O 2.94Å; L1522-L1636 HydrophobicContact CB-CB 3.84Å; L1522-L1636 HydrophobicContact CB-CD2 4.45Å; L1522-L1636 PolarHBondContact N-O 2.87Å; L1522-L1636 VanDerWaalsContact N-O 3.11Å; L1522-L1636 PolarHBondContact O-N 3.14Å; L1636-Y1661 HydrophobicContact CD1-CG 4.27Å; L1636-Y1661 HydrophobicContact CD2-CD1 4.02Å; L1636-Y1661 HydrophobicContact CD2-CD2 4.2Å; L1636-Y1661 HydrophobicContact CD2-CG 3.86Å; L1636-Y1661 HydrophobicContact CG-CD1 4.3Å; L1636-Y1661 HydrophobicContact CG-CG 4.06Å; L1636-R1663 HydrophobicContact CD1-CB 4.24Å; L1636-W1686 HydrophobicContact CD1-CZ3 4.42Å
1637	H	80.4	Confident	57.7	Low	21 Å²	21	79.6 Å²	79.6	10%	0.097	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	149	170	-58	74	0	0	0	109.2	K1516 R1517 G1518 P1519 A1619 Y1661 V1662	K1516-H1637 HydrophobicContact CB-CB 3.97Å; R1517-H1637 HydrophobicContact CB-CB 4.05Å; G1518-H1637 PolarHBondContact O-CD2 2.85Å; P1519-H1637 CarbonylContact O-C 3.44Å; P1519-H1637 VanDerWaalsContact O-CA 3.24Å; P1519-H1637 WeakPolarHBondContact O-CA 3.23Å; P1519-H1637 WeakPolarHBondContact O-CB 3.48Å; A1619-H1637 PolarHBondContact N-NE2 3.06Å; A1619-H1637 VanDerWaalsContact N-NE2 3.19Å; A1619-H1637 PolarHBondContact O-CE1 2.92Å; A1619-H1637 VanDerWaalsContact O-CE1 3.29Å; A1619-H1637 PolarHBondContact O-NE2 3.05Å; A1619-H1637 VanDerWaalsContact O-NE2 3.1Å; H1637-Y1661 CarbonylContact O-C 3.5Å; H1637-Y1661 WeakPolarHBondContact O-CA 3.33Å; H1637-V1662 HydrophobicContact CB-CB 4.49Å; H1637-V1662 PolarHBondContact N-O 2.8Å; H1637-V1662 PolarHBondContact O-N 2.51Å
1638	D	67.7	Low	55.2	Low	56 Å²	56	82.2 Å²	82.2	30%	0.299	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	155.6	169.4	-82.4	-38.7	0	0	0	111.2	G1518 P1519 R1521 T1640 P1660 Y1661	G1518-D1638 CarbonylContact C-O 3.59Å; G1518-D1638 WeakPolarHBondContact CA-O 3.46Å; G1518-D1638 PolarHBondContact N-O 3Å; P1519-D1638 HydrophobicContact CG-CB 4.23Å; P1519-D1638 PolarHBondContact O-N 3.21Å; R1521-D1638 WeakPolarHBondContact CD-OD1 3.31Å; R1521-D1638 WeakPolarHBondContact CD-OD2 3.3Å; R1521-D1638 VanDerWaalsContact CG-OD1 3.22Å; R1521-D1638 WeakPolarHBondContact CG-OD1 3.48Å; R1521-D1638 WeakPolarHBondContact CG-OD2 3.2Å; R1521-D1638 VanDerWaalsContact CZ-CG 3.47Å; R1521-D1638 IonicContact CZ-OD1 3.35Å; R1521-D1638 IonicContact CZ-OD2 3.83Å; R1521-D1638 IonicContact NE-OD1 2.84Å; R1521-D1638 PolarHBondContact NE-OD1 3.32Å; R1521-D1638 IonicContact NE-OD2 3.05Å; R1521-D1638 PolarHBondContact NE-OD2 2.8Å; R1521-D1638 IonicContact NH1-OD1 2.88Å; R1521-D1638 PolarHBondContact NH1-OD1 2.74Å; R1521-D1638 VanDerWaalsContact NH2-CG 3.3Å; R1521-D1638 IonicContact NH2-OD1 3.6Å; R1521-D1638 PolarHBondContact NH2-OD1 3.32Å; R1521-D1638 IonicContact NH2-OD2 3.29Å; R1521-D1638 PolarHBondContact NH2-OD2 2.81Å; D1638-T1640 PolarHBondContact O-N 2.9Å; D1638-P1660 CarbonylContact C-O 3.58Å; D1638-Y1661 WeakPolarHBondContact OD1-CE1 3.48Å
1639	R	47.5	Very low	52.9	Low	154.8 Å²	154.8	87.4 Å²	87.4	58%	0.584	51%	0.513	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	99.7	177.8	-174.9	177.4	-177.5	169.4	1.2	109.9	L1641 D1659 P1660 V1662	R1639-L1641 PolarHBondContact O-N 3.14Å; R1639-L1641 VanDerWaalsContact O-N 3.17Å; R1639-D1659 VanDerWaalsContact CD-OD2 3.25Å; R1639-D1659 WeakPolarHBondContact CD-OD2 3.45Å; R1639-D1659 IonicContact CZ-OD2 2.66Å; R1639-D1659 IonicContact NE-OD2 2.6Å; R1639-D1659 PolarHBondContact NH1-O 2.87Å; R1639-D1659 IonicContact NH1-OD1 2.67Å; R1639-D1659 PolarHBondContact NH1-OD1 2.89Å; R1639-D1659 IonicContact NH1-OD2 3.55Å; R1639-D1659 PolarHBondContact NH1-OD2 2.88Å; R1639-P1660 WeakPolarHBondContact CB-O 3.48Å; R1639-P1660 PolarHBondContact N-O 2.83Å; R1639-V1662 HydrophobicContact CB-CG2 4.48Å
1640	T	43.6	Very low	51	Low	73 Å²	73	88.5 Å²	88.5	45%	0.448	53%	0.534	S	S	.	.			trans	-69.5	115	168.5	22.3	0	0	0	0	110	K1516 G1518 D1638	K1516-T1640 PolarHBondContact O-OG1 3.06Å; G1518-T1640 PolarHBondContact N-OG1 3.07Å; D1638-T1640 PolarHBondContact O-N 2.9Å
1641	L	34.5	Very low	49.7	Very low	115.4 Å²	115.4	92.7 Å²	92.7	60%	0.604	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-72.8	145.8	165.8	-68.7	170	0	0	0	109.3	R1639 T1643	R1639-L1641 PolarHBondContact O-N 3.14Å; R1639-L1641 VanDerWaalsContact O-N 3.17Å; L1641-T1643 PolarHBondContact O-N 3.11Å
1642	P	32.8	Very low	47.7	Very low	117.6 Å²	117.6	95.2 Å²	95.2	76%	0.764	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-65.3	122	168.6	-6.2	17.7	0	0	0	109.5	P1644	P1642-P1644 WeakPolarHBondContact O-CD 3.29Å
1643	T	34.1	Very low	46.4	Very low	123 Å²	123	101.3 Å²	101.3	76%	0.755	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-67.1	126.3	170	-32.1	0	0	0	0	108.7	L1641 I1645	L1641-T1643 PolarHBondContact O-N 3.11Å; T1643-I1645 HydrophobicContact CG2-CG1 4.41Å; T1643-I1645 PolarHBondContact O-N 3.13Å
1644	P	33.1	Very low	44.7	Very low	115.8 Å²	115.8	108.6 Å²	108.6	75%	0.752	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-66.5	131.7	172.2	-9.2	20.3	0	0	0	110	P1642 E1646	P1642-P1644 WeakPolarHBondContact O-CD 3.29Å; P1644-E1646 PolarHBondContact O-N 2.96Å
1645	I	35.1	Very low	43.1	Very low	154.6 Å²	154.6	115.3 Å²	115.3	79%	0.793	65%	0.652	S	S	*	*			trans	-96	118.3	169.6	-63.3	175.3	0	0	0	107.6	T1643 A1647	T1643-I1645 HydrophobicContact CG2-CG1 4.41Å; T1643-I1645 PolarHBondContact O-N 3.13Å; I1645-A1647 PolarHBondContact O-N 2.77Å
1646	E	33.6	Very low	41.1	Very low	184.6 Å²	184.6	123.6 Å²	123.6	86%	0.863	68%	0.679	S	S	*	*			trans	23	126.7	162.1	-68.1	169.6	176.6	0	0	116	P1644	P1644-E1646 PolarHBondContact O-N 2.96Å
1647	A	32.6	Very low	39	Very low	103.4 Å²	103.4	132.1 Å²	132.1	86%	0.855	71%	0.707	S	S	*	*			trans	-115.7	133.9	159.9	0	0	0	0	0	111.3	I1645	I1645-A1647 PolarHBondContact O-N 2.77Å
1648	G	31.6	Very low	36.8	Very low	78.2 Å²	78.2	137.5 Å²	137.5	81%	0.806	73%	0.73	S	S	*	*			trans	-168	122.1	171.7	0	0	0	0	0	113.4
1649	S	33.1	Very low	35.1	Very low	125.8 Å²	125.8	139.3 Å²	139.3	88%	0.88	74%	0.74	S	S	*	*			trans	-59.7	129.7	166.3	-169.5	0	0	0	0	115.5
1650	A	33.7	Very low	34.5	Very low	93.2 Å²	93.2	135.6 Å²	135.6	77%	0.77	74%	0.736	S	S	*	*			trans	-164.9	122.9	151.9	0	0	0	0	0	114.8	P1652	A1650-P1652 WeakPolarHBondContact O-CD 3.39Å
1651	D	38.2	Very low	34.3	Very low	122.2 Å²	122.2	138.2 Å²	138.2	65%	0.653	74%	0.738	S	S	*	*			trans	24	116.1	149.5	-163.8	10	0	0	0	116.5	K1653 K1654	D1651-K1653 VanDerWaalsContact C-N 3.34Å; D1651-K1653 PolarHBondContact O-N 3.17Å; D1651-K1653 VanDerWaalsContact O-N 3.15Å; D1651-K1653 VanDerWaalsContact OD1-CB 3.28Å; D1651-K1653 WeakPolarHBondContact OD1-CB 3.27Å; D1651-K1653 PolarHBondContact OD1-N 2.94Å; D1651-K1653 IonicContact OD2-NZ 3.9Å; D1651-K1654 IonicContact OD2-NZ 2.78Å
1652	P	34	Very low	34.4	Very low	116.4 Å²	116.4	136.2 Å²	136.2	76%	0.756	73%	0.731	S	S	*	*			trans	-95	50.4	-171.5	27.1	-19.4	0	0	0	115.4	A1650	A1650-P1652 WeakPolarHBondContact O-CD 3.39Å
1653	K	36.9	Very low	34.6	Very low	183.4 Å²	183.4	137.2 Å²	137.2	80%	0.797	72%	0.719	S	S	*	*			trans	-127.5	53.2	-179.6	-84.6	171.9	-177.9	168.5	0	116.3	D1651	D1651-K1653 VanDerWaalsContact C-N 3.34Å; D1651-K1653 PolarHBondContact O-N 3.17Å; D1651-K1653 VanDerWaalsContact O-N 3.15Å; D1651-K1653 VanDerWaalsContact OD1-CB 3.28Å; D1651-K1653 WeakPolarHBondContact OD1-CB 3.27Å; D1651-K1653 PolarHBondContact OD1-N 2.94Å; D1651-K1653 IonicContact OD2-NZ 3.9Å
1654	K	35.1	Very low	34.8	Very low	180.6 Å²	180.6	136.8 Å²	136.8	79%	0.785	70%	0.704	S	S	*	*	S	Bend	trans	-158.5	120.1	166	-84.1	142.5	-174.7	171.8	0	114.7	D1651 R1656	D1651-K1654 IonicContact OD2-NZ 2.78Å; K1654-R1656 PolarHBondContact O-N 2.77Å
1655	K	34.5	Very low	35.1	Very low	198.4 Å²	198.4	134.5 Å²	134.5	86%	0.863	69%	0.688	S	S	*	*			trans	22.7	100.2	158.4	-68.3	178.3	-179.8	176.9	0	116	R1657	K1655-R1657 PolarHBondContact O-N 2.94Å; K1655-R1657 VanDerWaalsContact O-N 3.15Å
1656	R	33.4	Very low	35.3	Very low	217.6 Å²	217.6	130.9 Å²	130.9	82%	0.821	67%	0.669	S	S	*	*			trans	-58.3	119.2	145.6	-79.8	178.2	164.1	172.1	-4.2	112.1	K1654 K1658 E1691	K1654-R1656 PolarHBondContact O-N 2.77Å; R1656-K1658 VanDerWaalsContact C-N 3.27Å; R1656-K1658 PolarHBondContact O-N 2.88Å; R1656-E1691 IonicContact NH1-OE1 2.72Å; R1656-E1691 PolarHBondContact NH1-OE1 2.84Å; R1656-E1691 IonicContact NH1-OE2 3.39Å
1657	R	33.6	Very low	35.7	Very low	239.6 Å²	239.6	128.2 Å²	128.2	90%	0.904	65%	0.651	S	S	*	*			trans	-75.2	114.3	160	-84.4	-175.1	169.9	177.4	-2.8	112.5	K1655	K1655-R1657 PolarHBondContact O-N 2.94Å; K1655-R1657 VanDerWaalsContact O-N 3.15Å
1658	K	33.4	Very low	35.9	Very low	134.6 Å²	134.6	126.7 Å²	126.7	59%	0.585	64%	0.635	S	S	*	*			trans	-78.3	140	165.7	-75.1	176.8	165.2	179.5	0	112	R1656 P1660 P1685 E1691 K1813 A1814 D1815	R1656-K1658 VanDerWaalsContact C-N 3.27Å; R1656-K1658 PolarHBondContact O-N 2.88Å; K1658-P1660 WeakPolarHBondContact O-CD 3.36Å; K1658-P1685 VanDerWaalsContact NZ-CB 3.33Å; K1658-E1691 WeakPolarHBondContact CE-OE2 3.38Å; K1658-E1691 IonicContact NZ-OE2 2.81Å; K1658-E1691 PolarHBondContact NZ-OE2 2.93Å; K1658-K1813 PolarHBondContact O-NZ 3.05Å; K1658-A1814 PolarHBondContact NZ-O 2.77Å; K1658-D1815 HydrophobicContact CB-CB 4.44Å; K1658-D1815 WeakPolarHBondContact CB-OD1 3.49Å; K1658-D1815 WeakPolarHBondContact CD-OD1 3.37Å; K1658-D1815 WeakPolarHBondContact CD-OD2 3.14Å; K1658-D1815 VanDerWaalsContact CE-CG 3.49Å; K1658-D1815 WeakPolarHBondContact CE-OD1 3.45Å; K1658-D1815 VanDerWaalsContact CE-OD2 3.32Å; K1658-D1815 WeakPolarHBondContact CE-OD2 3.4Å; K1658-D1815 IonicContact NZ-OD1 3.37Å; K1658-D1815 PolarHBondContact NZ-OD1 3.18Å; K1658-D1815 IonicContact NZ-OD2 3.88Å; K1658-D1815 PolarHBondContact NZ-OD2 2.85Å
1659	D	32.9	Very low	36.3	Very low	93.6 Å²	93.6	124.6 Å²	124.6	50%	0.501	61%	0.613	S	S	.	*			trans	-60.9	130.4	158.4	-163.7	-11.3	0	0	0	110.5	R1639 Y1661 W1686 K1813	R1639-D1659 VanDerWaalsContact CD-OD2 3.25Å; R1639-D1659 WeakPolarHBondContact CD-OD2 3.45Å; R1639-D1659 IonicContact CZ-OD2 2.66Å; R1639-D1659 IonicContact NE-OD2 2.6Å; R1639-D1659 PolarHBondContact NH1-O 2.87Å; R1639-D1659 IonicContact NH1-OD1 2.67Å; R1639-D1659 PolarHBondContact NH1-OD1 2.89Å; R1639-D1659 IonicContact NH1-OD2 3.55Å; R1639-D1659 PolarHBondContact NH1-OD2 2.88Å; D1659-Y1661 PolarHBondContact O-N 2.84Å; D1659-Y1661 PolarHBondContact OD1-N 3.07Å; D1659-Y1661 VanDerWaalsContact OD1-N 3.1Å; D1659-W1686 WeakPolarHBondContact OD2-CH2 3.16Å; D1659-W1686 WeakPolarHBondContact OD2-CZ2 3.44Å; D1659-K1813 WeakPolarHBondContact O-CE 3.45Å; D1659-K1813 PolarHBondContact O-NZ 2.87Å
1660	P	35.5	Very low	36.6	Very low	76 Å²	76	124.1 Å²	124.1	49%	0.494	61%	0.606	S	S	.	*			trans	-91.4	16.4	-159.7	34	-32	0	0	0	114	D1638 R1639 K1658 V1662 Y1811	D1638-P1660 CarbonylContact C-O 3.58Å; R1639-P1660 WeakPolarHBondContact CB-O 3.48Å; R1639-P1660 PolarHBondContact N-O 2.83Å; K1658-P1660 WeakPolarHBondContact O-CD 3.36Å; P1660-V1662 PolarHBondContact O-N 2.89Å; P1660-V1662 VanDerWaalsContact O-N 3.08Å; P1660-Y1811 WeakPolarHBondContact O-CD2 3.4Å
1661	Y	37.8	Very low	37.2	Very low	128.4 Å²	128.4	122 Å²	122	50%	0.504	58%	0.582	S	S	.	*			trans	-109.3	70.5	-177	-72.9	-70.7	0	0	0	113.8	R1521 L1636 H1637 D1638 D1659 R1663 E1810 Y1811 K1813	R1521-Y1661 HydrophobicContact CG-CE1 4.46Å; L1636-Y1661 HydrophobicContact CD1-CG 4.27Å; L1636-Y1661 HydrophobicContact CD2-CD1 4.02Å; L1636-Y1661 HydrophobicContact CD2-CD2 4.2Å; L1636-Y1661 HydrophobicContact CD2-CG 3.86Å; L1636-Y1661 HydrophobicContact CG-CD1 4.3Å; L1636-Y1661 HydrophobicContact CG-CG 4.06Å; H1637-Y1661 CarbonylContact O-C 3.5Å; H1637-Y1661 WeakPolarHBondContact O-CA 3.33Å; D1638-Y1661 WeakPolarHBondContact OD1-CE1 3.48Å; D1659-Y1661 PolarHBondContact O-N 2.84Å; D1659-Y1661 PolarHBondContact OD1-N 3.07Å; D1659-Y1661 VanDerWaalsContact OD1-N 3.1Å; Y1661-R1663 PolarHBondContact O-N 2.87Å; Y1661-E1810 HydrophobicContact CD1-CG 4.42Å; Y1661-Y1811 WeakPolarHBondContact CD1-O 3.4Å; Y1661-Y1811 WeakPolarHBondContact CE1-O 3.31Å; Y1661-Y1811 PolarHBondContact O-N 3.05Å; Y1661-K1813 HydrophobicContact CD2-CG 4.33Å; Y1661-K1813 HydrophobicContact CE1-CG 4.14Å; Y1661-K1813 HydrophobicContact CE2-CD 4.16Å; Y1661-K1813 HydrophobicContact CE2-CG 3.88Å; Y1661-K1813 WeakPolarHBondContact OH-CE 3.01Å; Y1661-K1813 PolarHBondContact OH-NZ 2.92Å
1662	V	37.9	Very low	37.4	Very low	73 Å²	73	124.8 Å²	124.8	44%	0.442	59%	0.591	S	S	.	*			trans	-105	102.5	174.5	-176.4	0	0	0	0	110.2	R1517 H1637 R1639 P1660 R1664 T1809	R1517-V1662 HydrophobicContact CG-CG1 4.34Å; H1637-V1662 HydrophobicContact CB-CB 4.49Å; H1637-V1662 PolarHBondContact N-O 2.8Å; H1637-V1662 PolarHBondContact O-N 2.51Å; R1639-V1662 HydrophobicContact CB-CG2 4.48Å; P1660-V1662 PolarHBondContact O-N 2.89Å; P1660-V1662 VanDerWaalsContact O-N 3.08Å; V1662-R1664 HydrophobicContact CG1-CB 4.37Å; V1662-R1664 HydrophobicContact CG1-CG 4.07Å; V1662-R1664 PolarHBondContact O-N 2.88Å; V1662-T1809 VanDerWaalsContact CA-O 3.31Å; V1662-T1809 WeakPolarHBondContact CA-O 3.39Å
1663	R	37	Very low	37.6	Very low	138 Å²	138	125 Å²	125	52%	0.521	59%	0.586	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.9	124.4	164.9	-111.2	-177.9	178.7	173.2	-0.5	109.2	N1634 T1635 L1636 Y1661 W1686 T1809 Y1811	N1634-R1663 VanDerWaalsContact CG-NH2 3.27Å; N1634-R1663 PolarHBondContact ND2-NH2 2.93Å; N1634-R1663 PolarHBondContact OD1-NE 3.29Å; N1634-R1663 PolarHBondContact OD1-NH2 2.85Å; T1635-R1663 CarbonylContact O-C 3.54Å; T1635-R1663 VanDerWaalsContact O-CA 3.3Å; T1635-R1663 WeakPolarHBondContact O-CA 3.5Å; L1636-R1663 HydrophobicContact CD1-CB 4.24Å; Y1661-R1663 PolarHBondContact O-N 2.87Å; R1663-W1686 VanDerWaalsContact NH1-NE1 3.13Å; R1663-T1809 WeakPolarHBondContact CA-O 3.37Å; R1663-T1809 PolarHBondContact N-O 2.99Å; R1663-T1809 PolarHBondContact O-N 2.86Å; R1663-Y1811 HydrophobicContact CG-CE2 4.14Å; R1663-Y1811 PolarHBondContact NH1-OH 3.23Å
1664	R	39	Very low	37.6	Very low	115.2 Å²	115.2	123.2 Å²	123.2	44%	0.435	59%	0.585	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-115.4	115.3	174	-145.4	-179.4	-155.4	-146.9	-0.5	110.2	E1620 N1634 T1635 V1662 I1666 I1807 D1808 T1809	E1620-R1664 PolarHBondContact O-NH1 3.31Å; N1634-R1664 CarbonylContact C-O 3.55Å; N1634-R1664 VanDerWaalsContact CA-O 3.26Å; N1634-R1664 WeakPolarHBondContact CA-O 3.36Å; T1635-R1664 PolarHBondContact N-O 3.19Å; T1635-R1664 PolarHBondContact O-N 2.96Å; T1635-R1664 WeakPolarHBondContact OG1-CB 3.34Å; V1662-R1664 HydrophobicContact CG1-CB 4.37Å; V1662-R1664 HydrophobicContact CG1-CG 4.07Å; V1662-R1664 PolarHBondContact O-N 2.88Å; R1664-I1666 HydrophobicContact CB-CD1 4.41Å; R1664-I1666 HydrophobicContact CB-CG1 4.18Å; R1664-I1666 HydrophobicContact CG-CD1 4.49Å; R1664-I1666 HydrophobicContact CG-CG1 4.29Å; R1664-I1666 PolarHBondContact O-N 2.94Å; R1664-I1807 VanDerWaalsContact CA-O 3.29Å; R1664-I1807 WeakPolarHBondContact CA-O 3.36Å; R1664-D1808 IonicContact CZ-OD1 2.65Å; R1664-D1808 IonicContact CZ-OD2 3.49Å; R1664-D1808 IonicContact NE-OD1 2.75Å; R1664-D1808 PolarHBondContact NE-OD1 2.74Å; R1664-D1808 IonicContact NE-OD2 3.07Å; R1664-D1808 IonicContact NH2-OD1 3.18Å; R1664-D1808 PolarHBondContact NH2-OD1 2.86Å; R1664-D1808 IonicContact NH2-OD2 2.9Å; R1664-D1808 PolarHBondContact NH2-OD2 3.36Å; R1664-T1809 PolarHBondContact N-O 3.02Å; R1664-T1809 PolarHBondContact O-N 2.85Å; R1664-T1809 PolarHBondContact O-OG1 2.96Å; R1664-T1809 VanDerWaalsContact O-OG1 3.12Å
1665	T	38.7	Very low	37.5	Very low	67 Å²	67	117.9 Å²	117.9	41%	0.411	58%	0.582	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.7	128.4	161.6	-59.9	0	0	0	0	108.9	V1632 V1633 N1634 R1667 S1806 I1807 D1808	V1632-T1665 HydrophobicContact CG1-CG2 4.23Å; V1633-T1665 CarbonylContact O-C 3.54Å; V1633-T1665 VanDerWaalsContact O-CA 3.26Å; V1633-T1665 WeakPolarHBondContact O-CA 3.14Å; N1634-T1665 WeakPolarHBondContact OD1-CB 3.43Å; N1634-T1665 VanDerWaalsContact OD1-CG2 3.32Å; N1634-T1665 WeakPolarHBondContact OD1-CG2 3.35Å; N1634-T1665 PolarHBondContact OD1-OG1 2.83Å; T1665-R1667 HydrophobicContact CG2-CG 4.09Å; T1665-R1667 VanDerWaalsContact CG2-N 3.28Å; T1665-S1806 CarbonylContact O-C 3.51Å; T1665-S1806 VanDerWaalsContact O-CA 3.31Å; T1665-S1806 WeakPolarHBondContact O-CA 3.4Å; T1665-I1807 WeakPolarHBondContact CA-O 3.3Å; T1665-I1807 WeakPolarHBondContact CB-O 3.41Å; T1665-I1807 HydrophobicContact CG2-CB 4.07Å; T1665-I1807 WeakPolarHBondContact CG2-O 3.37Å; T1665-I1807 PolarHBondContact N-O 3Å; T1665-I1807 PolarHBondContact O-N 3.06Å; T1665-D1808 PolarHBondContact OG1-OD1 3.12Å
1666	I	38.7	Very low	37.4	Very low	80.6 Å²	80.6	114 Å²	114	41%	0.413	57%	0.571	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.6	109.1	175.4	-59.2	175.8	0	0	0	108.8	V1622 F1631 V1632 V1633 R1664 I1807 T1809	V1622-I1666 HydrophobicContact CB-CD1 4.37Å; F1631-I1666 HydrophobicContact CE2-CG2 4.07Å; V1632-I1666 CarbonylContact C-O 3.58Å; V1632-I1666 WeakPolarHBondContact CA-O 3.41Å; V1633-I1666 HydrophobicContact CB-CB 4.29Å; V1633-I1666 PolarHBondContact N-O 3.42Å; V1633-I1666 PolarHBondContact O-N 2.8Å; R1664-I1666 HydrophobicContact CB-CD1 4.41Å; R1664-I1666 HydrophobicContact CB-CG1 4.18Å; R1664-I1666 HydrophobicContact CG-CD1 4.49Å; R1664-I1666 HydrophobicContact CG-CG1 4.29Å; R1664-I1666 PolarHBondContact O-N 2.94Å; I1666-I1807 PolarHBondContact N-O 2.94Å; I1666-T1809 HydrophobicContact CD1-CG2 3.96Å
1667	R	41.7	Very low	37.3	Very low	126.6 Å²	126.6	110.9 Å²	110.9	48%	0.478	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-137.1	142.2	170.8	-84.4	-172.3	177	-175.8	-1.9	110.5	F1631 V1632 T1665 Y1805	F1631-R1667 CarbonylContact O-C 3.51Å; F1631-R1667 WeakPolarHBondContact O-CA 3.43Å; V1632-R1667 HydrophobicContact CB-CG 4.3Å; V1632-R1667 HydrophobicContact CG1-CG 3.97Å; V1632-R1667 HydrophobicContact CG2-CB 4.49Å; V1632-R1667 HydrophobicContact CG2-CG 3.87Å; T1665-R1667 HydrophobicContact CG2-CG 4.09Å; T1665-R1667 VanDerWaalsContact CG2-N 3.28Å; R1667-Y1805 HydrophobicContact CB-CD1 4.22Å; R1667-Y1805 HydrophobicContact CB-CE1 3.71Å; R1667-Y1805 WeakPolarHBondContact CD-OH 3.28Å; R1667-Y1805 HydrophobicContact CG-CE1 4.4Å; R1667-Y1805 PolarHBondContact N-O 3.3Å; R1667-Y1805 VanDerWaalsContact N-O 3.08Å; R1667-Y1805 PolarHBondContact O-N 3.07Å; R1667-Y1805 VanDerWaalsContact O-N 3.1Å
1668	S	36.7	Very low	37.3	Very low	73.2 Å²	73.2	102 Å²	102	51%	0.512	55%	0.552	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-145.2	131.1	168.5	58.6	0	0	0	0	108.2	A1630 F1631 Y1805	A1630-S1668 WeakPolarHBondContact CA-O 3.46Å; A1630-S1668 VanDerWaalsContact CB-O 3.29Å; A1630-S1668 WeakPolarHBondContact CB-O 3.34Å; F1631-S1668 WeakPolarHBondContact CD1-OG 3.48Å; F1631-S1668 WeakPolarHBondContact CE1-OG 3.36Å; F1631-S1668 WeakPolarHBondContact CG-OG 3.32Å; F1631-S1668 PolarHBondContact N-O 2.8Å; F1631-S1668 PolarHBondContact N-OG 3.21Å; F1631-S1668 PolarHBondContact O-N 3.16Å; S1668-Y1805 WeakPolarHBondContact CA-O 3.37Å
1669	G	40.5	Very low	37.1	Very low	33.8 Å²	33.8	105.9 Å²	105.9	35%	0.348	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	161.6	165.9	-177.8	0	0	0	0	0	111.9	L1671	G1669-L1671 PolarHBondContact O-N 3.04Å
1670	P	40.4	Very low	37.1	Very low	114.4 Å²	114.4	109.2 Å²	109.2	74%	0.743	57%	0.57	S	S	*	*			trans	-68.5	130.5	171.6	13.7	-9.5	0	0	0	110.7	E1672	P1670-E1672 PolarHBondContact O-N 3.01Å
1671	L	46.2	Very low	36.9	Very low	50.2 Å²	50.2	110.8 Å²	110.8	26%	0.263	58%	0.58	S	S	.	*			trans	-81.8	115.6	164.5	-92.5	125.6	0	0	0	108.2	T1526 Q1528 A1630 V1632 G1669 D1673 K1706 V1802 Y1805	T1526-L1671 HydrophobicContact CG2-CD2 3.78Å; Q1528-L1671 HydrophobicContact CB-CD1 3.57Å; Q1528-L1671 HydrophobicContact CB-CD2 4.25Å; Q1528-L1671 HydrophobicContact CG-CD1 4.15Å; A1630-L1671 HydrophobicContact CB-CB 4.01Å; A1630-L1671 HydrophobicContact CB-CD1 4.15Å; V1632-L1671 HydrophobicContact CG2-CB 4.33Å; G1669-L1671 PolarHBondContact O-N 3.04Å; L1671-D1673 PolarHBondContact O-N 2.9Å; L1671-K1706 PolarHBondContact O-NZ 2.96Å; L1671-V1802 HydrophobicContact CD1-CB 3.7Å; L1671-V1802 HydrophobicContact CD1-CG1 3.92Å; L1671-Y1805 HydrophobicContact CD1-CD1 4.36Å; L1671-Y1805 HydrophobicContact CD1-CE1 4.34Å; L1671-Y1805 HydrophobicContact CD2-CE1 4.43Å; L1671-Y1805 HydrophobicContact CG-CE1 4.33Å
1672	E	41.6	Very low	36.5	Very low	179.4 Å²	179.4	112.2 Å²	112.2	84%	0.838	59%	0.591	S	S	*	*			trans	-69.6	135	169.7	-69.8	177	157.2	0	0	109	P1670 D1674	P1670-E1672 PolarHBondContact O-N 3.01Å; E1672-D1674 VanDerWaalsContact C-N 3.28Å; E1672-D1674 PolarHBondContact O-N 2.94Å; E1672-D1674 VanDerWaalsContact O-N 3.12Å
1673	D	37.7	Very low	36.1	Very low	122 Å²	122	114.8 Å²	114.8	65%	0.652	60%	0.597	S	S	*	*			trans	-91.3	63.8	-169.1	-151.7	2	0	0	0	109.8	V1632 N1634 L1671 G1675 K1706	V1632-D1673 HydrophobicContact CG1-CB 4.3Å; N1634-D1673 PolarHBondContact ND2-OD2 2.78Å; N1634-D1673 VanDerWaalsContact ND2-OD2 3.13Å; L1671-D1673 PolarHBondContact O-N 2.9Å; D1673-G1675 PolarHBondContact O-N 2.87Å; D1673-G1675 PolarHBondContact OD1-N 2.97Å; D1673-K1706 VanDerWaalsContact CG-NZ 3.31Å; D1673-K1706 IonicContact OD1-NZ 3.21Å; D1673-K1706 PolarHBondContact OD1-NZ 2.94Å; D1673-K1706 IonicContact OD2-NZ 3.35Å; D1673-K1706 PolarHBondContact OD2-NZ 3.11Å
1674	D	36.4	Very low	35.7	Very low	144.6 Å²	144.6	112.6 Å²	112.6	77%	0.773	60%	0.603	S	S	*	*			trans	-94.8	101.8	-175.3	-161	-2.9	0	0	0	112	N1589 E1672 D1676	N1589-D1674 PolarHBondContact ND2-OD1 2.87Å; E1672-D1674 VanDerWaalsContact C-N 3.28Å; E1672-D1674 PolarHBondContact O-N 2.94Å; E1672-D1674 VanDerWaalsContact O-N 3.12Å; D1674-D1676 VanDerWaalsContact C-N 3.33Å; D1674-D1676 PolarHBondContact O-N 3.1Å
1675	G	33.8	Very low	35.1	Very low	69.8 Å²	69.8	111.2 Å²	111.2	72%	0.72	61%	0.609	S	S	*	*			trans	-77.5	46.2	-173.1	0	0	0	0	0	116.3	D1673 L1677	D1673-G1675 PolarHBondContact O-N 2.87Å; D1673-G1675 PolarHBondContact OD1-N 2.97Å; G1675-L1677 PolarHBondContact O-N 2.8Å
1676	D	32	Very low	34.8	Very low	116.6 Å²	116.6	113.8 Å²	113.8	62%	0.624	61%	0.611	S	S	*	*			trans	-107.8	114.8	173	-169.5	11.6	0	0	0	112.4	D1674 G1678 R1679	D1674-D1676 VanDerWaalsContact C-N 3.33Å; D1674-D1676 PolarHBondContact O-N 3.1Å; D1676-G1678 VanDerWaalsContact C-N 3.32Å; D1676-G1678 PolarHBondContact O-N 3.01Å; D1676-G1678 VanDerWaalsContact O-N 3.14Å; D1676-G1678 PolarHBondContact OD1-N 2.87Å; D1676-R1679 PolarHBondContact O-N 3.35Å; D1676-R1679 WeakPolarHBondContact OD2-CG 3.08Å; D1676-R1679 IonicContact OD2-NE 3.31Å; D1676-R1679 PolarHBondContact OD2-NE 2.92Å
1677	L	31.9	Very low	34.3	Very low	151.8 Å²	151.8	114.3 Å²	114.3	80%	0.795	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	18.2	-179.4	-71.3	170.5	0	0	0	112.1	G1675 R1679 Y1680 F1683	G1675-L1677 PolarHBondContact O-N 2.8Å; L1677-R1679 PolarHBondContact O-N 2.83Å; L1677-R1679 VanDerWaalsContact O-N 3.09Å; L1677-Y1680 PolarHBondContact O-N 2.77Å; L1677-F1683 HydrophobicContact CB-CB 4.03Å; L1677-F1683 HydrophobicContact CB-CD1 4.35Å; L1677-F1683 HydrophobicContact CB-CG 4.12Å; L1677-F1683 HydrophobicContact CD1-CD1 4.09Å; L1677-F1683 HydrophobicContact CD1-CE1 4.13Å; L1677-F1683 HydrophobicContact CD2-CD1 4.4Å; L1677-F1683 HydrophobicContact CD2-CD2 4.07Å; L1677-F1683 HydrophobicContact CD2-CE1 4.35Å; L1677-F1683 HydrophobicContact CD2-CE2 3.98Å; L1677-F1683 HydrophobicContact CD2-CG 4.26Å; L1677-F1683 HydrophobicContact CD2-CZ 4.13Å; L1677-F1683 WeakPolarHBondContact O-CB 3.24Å
1678	G	32.8	Very low	33.6	Very low	52.4 Å²	52.4	115.7 Å²	115.7	54%	0.54	64%	0.639	S	S	.	*	T	Hydrogen-bonded Turn	trans	-109.8	-22.6	-174.1	0	0	0	0	0	117.6	D1676 S1684	D1676-G1678 VanDerWaalsContact C-N 3.32Å; D1676-G1678 PolarHBondContact O-N 3.01Å; D1676-G1678 VanDerWaalsContact O-N 3.14Å; D1676-G1678 PolarHBondContact OD1-N 2.87Å; G1678-S1684 PolarHBondContact O-OG 2.74Å
1679	R	30.1	Very low	33.2	Very low	217 Å²	217	117.3 Å²	117.3	82%	0.819	65%	0.65	S	S	*	*			trans	-120.9	95	-170.4	-69	-173.4	177.2	-160.8	-1.9	115	D1676 L1677	D1676-R1679 PolarHBondContact O-N 3.35Å; D1676-R1679 WeakPolarHBondContact OD2-CG 3.08Å; D1676-R1679 IonicContact OD2-NE 3.31Å; D1676-R1679 PolarHBondContact OD2-NE 2.92Å; L1677-R1679 PolarHBondContact O-N 2.83Å; L1677-R1679 VanDerWaalsContact O-N 3.09Å
1680	Y	32.5	Very low	32.6	Very low	162.8 Å²	162.8	119.6 Å²	119.6	64%	0.638	67%	0.674	S	S	*	*			trans	-84.8	128.9	164.4	-79.5	-89	0	0	0	109.8	L1591 L1677 E1682 F1683 S1684 R1713	L1591-Y1680 HydrophobicContact CD2-CD1 4.44Å; L1591-Y1680 HydrophobicContact CD2-CE1 3.85Å; L1677-Y1680 PolarHBondContact O-N 2.77Å; Y1680-E1682 VanDerWaalsContact C-N 3.32Å; Y1680-E1682 PolarHBondContact O-N 3.2Å; Y1680-F1683 WeakPolarHBondContact O-CA 3.4Å; Y1680-F1683 PolarHBondContact O-N 2.82Å; Y1680-S1684 PolarHBondContact O-N 2.82Å; Y1680-S1684 PolarHBondContact O-OG 3.21Å; Y1680-R1713 PolarHBondContact OH-NH2 3.48Å
1681	P	30.7	Very low	32.2	Very low	109.2 Å²	109.2	121.4 Å²	121.4	71%	0.709	67%	0.672	S	S	*	*			trans	-66.7	103.4	172.3	-1.5	7	0	0	0	111.3	F1683 S1684	P1681-F1683 VanDerWaalsContact C-N 3.34Å; P1681-F1683 HydrophobicContact CB-CD2 4.24Å; P1681-F1683 HydrophobicContact CB-CE2 3.98Å; P1681-F1683 HydrophobicContact CG-CD2 4.48Å; P1681-F1683 HydrophobicContact CG-CE2 4.32Å; P1681-F1683 PolarHBondContact O-N 3.01Å; P1681-F1683 VanDerWaalsContact O-N 3.11Å; P1681-S1684 WeakPolarHBondContact CA-OG 3.4Å; P1681-S1684 PolarHBondContact O-N 2.82Å
1682	E	29.9	Very low	31.6	Very low	158.6 Å²	158.6	125.4 Å²	125.4	74%	0.741	70%	0.699	S	S	*	*			trans	-65.4	88.5	-174.9	-79.1	-179.9	150.2	0	0	113	L1522 K1593 Y1680 S1684	L1522-E1682 WeakPolarHBondContact CD1-OE2 3.39Å; K1593-E1682 WeakPolarHBondContact CE-OE1 3.42Å; K1593-E1682 IonicContact NZ-OE1 2.78Å; K1593-E1682 PolarHBondContact NZ-OE1 3.25Å; Y1680-E1682 VanDerWaalsContact C-N 3.32Å; Y1680-E1682 PolarHBondContact O-N 3.2Å; E1682-S1684 PolarHBondContact O-N 3.45Å
1683	F	29	Very low	31.9	Very low	127.6 Å²	127.6	122.9 Å²	122.9	56%	0.56	68%	0.682	S	S	*	*			trans	-119	66.9	168.3	-88.7	-77	0	0	0	111.4	L1522 L1677 Y1680 P1681 P1685 W1686	L1522-F1683 HydrophobicContact CD2-CE2 3.33Å; L1522-F1683 HydrophobicContact CD2-CZ 3.4Å; L1677-F1683 HydrophobicContact CB-CB 4.03Å; L1677-F1683 HydrophobicContact CB-CD1 4.35Å; L1677-F1683 HydrophobicContact CB-CG 4.12Å; L1677-F1683 HydrophobicContact CD1-CD1 4.09Å; L1677-F1683 HydrophobicContact CD1-CE1 4.13Å; L1677-F1683 HydrophobicContact CD2-CD1 4.4Å; L1677-F1683 HydrophobicContact CD2-CD2 4.07Å; L1677-F1683 HydrophobicContact CD2-CE1 4.35Å; L1677-F1683 HydrophobicContact CD2-CE2 3.98Å; L1677-F1683 HydrophobicContact CD2-CG 4.26Å; L1677-F1683 HydrophobicContact CD2-CZ 4.13Å; L1677-F1683 WeakPolarHBondContact O-CB 3.24Å; Y1680-F1683 WeakPolarHBondContact O-CA 3.4Å; Y1680-F1683 PolarHBondContact O-N 2.82Å; P1681-F1683 VanDerWaalsContact C-N 3.34Å; P1681-F1683 HydrophobicContact CB-CD2 4.24Å; P1681-F1683 HydrophobicContact CB-CE2 3.98Å; P1681-F1683 HydrophobicContact CG-CD2 4.48Å; P1681-F1683 HydrophobicContact CG-CE2 4.32Å; P1681-F1683 PolarHBondContact O-N 3.01Å; P1681-F1683 VanDerWaalsContact O-N 3.11Å; F1683-P1685 VanDerWaalsContact C-CD 3.48Å; F1683-P1685 VanDerWaalsContact C-N 3.28Å; F1683-P1685 VanDerWaalsContact O-CD 3.28Å; F1683-P1685 WeakPolarHBondContact O-CD 3.35Å; F1683-P1685 VanDerWaalsContact O-N 3.14Å; F1683-W1686 PolarHBondContact O-N 2.86Å
1684	S	28.7	Very low	32.8	Very low	91.8 Å²	91.8	121.5 Å²	121.5	64%	0.642	67%	0.672	S	S	*	*			trans	-67.2	108.4	173.1	-95.6	0	0	0	0	111.9	G1678 Y1680 P1681 E1682 W1686 S1687	G1678-S1684 PolarHBondContact O-OG 2.74Å; Y1680-S1684 PolarHBondContact O-N 2.82Å; Y1680-S1684 PolarHBondContact O-OG 3.21Å; P1681-S1684 WeakPolarHBondContact CA-OG 3.4Å; P1681-S1684 PolarHBondContact O-N 2.82Å; E1682-S1684 PolarHBondContact O-N 3.45Å; S1684-W1686 PolarHBondContact O-N 3Å; S1684-W1686 PolarHBondContact OG-N 2.85Å; S1684-S1687 PolarHBondContact O-OG 2.75Å
1685	P	28	Very low	34.4	Very low	86.4 Å²	86.4	116.4 Å²	116.4	56%	0.561	65%	0.645	S	S	*	*			trans	-76.5	44.6	171.5	14.6	-8.6	0	0	0	112.3	K1658 F1683 S1687	K1658-P1685 VanDerWaalsContact NZ-CB 3.33Å; F1683-P1685 VanDerWaalsContact C-CD 3.48Å; F1683-P1685 VanDerWaalsContact C-N 3.28Å; F1683-P1685 VanDerWaalsContact O-CD 3.28Å; F1683-P1685 WeakPolarHBondContact O-CD 3.35Å; F1683-P1685 VanDerWaalsContact O-N 3.14Å; P1685-S1687 PolarHBondContact O-N 3.43Å
1686	W	32	Very low	36.5	Very low	120.6 Å²	120.6	113.1 Å²	113.1	46%	0.457	61%	0.611	S	S	.	*			trans	-128.9	58.6	-175.2	-79.6	-36.1	0	0	0	114.1	L1636 D1659 R1663 F1683 S1684 N1688 R1693 E1794 T1795	L1636-W1686 HydrophobicContact CD1-CZ3 4.42Å; D1659-W1686 WeakPolarHBondContact OD2-CH2 3.16Å; D1659-W1686 WeakPolarHBondContact OD2-CZ2 3.44Å; R1663-W1686 VanDerWaalsContact NH1-NE1 3.13Å; F1683-W1686 PolarHBondContact O-N 2.86Å; S1684-W1686 PolarHBondContact O-N 3Å; S1684-W1686 PolarHBondContact OG-N 2.85Å; W1686-N1688 PolarHBondContact O-N 2.86Å; W1686-N1688 VanDerWaalsContact O-N 3.16Å; W1686-R1693 VanDerWaalsContact CD1-NH1 3.31Å; W1686-R1693 VanDerWaalsContact CD1-NH2 3.27Å; W1686-R1693 VanDerWaalsContact CE3-NH1 3.34Å; W1686-R1693 VanDerWaalsContact CG-NH1 3.26Å; W1686-E1794 WeakPolarHBondContact CH2-O 3.48Å; W1686-E1794 VanDerWaalsContact CZ3-O 3.29Å; W1686-E1794 WeakPolarHBondContact CZ3-O 3.13Å; W1686-T1795 HydrophobicContact CH2-CG2 4.23Å; W1686-T1795 HydrophobicContact CZ3-CG2 3.98Å
1687	S	27.1	Very low	38.9	Very low	90.8 Å²	90.8	112.5 Å²	112.5	64%	0.635	60%	0.602	S	S	*	*			trans	-79.5	139.9	162.4	49.9	0	0	0	0	111.4	S1684 P1685 S1689	S1684-S1687 PolarHBondContact O-OG 2.75Å; P1685-S1687 PolarHBondContact O-N 3.43Å; S1687-S1689 PolarHBondContact O-N 3Å; S1687-S1689 VanDerWaalsContact O-N 3.15Å
1688	N	27.2	Very low	41.4	Very low	157.4 Å²	157.4	106.6 Å²	106.6	84%	0.842	57%	0.573	S	S	*	*			trans	57.5	109.3	173.1	-60.6	-13.7	0	0	0	117.1	W1686 G1690	W1686-N1688 PolarHBondContact O-N 2.86Å; W1686-N1688 VanDerWaalsContact O-N 3.16Å; N1688-G1690 PolarHBondContact O-N 2.96Å
1689	S	28.1	Very low	43.9	Very low	105.8 Å²	105.8	104.1 Å²	104.1	74%	0.74	55%	0.547	S	S	*	.			trans	-131.7	125.9	148	55.9	0	0	0	0	116.1	S1687 E1691	S1687-S1689 PolarHBondContact O-N 3Å; S1687-S1689 VanDerWaalsContact O-N 3.15Å; S1689-E1691 PolarHBondContact O-N 3.36Å
1690	G	29.3	Very low	46.5	Very low	83.4 Å²	83.4	94.9 Å²	94.9	86%	0.86	52%	0.515	S	S	*	.			trans	80.1	-27.4	146.7	0	0	0	0	0	118.4	N1688 T1692	N1688-G1690 PolarHBondContact O-N 2.96Å; G1690-T1692 PolarHBondContact O-N 3.38Å; G1690-T1692 VanDerWaalsContact O-N 3.16Å
1691	E	32.1	Very low	48.9	Very low	151.6 Å²	151.6	87.2 Å²	87.2	71%	0.708	49%	0.485	S	S	*	.			trans	-106.1	133	-172.6	-75.6	-177.3	141.3	0	0	113.2	R1656 K1658 S1689 R1693	R1656-E1691 IonicContact NH1-OE1 2.72Å; R1656-E1691 PolarHBondContact NH1-OE1 2.84Å; R1656-E1691 IonicContact NH1-OE2 3.39Å; K1658-E1691 WeakPolarHBondContact CE-OE2 3.38Å; K1658-E1691 IonicContact NZ-OE2 2.81Å; K1658-E1691 PolarHBondContact NZ-OE2 2.93Å; S1689-E1691 PolarHBondContact O-N 3.36Å; E1691-R1693 WeakPolarHBondContact O-CG 3.4Å; E1691-R1693 PolarHBondContact O-N 2.94Å
1692	T	32.9	Very low	51.3	Low	133.2 Å²	133.2	83.2 Å²	83.2	82%	0.817	46%	0.458	S	S	*	.			trans	-48.8	100.5	177	-38.1	0	0	0	0	113.3	G1690 M1694	G1690-T1692 PolarHBondContact O-N 3.38Å; G1690-T1692 VanDerWaalsContact O-N 3.16Å; T1692-M1694 PolarHBondContact O-N 3.15Å
1693	R	46.7	Very low	53.7	Low	127.6 Å²	127.6	75.6 Å²	75.6	48%	0.482	42%	0.422	S	S	.	.			trans	-79.5	109.2	178	-73.5	-171.7	177.5	169.3	4.5	111.7	W1686 E1691 L1793 E1794	W1686-R1693 VanDerWaalsContact CD1-NH1 3.31Å; W1686-R1693 VanDerWaalsContact CD1-NH2 3.27Å; W1686-R1693 VanDerWaalsContact CE3-NH1 3.34Å; W1686-R1693 VanDerWaalsContact CG-NH1 3.26Å; E1691-R1693 WeakPolarHBondContact O-CG 3.4Å; E1691-R1693 PolarHBondContact O-N 2.94Å; R1693-L1793 WeakPolarHBondContact CD-O 3.16Å; R1693-L1793 PolarHBondContact NH1-O 3.18Å; R1693-E1794 PolarHBondContact NH1-O 3.09Å
1694	M	56.7	Low	56	Low	93.2 Å²	93.2	70.3 Å²	70.3	46%	0.459	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-60.5	149.8	166.2	-66.5	169.9	73	0	0	111	T1692 Y1811 P1812	T1692-M1694 PolarHBondContact O-N 3.15Å; M1694-Y1811 WeakPolarHBondContact O-CE1 3.34Å; M1694-P1812 HydrophobicContact CB-CG 4.19Å; M1694-P1812 HydrophobicContact CE-CB 3.82Å; M1694-P1812 HydrophobicContact CE-CG 3.82Å; M1694-P1812 HydrophobicContact SD-CG 3.86Å
1695	L	70.7	Confident	58.4	Low	36.4 Å²	36.4	66.5 Å²	66.5	19%	0.191	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-62.5	144.5	166.6	-73.7	167.4	0	0	0	110.5	M1718 I1768 L1788 N1791 L1793 P1812	L1695-M1718 HydrophobicContact CD2-CE 3.68Å; L1695-M1718 VanDerWaalsContact CD2-CE 3.46Å; L1695-I1768 HydrophobicContact CB-CG2 4.08Å; L1695-I1768 HydrophobicContact CD1-CG2 4Å; L1695-I1768 HydrophobicContact CD2-CD1 4.44Å; L1695-I1768 HydrophobicContact CG-CG2 4.35Å; L1695-L1788 HydrophobicContact CD1-CD1 3.8Å; L1695-L1788 HydrophobicContact CD2-CD1 4.38Å; L1695-N1791 WeakPolarHBondContact CD2-O 3.31Å; L1695-N1791 WeakPolarHBondContact CG-O 3.4Å; L1695-L1793 HydrophobicContact CD2-CB 4.39Å; L1695-P1812 VanDerWaalsContact O-CD 3.25Å; L1695-P1812 WeakPolarHBondContact O-CD 3.32Å
1696	P	78.7	Confident	60.8	Low	0.8 Å²	0.8	65.5 Å²	65.5	1%	0.005	36%	0.361	C	S	.	.	P	Polyproline II helix	trans	-66.8	146.1	167.2	29.5	-32	0	0	0	109.8	T1698 A1699 I1768 L1793 E1810 Y1811	P1696-T1698 VanDerWaalsContact C-N 3.34Å; P1696-A1699 HydrophobicContact CG-CB 4.48Å; P1696-I1768 HydrophobicContact CG-CD1 4.29Å; P1696-I1768 VanDerWaalsContact O-CB 3.3Å; P1696-I1768 WeakPolarHBondContact O-CB 3.44Å; P1696-I1768 WeakPolarHBondContact O-CD1 3.48Å; P1696-L1793 HydrophobicContact CG-CB 4.37Å; P1696-L1793 HydrophobicContact CG-CD2 3.7Å; P1696-E1810 CarbonylContact C-O 3.56Å; P1696-E1810 VanDerWaalsContact C-O 3.29Å; P1696-E1810 VanDerWaalsContact CA-O 3.26Å; P1696-E1810 WeakPolarHBondContact CA-O 3.25Å; P1696-E1810 VanDerWaalsContact CB-O 3.28Å; P1696-E1810 WeakPolarHBondContact CB-O 3.37Å; P1696-Y1811 HydrophobicContact CB-CD1 3.95Å; P1696-Y1811 HydrophobicContact CB-CD2 4.35Å; P1696-Y1811 HydrophobicContact CB-CE1 3.83Å; P1696-Y1811 HydrophobicContact CB-CE2 4.23Å; P1696-Y1811 HydrophobicContact CB-CG 4.21Å; P1696-Y1811 HydrophobicContact CG-CE1 4.23Å
1697	K	82.1	Confident	62.7	Low	103.2 Å²	103.2	69.2 Å²	69.2	45%	0.449	38%	0.381	S	S	.	.	S	Bend	trans	-68.1	-37.6	173.3	-174.1	179	-176.7	172.4	0	111.4	I1768 E1810 P1812	K1697-I1768 PolarHBondContact O-N 2.85Å; K1697-E1810 PolarHBondContact N-O 2.95Å; K1697-P1812 HydrophobicContact CB-CG 4.21Å
1698	T	84.7	Confident	65	Low	28.6 Å²	28.6	71.9 Å²	71.9	18%	0.175	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	142.1	171.6	66.5	0	0	0	0	111.1	P1696 T1765 F1766 T1767 T1809 E1810	P1696-T1698 VanDerWaalsContact C-N 3.34Å; T1698-T1765 HydrophobicContact CG2-CG2 4.32Å; T1698-F1766 VanDerWaalsContact CA-O 3.31Å; T1698-F1766 WeakPolarHBondContact CA-O 3.4Å; T1698-T1767 HydrophobicContact CG2-CG2 4.33Å; T1698-T1809 WeakPolarHBondContact O-CA 3.38Å; T1698-E1810 PolarHBondContact N-O 2.91Å; T1698-E1810 PolarHBondContact O-N 3.11Å; T1698-E1810 VanDerWaalsContact OG1-CB 3.32Å; T1698-E1810 WeakPolarHBondContact OG1-CB 3.29Å; T1698-E1810 PolarHBondContact OG1-OE2 2.9Å; T1698-E1810 VanDerWaalsContact OG1-OE2 3.1Å
1699	A	84.6	Confident	67.5	Low	0.6 Å²	0.6	65.5 Å²	65.5	1%	0.005	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	123	164.4	0	0	0	0	0	108.4	P1696 L1716 F1766 I1796 D1808 T1809	P1696-A1699 HydrophobicContact CG-CB 4.48Å; A1699-L1716 HydrophobicContact CB-CD2 4.43Å; A1699-F1766 HydrophobicContact CB-CB 4.45Å; A1699-F1766 PolarHBondContact N-O 3.03Å; A1699-F1766 WeakPolarHBondContact O-CB 3.32Å; A1699-F1766 WeakPolarHBondContact O-CD2 3.23Å; A1699-F1766 PolarHBondContact O-N 2.89Å; A1699-I1796 HydrophobicContact CB-CD1 3.78Å; A1699-D1808 CarbonylContact C-O 3.11Å; A1699-D1808 WeakPolarHBondContact CA-O 3.31Å; A1699-T1809 HydrophobicContact CB-CG2 4.07Å
1700	T	84.7	Confident	70.1	Confident	22.4 Å²	22.4	68.8 Å²	68.8	14%	0.137	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	125.1	179.5	-59.9	0	0	0	0	110.3	N1702 P1763 L1764 T1765 I1807 D1808	T1700-N1702 WeakPolarHBondContact CG2-OD1 3.43Å; T1700-P1763 HydrophobicContact CG2-CB 4.33Å; T1700-L1764 CarbonylContact C-O 3.53Å; T1700-L1764 VanDerWaalsContact CA-O 3.3Å; T1700-L1764 WeakPolarHBondContact CA-O 3.36Å; T1700-T1765 VanDerWaalsContact CG2-OG1 3.31Å; T1700-T1765 WeakPolarHBondContact CG2-OG1 3.39Å; T1700-T1765 WeakPolarHBondContact OG1-CB 3.3Å; T1700-T1765 WeakPolarHBondContact OG1-CG2 3.34Å; T1700-T1765 PolarHBondContact OG1-OG1 3.05Å; T1700-I1807 CarbonylContact O-C 3.5Å; T1700-I1807 VanDerWaalsContact O-CA 3.25Å; T1700-I1807 WeakPolarHBondContact O-CA 3.44Å; T1700-D1808 PolarHBondContact N-O 3.18Å; T1700-D1808 PolarHBondContact O-N 2.88Å
1701	A	83.1	Confident	72.8	Confident	2 Å²	2	65.5 Å²	65.5	2%	0.017	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	116.4	168.1	0	0	0	0	0	109.1	I1703 V1714 L1764 V1798 S1806 I1807	A1701-I1703 HydrophobicContact CB-CD1 4.35Å; A1701-I1703 HydrophobicContact CB-CG1 4.29Å; A1701-V1714 HydrophobicContact CB-CG1 4.44Å; A1701-L1764 HydrophobicContact CB-CB 4.42Å; A1701-L1764 PolarHBondContact N-O 2.9Å; A1701-L1764 WeakPolarHBondContact O-CB 3.37Å; A1701-L1764 PolarHBondContact O-N 2.97Å; A1701-V1798 HydrophobicContact CB-CG2 4.46Å; A1701-S1806 CarbonylContact C-O 3.59Å; A1701-S1806 WeakPolarHBondContact CA-O 3.35Å; A1701-I1807 HydrophobicContact CB-CD1 3.45Å; A1701-I1807 VanDerWaalsContact CB-CD1 3.45Å
1702	N	80.8	Confident	75.6	Confident	24.2 Å²	24.2	58.6 Å²	58.6	13%	0.129	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	119	171.1	-50.2	-71	0	0	0	107.9	T1700 N1761 P1763 Y1805 S1806 D1808	T1700-N1702 WeakPolarHBondContact CG2-OD1 3.43Å; N1702-N1761 WeakPolarHBondContact CB-OD1 3.14Å; N1702-P1763 WeakPolarHBondContact OD1-CB 3.42Å; N1702-Y1805 CarbonylContact O-C 3.53Å; N1702-Y1805 VanDerWaalsContact O-CA 3.25Å; N1702-Y1805 WeakPolarHBondContact O-CA 3.38Å; N1702-Y1805 WeakPolarHBondContact O-CB 3.33Å; N1702-S1806 PolarHBondContact N-O 3Å; N1702-S1806 PolarHBondContact ND2-OG 3.05Å; N1702-S1806 VanDerWaalsContact ND2-OG 3.08Å; N1702-S1806 PolarHBondContact O-N 2.99Å; N1702-D1808 PolarHBondContact ND2-OD2 2.99Å
1703	I	80	Confident	78.4	Confident	0.2 Å²	0.2	56 Å²	56	0%	0.001	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	124.9	-169.9	-57.3	-175.8	0	0	0	111	A1701 L1705 F1712 V1714 N1761 I1762 L1764 V1798 V1802	A1701-I1703 HydrophobicContact CB-CD1 4.35Å; A1701-I1703 HydrophobicContact CB-CG1 4.29Å; I1703-L1705 HydrophobicContact CG2-CD2 3.67Å; I1703-L1705 HydrophobicContact CG2-CG 4.41Å; I1703-F1712 HydrophobicContact CD1-CD2 3.82Å; I1703-F1712 HydrophobicContact CD1-CE2 3.7Å; I1703-F1712 HydrophobicContact CD1-CZ 4.45Å; I1703-V1714 HydrophobicContact CD1-CG2 3.61Å; I1703-V1714 VanDerWaalsContact CD1-CG2 3.5Å; I1703-N1761 CarbonylContact O-C 3.53Å; I1703-N1761 WeakPolarHBondContact O-CA 3.38Å; I1703-I1762 HydrophobicContact CB-CB 4.5Å; I1703-I1762 PolarHBondContact N-O 3.09Å; I1703-I1762 PolarHBondContact O-N 2.96Å; I1703-L1764 HydrophobicContact CD1-CD1 3.62Å; I1703-L1764 HydrophobicContact CD1-CG 4.42Å; I1703-L1764 HydrophobicContact CG1-CD1 4.38Å; I1703-V1798 HydrophobicContact CD1-CG1 3.83Å; I1703-V1798 HydrophobicContact CD1-CG2 4.33Å; I1703-V1798 HydrophobicContact CG1-CG1 4.27Å; I1703-V1798 HydrophobicContact CG2-CG1 4.31Å; I1703-V1802 HydrophobicContact CG2-CB 4.39Å; I1703-V1802 HydrophobicContact CG2-CG1 3.9Å; I1703-V1802 HydrophobicContact CG2-CG2 3.7Å
1704	A	77.2	Confident	80.5	Confident	15.4 Å²	15.4	49.9 Å²	49.9	13%	0.127	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	132.3	167.2	0	0	0	0	0	109.6	N1760 V1802 D1803 S1804	A1704-N1760 WeakPolarHBondContact CA-O 3.29Å; A1704-N1760 VanDerWaalsContact CB-O 3.31Å; A1704-N1760 WeakPolarHBondContact CB-O 3.37Å; A1704-V1802 CarbonylContact O-C 3.53Å; A1704-V1802 WeakPolarHBondContact O-CG1 3.44Å; A1704-D1803 PolarHBondContact O-N 3.06Å; A1704-S1804 PolarHBondContact N-O 2.77Å; A1704-S1804 PolarHBondContact O-N 2.82Å
1705	L	80.3	Confident	82.1	Confident	12.8 Å²	12.8	46 Å²	46	7%	0.067	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	152.7	-174.9	-57.8	178.9	0	0	0	112.9	K1605 I1703 P1709 F1712 L1730 L1759 I1762 D1801 V1802	K1605-L1705 PolarHBondContact NZ-O 3.08Å; I1703-L1705 HydrophobicContact CG2-CD2 3.67Å; I1703-L1705 HydrophobicContact CG2-CG 4.41Å; L1705-P1709 HydrophobicContact CB-CB 4.17Å; L1705-P1709 HydrophobicContact CB-CG 3.75Å; L1705-P1709 HydrophobicContact CD1-CB 4.22Å; L1705-P1709 HydrophobicContact CD1-CG 3.99Å; L1705-P1709 HydrophobicContact CG-CG 4.41Å; L1705-F1712 HydrophobicContact CD1-CD1 4.05Å; L1705-F1712 HydrophobicContact CD1-CE1 4.25Å; L1705-F1712 HydrophobicContact CD2-CB 4.1Å; L1705-F1712 HydrophobicContact CD2-CD1 3.57Å; L1705-F1712 HydrophobicContact CD2-CE1 4.26Å; L1705-F1712 HydrophobicContact CD2-CG 4.02Å; L1705-F1712 HydrophobicContact CG-CD1 4.37Å; L1705-L1730 HydrophobicContact CD1-CD1 3.98Å; L1705-L1730 HydrophobicContact CD1-CD2 4.29Å; L1705-L1759 HydrophobicContact CB-CB 4.41Å; L1705-L1759 HydrophobicContact CD1-CB 4.35Å; L1705-L1759 HydrophobicContact CD1-CD2 3.94Å; L1705-L1759 PolarHBondContact N-O 3.09Å; L1705-L1759 VanDerWaalsContact N-O 3.12Å; L1705-I1762 HydrophobicContact CD1-CD1 3.8Å; L1705-I1762 HydrophobicContact CG-CD1 4.28Å; L1705-D1801 CarbonylContact C-O 3.51Å; L1705-D1801 VanDerWaalsContact CA-O 3.27Å; L1705-D1801 WeakPolarHBondContact CA-O 3.41Å; L1705-D1801 WeakPolarHBondContact CB-O 3.49Å; L1705-D1801 WeakPolarHBondContact CD2-O 3.47Å; L1705-V1802 HydrophobicContact CD2-CG2 4Å
1706	K	76.9	Confident	83.1	Confident	64.6 Å²	64.6	44.3 Å²	44.3	28%	0.281	21%	0.214	S	C	.	.	P	Polyproline II helix	trans	-62.9	162.9	172.4	-66.2	-177.7	-177.8	177.1	0	110.5	L1671 D1673 N1708 P1709 D1801 V1802 D1803	L1671-K1706 PolarHBondContact O-NZ 2.96Å; D1673-K1706 VanDerWaalsContact CG-NZ 3.31Å; D1673-K1706 IonicContact OD1-NZ 3.21Å; D1673-K1706 PolarHBondContact OD1-NZ 2.94Å; D1673-K1706 IonicContact OD2-NZ 3.35Å; D1673-K1706 PolarHBondContact OD2-NZ 3.11Å; K1706-N1708 PolarHBondContact O-N 3.09Å; K1706-P1709 VanDerWaalsContact O-CD 3.27Å; K1706-P1709 WeakPolarHBondContact O-CD 3.33Å; K1706-P1709 VanDerWaalsContact O-CG 3.29Å; K1706-P1709 WeakPolarHBondContact O-CG 3.32Å; K1706-D1801 HydrophobicContact CB-CB 4.44Å; K1706-D1801 PolarHBondContact N-O 2.86Å; K1706-V1802 VanDerWaalsContact CE-O 3.28Å; K1706-V1802 WeakPolarHBondContact CE-O 3.36Å; K1706-D1803 HydrophobicContact CG-CB 4.16Å
1707	K	73.7	Confident	83.6	Confident	199 Å²	199	46.5 Å²	46.5	87%	0.865	23%	0.226	S	C	*	.	S	Bend	trans	-64.8	133.3	173.4	-133.8	-178.3	179.4	-176.6	0	110
1708	N	74.5	Confident	83.7	Confident	146.8 Å²	146.8	41.6 Å²	41.6	79%	0.785	21%	0.205	S	C	*	.	S	Bend	trans	55.9	57.1	-175.3	-58	-18.2	0	0	0	114.9	K1706	K1706-N1708 PolarHBondContact O-N 3.09Å
1709	P	80.3	Confident	83.3	Confident	24 Å²	24	40.9 Å²	40.9	16%	0.156	20%	0.203	C	C	.	.			trans	-69.5	146.6	-177.5	11.5	-2.7	0	0	0	112.1	L1705 K1706 L1730 L1759 D1801	L1705-P1709 HydrophobicContact CB-CB 4.17Å; L1705-P1709 HydrophobicContact CB-CG 3.75Å; L1705-P1709 HydrophobicContact CD1-CB 4.22Å; L1705-P1709 HydrophobicContact CD1-CG 3.99Å; L1705-P1709 HydrophobicContact CG-CG 4.41Å; K1706-P1709 VanDerWaalsContact O-CD 3.27Å; K1706-P1709 WeakPolarHBondContact O-CD 3.33Å; K1706-P1709 VanDerWaalsContact O-CG 3.29Å; K1706-P1709 WeakPolarHBondContact O-CG 3.32Å; P1709-L1730 HydrophobicContact CB-CD1 3.71Å; P1709-L1730 HydrophobicContact CB-CG 4.1Å; P1709-L1730 HydrophobicContact CG-CD1 3.62Å; P1709-L1730 VanDerWaalsContact CG-CD1 3.47Å; P1709-L1730 WeakPolarHBondContact O-CD1 3.43Å; P1709-L1759 HydrophobicContact CG-CD1 4.07Å; P1709-D1801 HydrophobicContact CB-CB 3.63Å
1710	K	83.1	Confident	82.8	Confident	173.8 Å²	173.8	52.1 Å²	52.1	76%	0.756	25%	0.245	S	C	*	.			trans	-91.8	-41.6	168.3	-57.1	170.6	-175.8	168	0	110.3	L1730 D1801	K1710-L1730 PolarHBondContact O-N 2.91Å; K1710-D1801 VanDerWaalsContact CA-OD2 3.29Å; K1710-D1801 WeakPolarHBondContact CA-OD2 3.39Å; K1710-D1801 VanDerWaalsContact CB-OD2 3.26Å; K1710-D1801 WeakPolarHBondContact CB-OD2 3.33Å; K1710-D1801 PolarHBondContact N-OD2 2.9Å
1711	G	85.9	Confident	82.5	Confident	14.2 Å²	14.2	52.5 Å²	52.5	15%	0.146	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.1	174.5	177.5	0	0	0	0	0	114	A1728 D1801	G1711-A1728 VanDerWaalsContact CA-O 3.27Å; G1711-A1728 WeakPolarHBondContact CA-O 3.28Å; G1711-D1801 PolarHBondContact N-OD2 2.89Å; G1711-D1801 VanDerWaalsContact O-CB 3.3Å; G1711-D1801 WeakPolarHBondContact O-CB 3.43Å; G1711-D1801 PolarHBondContact O-N 2.72Å; G1711-D1801 VanDerWaalsContact O-OD2 3.11Å
1712	F	89.7	Confident	82.6	Confident	8.2 Å²	8.2	52.7 Å²	52.7	4%	0.036	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	170.2	174.3	67.1	-91	0	0	0	111.2	I1703 L1705 V1714 A1728 L1730 W1734 I1762 L1764 S1799 V1802	I1703-F1712 HydrophobicContact CD1-CD2 3.82Å; I1703-F1712 HydrophobicContact CD1-CE2 3.7Å; I1703-F1712 HydrophobicContact CD1-CZ 4.45Å; L1705-F1712 HydrophobicContact CD1-CD1 4.05Å; L1705-F1712 HydrophobicContact CD1-CE1 4.25Å; L1705-F1712 HydrophobicContact CD2-CB 4.1Å; L1705-F1712 HydrophobicContact CD2-CD1 3.57Å; L1705-F1712 HydrophobicContact CD2-CE1 4.26Å; L1705-F1712 HydrophobicContact CD2-CG 4.02Å; L1705-F1712 HydrophobicContact CG-CD1 4.37Å; F1712-V1714 HydrophobicContact CD2-CG2 4.14Å; F1712-V1714 HydrophobicContact CE2-CG2 4.09Å; F1712-A1728 HydrophobicContact CD1-CB 3.84Å; F1712-A1728 HydrophobicContact CD2-CB 3.82Å; F1712-A1728 HydrophobicContact CE1-CB 3.56Å; F1712-A1728 VanDerWaalsContact CE1-CB 3.5Å; F1712-A1728 HydrophobicContact CE2-CB 3.5Å; F1712-A1728 VanDerWaalsContact CE2-CB 3.46Å; F1712-A1728 HydrophobicContact CG-CB 3.98Å; F1712-A1728 HydrophobicContact CZ-CB 3.39Å; F1712-A1728 VanDerWaalsContact CZ-CB 3.49Å; F1712-A1728 PolarHBondContact N-O 2.95Å; F1712-A1728 VanDerWaalsContact N-O 3.14Å; F1712-A1728 WeakPolarHBondContact O-CA 3.21Å; F1712-A1728 WeakPolarHBondContact O-CB 3.33Å; F1712-A1728 PolarHBondContact O-N 2.85Å; F1712-L1730 HydrophobicContact CE1-CD2 4.41Å; F1712-W1734 AromaticContact CE1-CH2 3.83Å; F1712-W1734 HydrophobicContact CE1-CH2 3.83Å; F1712-W1734 AromaticContact CE1-CZ2 3.76Å; F1712-W1734 HydrophobicContact CE1-CZ2 3.76Å; F1712-W1734 HydrophobicContact CE2-CH2 4.42Å; F1712-W1734 AromaticContact CZ-CH2 3.44Å; F1712-W1734 HydrophobicContact CZ-CH2 3.44Å; F1712-W1734 VanDerWaalsContact CZ-CH2 3.44Å; F1712-W1734 AromaticContact CZ-CZ2 3.82Å; F1712-W1734 HydrophobicContact CZ-CZ2 3.82Å; F1712-W1734 AromaticContact CZ-CZ3 3.93Å; F1712-W1734 HydrophobicContact CZ-CZ3 3.98Å; F1712-I1762 HydrophobicContact CE1-CD1 4.09Å; F1712-I1762 HydrophobicContact CZ-CD1 4.32Å; F1712-L1764 HydrophobicContact CE2-CD1 3.57Å; F1712-L1764 VanDerWaalsContact CE2-CD1 3.49Å; F1712-L1764 HydrophobicContact CZ-CD1 3.89Å; F1712-S1799 CarbonylContact C-O 3.56Å; F1712-S1799 VanDerWaalsContact CA-O 3.32Å; F1712-S1799 WeakPolarHBondContact CA-O 3.41Å; F1712-S1799 WeakPolarHBondContact CB-O 3.33Å; F1712-V1802 HydrophobicContact CB-CG2 3.67Å; F1712-V1802 HydrophobicContact CG-CG2 4.44Å
1713	R	91.3	Very high	83.1	Confident	78 Å²	78	52.5 Å²	52.5	29%	0.294	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	143.5	178.7	-174.2	177.7	106.4	-153.1	-3.6	110.7	Y1680 D1715 R1725 L1726 E1727 V1798 S1799	Y1680-R1713 PolarHBondContact OH-NH2 3.48Å; R1713-D1715 WeakPolarHBondContact CG-OD1 3.29Å; R1713-D1715 IonicContact CZ-OD1 3.04Å; R1713-D1715 IonicContact CZ-OD2 3.32Å; R1713-D1715 VanDerWaalsContact CZ-OD2 3.3Å; R1713-D1715 IonicContact NE-OD1 3.24Å; R1713-D1715 PolarHBondContact NE-OD1 3.21Å; R1713-D1715 VanDerWaalsContact NE-OD1 3.16Å; R1713-D1715 IonicContact NE-OD2 2.82Å; R1713-D1715 PolarHBondContact NE-OD2 3.01Å; R1713-D1715 IonicContact NH2-OD1 3.05Å; R1713-D1715 PolarHBondContact NH2-OD1 2.84Å; R1713-D1715 IonicContact NH2-OD2 3.54Å; R1713-D1715 PolarHBondContact NH2-OD2 3.02Å; R1713-R1725 HydrophobicContact CG-CG 4.14Å; R1713-R1725 VanDerWaalsContact CZ-CZ 3.5Å; R1713-R1725 VanDerWaalsContact CZ-NE 3.34Å; R1713-R1725 VanDerWaalsContact NE-NE 3.19Å; R1713-L1726 CarbonylContact C-O 3.5Å; R1713-L1726 VanDerWaalsContact CA-O 3.29Å; R1713-L1726 WeakPolarHBondContact CA-O 3.35Å; R1713-L1726 WeakPolarHBondContact CG-O 3.35Å; R1713-E1727 HydrophobicContact CG-CG 4.22Å; R1713-V1798 WeakPolarHBondContact O-CA 3.31Å; R1713-S1799 PolarHBondContact N-O 3.08Å; R1713-S1799 PolarHBondContact O-N 3.1Å
1714	V	91.1	Very high	83.7	Confident	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	123.1	172.1	-172.6	0	0	0	0	108.7	A1701 I1703 F1712 L1716 R1725 L1726 L1764 F1766 I1796 G1797 V1798	A1701-V1714 HydrophobicContact CB-CG1 4.44Å; I1703-V1714 HydrophobicContact CD1-CG2 3.61Å; I1703-V1714 VanDerWaalsContact CD1-CG2 3.5Å; F1712-V1714 HydrophobicContact CD2-CG2 4.14Å; F1712-V1714 HydrophobicContact CE2-CG2 4.09Å; V1714-L1716 HydrophobicContact CG1-CD1 3.96Å; V1714-R1725 WeakPolarHBondContact O-CA 3.24Å; V1714-L1726 HydrophobicContact CB-CB 4.32Å; V1714-L1726 PolarHBondContact N-O 2.92Å; V1714-L1726 PolarHBondContact O-N 3.11Å; V1714-L1764 HydrophobicContact CG2-CD1 4.06Å; V1714-F1766 HydrophobicContact CB-CZ 4.42Å; V1714-F1766 HydrophobicContact CG1-CE2 4.14Å; V1714-F1766 HydrophobicContact CG1-CZ 4.13Å; V1714-I1796 HydrophobicContact CG1-CG2 4.14Å; V1714-G1797 CarbonylContact C-O 3.45Å; V1714-G1797 VanDerWaalsContact CA-O 3.32Å; V1714-G1797 WeakPolarHBondContact CA-O 3.16Å; V1714-V1798 HydrophobicContact CG1-CG2 4.26Å; V1714-V1798 HydrophobicContact CG2-CG2 4.35Å
1715	D	91.5	Very high	84.5	Confident	10.4 Å²	10.4	54.6 Å²	54.6	6%	0.056	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	120.7	177.8	-66.6	-44.1	0	0	0	109.3	R1713 T1723 R1725 I1796 G1797	R1713-D1715 WeakPolarHBondContact CG-OD1 3.29Å; R1713-D1715 IonicContact CZ-OD1 3.04Å; R1713-D1715 IonicContact CZ-OD2 3.32Å; R1713-D1715 VanDerWaalsContact CZ-OD2 3.3Å; R1713-D1715 IonicContact NE-OD1 3.24Å; R1713-D1715 PolarHBondContact NE-OD1 3.21Å; R1713-D1715 VanDerWaalsContact NE-OD1 3.16Å; R1713-D1715 IonicContact NE-OD2 2.82Å; R1713-D1715 PolarHBondContact NE-OD2 3.01Å; R1713-D1715 IonicContact NH2-OD1 3.05Å; R1713-D1715 PolarHBondContact NH2-OD1 2.84Å; R1713-D1715 IonicContact NH2-OD2 3.54Å; R1713-D1715 PolarHBondContact NH2-OD2 3.02Å; D1715-T1723 HydrophobicContact CB-CG2 4.01Å; D1715-R1725 WeakPolarHBondContact OD1-CB 3.43Å; D1715-R1725 VanDerWaalsContact OD1-CG 3.29Å; D1715-R1725 WeakPolarHBondContact OD1-CG 3.45Å; D1715-R1725 IonicContact OD1-CZ 3.17Å; D1715-R1725 IonicContact OD1-NE 3.16Å; D1715-R1725 PolarHBondContact OD1-NE 3.05Å; D1715-R1725 IonicContact OD1-NH2 3.24Å; D1715-R1725 PolarHBondContact OD1-NH2 2.97Å; D1715-R1725 IonicContact OD2-CZ 2.61Å; D1715-R1725 IonicContact OD2-NE 2.66Å; D1715-R1725 PolarHBondContact OD2-NE 2.84Å; D1715-R1725 IonicContact OD2-NH2 3.73Å; D1715-R1725 PolarHBondContact OD2-NH2 3.05Å; D1715-I1796 CarbonylContact O-C 3.52Å; D1715-I1796 VanDerWaalsContact O-CA 3.29Å; D1715-I1796 WeakPolarHBondContact O-CA 3.31Å; D1715-G1797 PolarHBondContact N-O 2.97Å; D1715-G1797 PolarHBondContact O-N 3.04Å
1716	L	90.7	Very high	85.2	Confident	0.2 Å²	0.2	54 Å²	54	0%	0.001	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	104.9	166.3	-76.8	72.4	0	0	0	107.4	A1699 V1714 M1718 T1723 L1724 F1766 L1793 I1796	A1699-L1716 HydrophobicContact CB-CD2 4.43Å; V1714-L1716 HydrophobicContact CG1-CD1 3.96Å; L1716-M1718 HydrophobicContact CB-CE 3.84Å; L1716-M1718 HydrophobicContact CB-CG 4.35Å; L1716-M1718 HydrophobicContact CD2-CE 4.12Å; L1716-M1718 VanDerWaalsContact O-CG 3.3Å; L1716-M1718 WeakPolarHBondContact O-CG 3.42Å; L1716-M1718 PolarHBondContact O-N 2.8Å; L1716-T1723 CarbonylContact O-C 3.53Å; L1716-T1723 WeakPolarHBondContact O-CA 3.37Å; L1716-L1724 HydrophobicContact CB-CB 4.22Å; L1716-L1724 HydrophobicContact CD1-CD2 4.47Å; L1716-L1724 HydrophobicContact CD2-CD2 4.33Å; L1716-L1724 PolarHBondContact N-O 2.95Å; L1716-L1724 PolarHBondContact O-N 3.08Å; L1716-F1766 HydrophobicContact CD1-CD1 4.15Å; L1716-F1766 HydrophobicContact CD1-CD2 4.12Å; L1716-F1766 HydrophobicContact CD1-CE1 3.87Å; L1716-F1766 HydrophobicContact CD1-CE2 3.86Å; L1716-F1766 HydrophobicContact CD1-CG 4.28Å; L1716-F1766 HydrophobicContact CD1-CZ 3.72Å; L1716-F1766 HydrophobicContact CD2-CB 4.19Å; L1716-F1766 HydrophobicContact CD2-CD1 4.16Å; L1716-F1766 HydrophobicContact CD2-CD2 4.34Å; L1716-F1766 HydrophobicContact CD2-CE1 4.49Å; L1716-F1766 HydrophobicContact CD2-CG 4.01Å; L1716-L1793 HydrophobicContact CB-CD1 3.91Å; L1716-L1793 HydrophobicContact CD2-CD1 4.27Å; L1716-L1793 HydrophobicContact CG-CD1 4.18Å; L1716-I1796 HydrophobicContact CD1-CD1 4.33Å; L1716-I1796 HydrophobicContact CD1-CG1 4.47Å; L1716-I1796 HydrophobicContact CD1-CG2 4.21Å; L1716-I1796 HydrophobicContact CD2-CD1 4.43Å; L1716-I1796 HydrophobicContact CG-CD1 4.08Å; L1716-I1796 HydrophobicContact CG-CG1 4.09Å; L1716-I1796 HydrophobicContact CG-CG2 4.48Å
1717	N	88.5	Confident	85.9	Confident	47.4 Å²	47.4	54.3 Å²	54.3	25%	0.253	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	121.1	177.6	-64.6	-21.8	0	0	0	108.7	A1722 T1723 E1794 T1795	N1717-A1722 CarbonylContact C-O 3.53Å; N1717-T1723 VanDerWaalsContact OD1-CG2 3.3Å; N1717-T1723 WeakPolarHBondContact OD1-CG2 3.36Å; N1717-T1723 PolarHBondContact OD1-OG1 2.91Å; N1717-T1723 VanDerWaalsContact OD1-OG1 3.08Å; N1717-E1794 HydrophobicContact CB-CB 4.31Å; N1717-E1794 PolarHBondContact O-N 3.21Å; N1717-T1795 WeakPolarHBondContact CB-OG1 3.42Å; N1717-T1795 PolarHBondContact N-O 3.01Å; N1717-T1795 PolarHBondContact ND2-OG1 3.07Å
1718	M	85.6	Confident	86.7	Confident	1.4 Å²	1.4	44.8 Å²	44.8	1%	0.007	22%	0.218	C	C	.	.			trans	-115.5	17.8	-166.8	-58.9	-160.1	85.3	0	0	114.3	L1695 L1716 A1722 L1724 I1768 L1788 P1789 G1790 N1791 R1792 L1793	L1695-M1718 HydrophobicContact CD2-CE 3.68Å; L1695-M1718 VanDerWaalsContact CD2-CE 3.46Å; L1716-M1718 HydrophobicContact CB-CE 3.84Å; L1716-M1718 HydrophobicContact CB-CG 4.35Å; L1716-M1718 HydrophobicContact CD2-CE 4.12Å; L1716-M1718 VanDerWaalsContact O-CG 3.3Å; L1716-M1718 WeakPolarHBondContact O-CG 3.42Å; L1716-M1718 PolarHBondContact O-N 2.8Å; M1718-A1722 WeakPolarHBondContact CA-O 3.41Å; M1718-A1722 HydrophobicContact CB-CB 4.27Å; M1718-A1722 PolarHBondContact N-O 3Å; M1718-L1724 HydrophobicContact CE-CB 3.94Å; M1718-L1724 HydrophobicContact CE-CD2 4.29Å; M1718-L1724 HydrophobicContact SD-CB 4.23Å; M1718-I1768 HydrophobicContact CE-CD1 4.31Å; M1718-L1788 HydrophobicContact CE-CB 4.46Å; M1718-L1788 HydrophobicContact CE-CD1 4.36Å; M1718-L1788 HydrophobicContact CE-CD2 3.89Å; M1718-L1788 HydrophobicContact CE-CG 4.48Å; M1718-L1788 HydrophobicContact SD-CB 4.38Å; M1718-L1788 HydrophobicContact SD-CD2 3.9Å; M1718-P1789 HydrophobicContact CB-CG 4.42Å; M1718-P1789 HydrophobicContact CG-CG 4.34Å; M1718-P1789 HydrophobicContact SD-CG 4.18Å; M1718-G1790 VanDerWaalsContact CE-O 3.25Å; M1718-G1790 WeakPolarHBondContact CE-O 3.26Å; M1718-G1790 CarbonylContact O-C 3.54Å; M1718-G1790 WeakPolarHBondContact O-CA 3.26Å; M1718-N1791 PolarHBondContact O-N 3.03Å; M1718-R1792 CarbonylContact C-O 3.48Å; M1718-R1792 WeakPolarHBondContact CA-O 3.29Å; M1718-R1792 VanDerWaalsContact CB-O 3.27Å; M1718-R1792 WeakPolarHBondContact CB-O 3.24Å; M1718-R1792 WeakPolarHBondContact CE-O 3.5Å; M1718-R1792 WeakPolarHBondContact CG-O 3.09Å; M1718-R1792 CarbonylContact O-C 3.58Å; M1718-R1792 WeakPolarHBondContact O-CG 3.3Å; M1718-R1792 PolarHBondContact O-N 3.19Å; M1718-R1792 VanDerWaalsContact O-O 3.05Å; M1718-L1793 HydrophobicContact CE-CD1 4.28Å; M1718-L1793 HydrophobicContact CG-CD1 4.35Å
1719	G	75.1	Confident	87.4	Confident	13.4 Å²	13.4	40.2 Å²	40.2	14%	0.138	20%	0.195	C	C	.	.	S	Bend	trans	135.2	176.8	179.9	0	0	0	0	0	111.8	G1721 A1722 R1792 E1794	G1719-G1721 VanDerWaalsContact C-N 3.34Å; G1719-G1721 PolarHBondContact O-N 3.08Å; G1719-A1722 WeakPolarHBondContact O-CA 3.39Å; G1719-A1722 WeakPolarHBondContact O-CB 3.09Å; G1719-A1722 PolarHBondContact O-N 2.8Å; G1719-A1722 VanDerWaalsContact O-N 3.14Å; G1719-R1792 VanDerWaalsContact CA-NE 3.31Å; G1719-R1792 PolarHBondContact N-O 3.42Å; G1719-E1794 VanDerWaalsContact C-OE1 3.31Å; G1719-E1794 VanDerWaalsContact C-OE2 3.28Å; G1719-E1794 VanDerWaalsContact CA-CD 3.48Å; G1719-E1794 VanDerWaalsContact CA-OE1 3.3Å; G1719-E1794 WeakPolarHBondContact CA-OE1 3.47Å; G1719-E1794 WeakPolarHBondContact CA-OE2 3.44Å
1720	R	74.9	Confident	87.4	Confident	235.6 Å²	235.6	41.5 Å²	41.5	89%	0.889	20%	0.201	S	C	*	.	S	Bend	trans	-41.8	118.5	166.3	-92.3	-172.8	177.2	-165.6	-0.9	109.8	A1722	R1720-A1722 PolarHBondContact O-N 3.03Å
1721	G	78.1	Confident	87.2	Confident	30.8 Å²	30.8	42.8 Å²	42.8	32%	0.318	21%	0.207	S	C	.	.	S	Bend	trans	74.4	-27	179.9	0	0	0	0	0	115.6	G1719 V1740 D1741	G1719-G1721 VanDerWaalsContact C-N 3.34Å; G1719-G1721 PolarHBondContact O-N 3.08Å; G1721-V1740 CarbonylContact O-C 3.6Å; G1721-V1740 WeakPolarHBondContact O-CA 3.09Å; G1721-D1741 VanDerWaalsContact CA-OD1 3.27Å; G1721-D1741 WeakPolarHBondContact CA-OD1 3.41Å; G1721-D1741 PolarHBondContact O-N 2.92Å
1722	A	86.2	Confident	87	Confident	6.8 Å²	6.8	49.7 Å²	49.7	6%	0.056	23%	0.228	C	C	.	.			trans	-85.5	121.1	-172.2	0	0	0	0	0	112.7	N1717 M1718 G1719 R1720 I1739 P1789	N1717-A1722 CarbonylContact C-O 3.53Å; M1718-A1722 WeakPolarHBondContact CA-O 3.41Å; M1718-A1722 HydrophobicContact CB-CB 4.27Å; M1718-A1722 PolarHBondContact N-O 3Å; G1719-A1722 WeakPolarHBondContact O-CA 3.39Å; G1719-A1722 WeakPolarHBondContact O-CB 3.09Å; G1719-A1722 PolarHBondContact O-N 2.8Å; G1719-A1722 VanDerWaalsContact O-N 3.14Å; R1720-A1722 PolarHBondContact O-N 3.03Å; A1722-I1739 CarbonylContact C-O 3.49Å; A1722-I1739 VanDerWaalsContact CA-O 3.29Å; A1722-I1739 WeakPolarHBondContact CA-O 3.31Å; A1722-P1789 HydrophobicContact CB-CB 4.01Å; A1722-P1789 VanDerWaalsContact CB-O 3.27Å; A1722-P1789 WeakPolarHBondContact CB-O 3.25Å
1723	T	90.6	Very high	86.8	Confident	20.2 Å²	20.2	51.4 Å²	51.4	12%	0.124	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	126.9	175.6	-56.1	0	0	0	0	111.3	D1715 L1716 N1717 R1725 I1739 P1789	D1715-T1723 HydrophobicContact CB-CG2 4.01Å; L1716-T1723 CarbonylContact O-C 3.53Å; L1716-T1723 WeakPolarHBondContact O-CA 3.37Å; N1717-T1723 VanDerWaalsContact OD1-CG2 3.3Å; N1717-T1723 WeakPolarHBondContact OD1-CG2 3.36Å; N1717-T1723 PolarHBondContact OD1-OG1 2.91Å; N1717-T1723 VanDerWaalsContact OD1-OG1 3.08Å; T1723-R1725 HydrophobicContact CG2-CB 4.42Å; T1723-I1739 PolarHBondContact N-O 2.87Å; T1723-I1739 WeakPolarHBondContact O-CB 3.31Å; T1723-I1739 PolarHBondContact O-N 2.98Å; T1723-P1789 VanDerWaalsContact C-CG 3.43Å; T1723-P1789 WeakPolarHBondContact O-CG 3.36Å
1724	L	93	Very high	86.8	Confident	0.2 Å²	0.2	47.9 Å²	47.9	0%	0.001	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	110.1	167.2	179	80	0	0	0	108	L1716 M1718 L1736 S1737 F1766 V1773 F1786 L1788 P1789	L1716-L1724 HydrophobicContact CB-CB 4.22Å; L1716-L1724 HydrophobicContact CD1-CD2 4.47Å; L1716-L1724 HydrophobicContact CD2-CD2 4.33Å; L1716-L1724 PolarHBondContact N-O 2.95Å; L1716-L1724 PolarHBondContact O-N 3.08Å; M1718-L1724 HydrophobicContact CE-CB 3.94Å; M1718-L1724 HydrophobicContact CE-CD2 4.29Å; M1718-L1724 HydrophobicContact SD-CB 4.23Å; L1724-L1736 HydrophobicContact CD1-CD1 3.95Å; L1724-L1736 HydrophobicContact CD1-CD2 4.46Å; L1724-L1736 HydrophobicContact CD1-CG 4.12Å; L1724-L1736 HydrophobicContact CD2-CD1 4.33Å; L1724-L1736 HydrophobicContact CG-CD1 3.97Å; L1724-S1737 WeakPolarHBondContact CA-O 3.43Å; L1724-F1766 HydrophobicContact CD2-CD1 4Å; L1724-F1766 HydrophobicContact CD2-CE1 4.22Å; L1724-V1773 HydrophobicContact CD1-CG1 4.23Å; L1724-V1773 HydrophobicContact CD2-CB 4.34Å; L1724-V1773 HydrophobicContact CD2-CG1 3.8Å; L1724-V1773 HydrophobicContact CD2-CG2 4.26Å; L1724-F1786 HydrophobicContact CD1-CD1 3.8Å; L1724-F1786 HydrophobicContact CD1-CE1 3.84Å; L1724-L1788 HydrophobicContact CD2-CD2 4.09Å; L1724-P1789 HydrophobicContact CB-CG 3.82Å
1725	R	94	Very high	86.8	Confident	58.2 Å²	58.2	50.2 Å²	50.2	22%	0.22	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	129.1	-175.5	174.5	171.5	-65	159.6	8.4	111.6	R1713 V1714 D1715 T1723 E1727 L1736 S1737 I1739	R1713-R1725 HydrophobicContact CG-CG 4.14Å; R1713-R1725 VanDerWaalsContact CZ-CZ 3.5Å; R1713-R1725 VanDerWaalsContact CZ-NE 3.34Å; R1713-R1725 VanDerWaalsContact NE-NE 3.19Å; V1714-R1725 WeakPolarHBondContact O-CA 3.24Å; D1715-R1725 WeakPolarHBondContact OD1-CB 3.43Å; D1715-R1725 VanDerWaalsContact OD1-CG 3.29Å; D1715-R1725 WeakPolarHBondContact OD1-CG 3.45Å; D1715-R1725 IonicContact OD1-CZ 3.17Å; D1715-R1725 IonicContact OD1-NE 3.16Å; D1715-R1725 PolarHBondContact OD1-NE 3.05Å; D1715-R1725 IonicContact OD1-NH2 3.24Å; D1715-R1725 PolarHBondContact OD1-NH2 2.97Å; D1715-R1725 IonicContact OD2-CZ 2.61Å; D1715-R1725 IonicContact OD2-NE 2.66Å; D1715-R1725 PolarHBondContact OD2-NE 2.84Å; D1715-R1725 IonicContact OD2-NH2 3.73Å; D1715-R1725 PolarHBondContact OD2-NH2 3.05Å; T1723-R1725 HydrophobicContact CG2-CB 4.42Å; R1725-E1727 VanDerWaalsContact CD-OE1 3.3Å; R1725-E1727 WeakPolarHBondContact CD-OE1 3.39Å; R1725-E1727 HydrophobicContact CG-CG 3.93Å; R1725-E1727 IonicContact NH1-OE1 3.94Å; R1725-L1736 CarbonylContact O-C 3.48Å; R1725-L1736 WeakPolarHBondContact O-CA 3.34Å; R1725-S1737 PolarHBondContact N-O 2.89Å; R1725-S1737 PolarHBondContact O-N 2.91Å; R1725-I1739 HydrophobicContact CB-CD1 3.91Å; R1725-I1739 HydrophobicContact CG-CD1 4.36Å
1726	L	93.5	Very high	86.9	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	116.6	166	175	63.1	0	0	0	109.5	R1713 V1714 W1734 K1735 L1736 F1750 L1764 F1766 L1775	R1713-L1726 CarbonylContact C-O 3.5Å; R1713-L1726 VanDerWaalsContact CA-O 3.29Å; R1713-L1726 WeakPolarHBondContact CA-O 3.35Å; R1713-L1726 WeakPolarHBondContact CG-O 3.35Å; V1714-L1726 HydrophobicContact CB-CB 4.32Å; V1714-L1726 PolarHBondContact N-O 2.92Å; V1714-L1726 PolarHBondContact O-N 3.11Å; L1726-W1734 HydrophobicContact CD1-CB 4.43Å; L1726-W1734 HydrophobicContact CD1-CE3 4.24Å; L1726-W1734 HydrophobicContact CD2-CE3 4.36Å; L1726-W1734 HydrophobicContact CD2-CZ3 4.31Å; L1726-K1735 CarbonylContact C-O 3.57Å; L1726-K1735 WeakPolarHBondContact CA-O 3.28Å; L1726-L1736 HydrophobicContact CB-CD1 4.08Å; L1726-L1736 HydrophobicContact CD1-CB 4.34Å; L1726-L1736 HydrophobicContact CD1-CD1 4.41Å; L1726-F1750 HydrophobicContact CD1-CE1 4.35Å; L1726-F1750 HydrophobicContact CD1-CE2 4.3Å; L1726-F1750 HydrophobicContact CD1-CZ 3.72Å; L1726-L1764 HydrophobicContact CD2-CD1 4.04Å; L1726-L1764 HydrophobicContact CD2-CD2 4.45Å; L1726-F1766 HydrophobicContact CB-CE1 4.47Å; L1726-F1766 HydrophobicContact CB-CZ 4.27Å; L1726-F1766 HydrophobicContact CD2-CZ 4.09Å; L1726-L1775 HydrophobicContact CD1-CD2 4.02Å; L1726-L1775 HydrophobicContact CD2-CD1 4.31Å; L1726-L1775 HydrophobicContact CD2-CD2 3.93Å; L1726-L1775 HydrophobicContact CG-CD2 4.49Å
1727	E	92.5	Very high	87	Confident	71.2 Å²	71.2	50 Å²	50	33%	0.333	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	123.1	170.4	-70	177.3	174.5	0	0	109.6	R1713 R1725 P1729 W1734 K1735	R1713-E1727 HydrophobicContact CG-CG 4.22Å; R1725-E1727 VanDerWaalsContact CD-OE1 3.3Å; R1725-E1727 WeakPolarHBondContact CD-OE1 3.39Å; R1725-E1727 HydrophobicContact CG-CG 3.93Å; R1725-E1727 IonicContact NH1-OE1 3.94Å; E1727-P1729 VanDerWaalsContact C-CD 3.44Å; E1727-P1729 VanDerWaalsContact O-CD 3.28Å; E1727-P1729 WeakPolarHBondContact O-CD 3.32Å; E1727-W1734 CarbonylContact O-C 3.54Å; E1727-W1734 VanDerWaalsContact O-CA 3.31Å; E1727-W1734 WeakPolarHBondContact O-CA 3.27Å; E1727-K1735 HydrophobicContact CB-CB 4.43Å; E1727-K1735 PolarHBondContact N-O 2.99Å; E1727-K1735 PolarHBondContact O-N 2.98Å
1728	A	90.4	Very high	87.1	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.008	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	67	-167.9	0	0	0	0	0	112.8	G1711 F1712 L1730 W1734	G1711-A1728 VanDerWaalsContact CA-O 3.27Å; G1711-A1728 WeakPolarHBondContact CA-O 3.28Å; F1712-A1728 HydrophobicContact CD1-CB 3.84Å; F1712-A1728 HydrophobicContact CD2-CB 3.82Å; F1712-A1728 HydrophobicContact CE1-CB 3.56Å; F1712-A1728 VanDerWaalsContact CE1-CB 3.5Å; F1712-A1728 HydrophobicContact CE2-CB 3.5Å; F1712-A1728 VanDerWaalsContact CE2-CB 3.46Å; F1712-A1728 HydrophobicContact CG-CB 3.98Å; F1712-A1728 HydrophobicContact CZ-CB 3.39Å; F1712-A1728 VanDerWaalsContact CZ-CB 3.49Å; F1712-A1728 PolarHBondContact N-O 2.95Å; F1712-A1728 VanDerWaalsContact N-O 3.14Å; F1712-A1728 WeakPolarHBondContact O-CA 3.21Å; F1712-A1728 WeakPolarHBondContact O-CB 3.33Å; F1712-A1728 PolarHBondContact O-N 2.85Å; A1728-L1730 PolarHBondContact O-N 3.29Å; A1728-W1734 VanDerWaalsContact CA-CD1 3.5Å; A1728-W1734 HydrophobicContact CB-CD2 3.51Å; A1728-W1734 VanDerWaalsContact CB-CE2 3.46Å; A1728-W1734 HydrophobicContact CB-CE3 3.88Å; A1728-W1734 HydrophobicContact CB-CG 3.98Å; A1728-W1734 HydrophobicContact CB-CH2 4.16Å; A1728-W1734 HydrophobicContact CB-CZ2 3.79Å; A1728-W1734 HydrophobicContact CB-CZ3 4.2Å
1729	P	89.2	Confident	87.3	Confident	48.2 Å²	48.2	49.3 Å²	49.3	31%	0.313	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	132.4	172.9	30.6	-34.9	0	0	0	110.7	E1727 K1731 R1732 P1733 W1734	E1727-P1729 VanDerWaalsContact C-CD 3.44Å; E1727-P1729 VanDerWaalsContact O-CD 3.28Å; E1727-P1729 WeakPolarHBondContact O-CD 3.32Å; P1729-K1731 VanDerWaalsContact C-N 3.29Å; P1729-K1731 PolarHBondContact O-N 3.02Å; P1729-R1732 HydrophobicContact CB-CB 4.16Å; P1729-R1732 HydrophobicContact CG-CB 3.82Å; P1729-R1732 PolarHBondContact O-N 2.87Å; P1729-R1732 VanDerWaalsContact O-N 3.09Å; P1729-R1732 VanDerWaalsContact O-O 3.08Å; P1729-P1733 VanDerWaalsContact CG-O 3.29Å; P1729-P1733 WeakPolarHBondContact CG-O 3.33Å; P1729-W1734 VanDerWaalsContact O-CD1 3.27Å; P1729-W1734 PolarHBondContact O-NE1 3.01Å; P1729-W1734 VanDerWaalsContact O-NE1 3.08Å
1730	L	80.9	Confident	87.8	Confident	51.6 Å²	51.6	50.2 Å²	50.2	27%	0.27	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-16.7	-174.2	-64.5	-169.3	0	0	0	114.1	L1705 P1709 K1710 F1712 A1728 R1732 W1734 L1759	L1705-L1730 HydrophobicContact CD1-CD1 3.98Å; L1705-L1730 HydrophobicContact CD1-CD2 4.29Å; P1709-L1730 HydrophobicContact CB-CD1 3.71Å; P1709-L1730 HydrophobicContact CB-CG 4.1Å; P1709-L1730 HydrophobicContact CG-CD1 3.62Å; P1709-L1730 VanDerWaalsContact CG-CD1 3.47Å; P1709-L1730 WeakPolarHBondContact O-CD1 3.43Å; K1710-L1730 PolarHBondContact O-N 2.91Å; F1712-L1730 HydrophobicContact CE1-CD2 4.41Å; A1728-L1730 PolarHBondContact O-N 3.29Å; L1730-R1732 PolarHBondContact O-N 2.96Å; L1730-W1734 HydrophobicContact CD2-CZ2 4.09Å; L1730-L1759 HydrophobicContact CD1-CD2 4.07Å; L1730-L1759 HydrophobicContact CD2-CD2 4.09Å
1731	K	78.9	Confident	88.2	Confident	202.4 Å²	202.4	44.8 Å²	44.8	88%	0.88	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.9	-7.2	177.6	-65.7	-173.7	178.7	-178.7	0	113.8	P1729	P1729-K1731 VanDerWaalsContact C-N 3.29Å; P1729-K1731 PolarHBondContact O-N 3.02Å
1732	R	81.3	Confident	88.2	Confident	157.8 Å²	157.8	46.5 Å²	46.5	60%	0.595	24%	0.241	S	C	*	.	S	Bend	trans	-164.8	165.4	-175.5	-63.5	-177.1	-176.6	-179	0	111	P1729 L1730 K1751 P1752 L1754	P1729-R1732 HydrophobicContact CB-CB 4.16Å; P1729-R1732 HydrophobicContact CG-CB 3.82Å; P1729-R1732 PolarHBondContact O-N 2.87Å; P1729-R1732 VanDerWaalsContact O-N 3.09Å; P1729-R1732 VanDerWaalsContact O-O 3.08Å; L1730-R1732 PolarHBondContact O-N 2.96Å; R1732-K1751 HydrophobicContact CB-CG 4.48Å; R1732-P1752 PolarHBondContact NE-O 3.41Å; R1732-P1752 PolarHBondContact NH1-O 3.1Å; R1732-P1752 VanDerWaalsContact NH1-O 3.13Å; R1732-P1752 PolarHBondContact NH2-O 3.22Å; R1732-L1754 PolarHBondContact NH2-O 2.76Å
1733	P	85.6	Confident	88.1	Confident	45.2 Å²	45.2	51.7 Å²	51.7	29%	0.294	27%	0.268	S	S	.	.			trans	-59.2	156.6	151	-1.6	7.9	0	0	0	111.7	P1729 E1749 F1750 K1751	P1729-P1733 VanDerWaalsContact CG-O 3.29Å; P1729-P1733 WeakPolarHBondContact CG-O 3.33Å; P1733-E1749 HydrophobicContact CB-CB 4.11Å; P1733-E1749 HydrophobicContact CB-CG 4.45Å; P1733-E1749 HydrophobicContact CG-CB 4.25Å; P1733-E1749 HydrophobicContact CG-CG 4.24Å; P1733-E1749 VanDerWaalsContact CG-OE2 3.25Å; P1733-E1749 WeakPolarHBondContact CG-OE2 3.46Å; P1733-F1750 CarbonylContact C-O 3.59Å; P1733-F1750 WeakPolarHBondContact CA-O 3.25Å; P1733-F1750 WeakPolarHBondContact CB-O 3.32Å; P1733-K1751 HydrophobicContact CB-CG 4.14Å; P1733-K1751 HydrophobicContact CG-CG 4.1Å
1734	W	90.4	Very high	87.9	Confident	3.2 Å²	3.2	55 Å²	55	1%	0.012	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	145.9	166.8	-69.9	10.8	0	0	0	109	F1712 L1726 E1727 A1728 P1729 L1730 E1749 F1750 P1752 L1754 I1762 L1764 V1777 I1782	F1712-W1734 AromaticContact CE1-CH2 3.83Å; F1712-W1734 HydrophobicContact CE1-CH2 3.83Å; F1712-W1734 AromaticContact CE1-CZ2 3.76Å; F1712-W1734 HydrophobicContact CE1-CZ2 3.76Å; F1712-W1734 HydrophobicContact CE2-CH2 4.42Å; F1712-W1734 AromaticContact CZ-CH2 3.44Å; F1712-W1734 HydrophobicContact CZ-CH2 3.44Å; F1712-W1734 VanDerWaalsContact CZ-CH2 3.44Å; F1712-W1734 AromaticContact CZ-CZ2 3.82Å; F1712-W1734 HydrophobicContact CZ-CZ2 3.82Å; F1712-W1734 AromaticContact CZ-CZ3 3.93Å; F1712-W1734 HydrophobicContact CZ-CZ3 3.98Å; L1726-W1734 HydrophobicContact CD1-CB 4.43Å; L1726-W1734 HydrophobicContact CD1-CE3 4.24Å; L1726-W1734 HydrophobicContact CD2-CE3 4.36Å; L1726-W1734 HydrophobicContact CD2-CZ3 4.31Å; E1727-W1734 CarbonylContact O-C 3.54Å; E1727-W1734 VanDerWaalsContact O-CA 3.31Å; E1727-W1734 WeakPolarHBondContact O-CA 3.27Å; A1728-W1734 VanDerWaalsContact CA-CD1 3.5Å; A1728-W1734 HydrophobicContact CB-CD2 3.51Å; A1728-W1734 VanDerWaalsContact CB-CE2 3.46Å; A1728-W1734 HydrophobicContact CB-CE3 3.88Å; A1728-W1734 HydrophobicContact CB-CG 3.98Å; A1728-W1734 HydrophobicContact CB-CH2 4.16Å; A1728-W1734 HydrophobicContact CB-CZ2 3.79Å; A1728-W1734 HydrophobicContact CB-CZ3 4.2Å; P1729-W1734 VanDerWaalsContact O-CD1 3.27Å; P1729-W1734 PolarHBondContact O-NE1 3.01Å; P1729-W1734 VanDerWaalsContact O-NE1 3.08Å; L1730-W1734 HydrophobicContact CD2-CZ2 4.09Å; W1734-E1749 CarbonylContact O-C 3.5Å; W1734-E1749 VanDerWaalsContact O-CA 3.28Å; W1734-E1749 WeakPolarHBondContact O-CA 3.4Å; W1734-F1750 HydrophobicContact CB-CD2 3.99Å; W1734-F1750 HydrophobicContact CB-CE2 3.56Å; W1734-F1750 VanDerWaalsContact CB-CE2 3.41Å; W1734-F1750 HydrophobicContact CB-CZ 4.06Å; W1734-F1750 HydrophobicContact CD2-CE2 4.36Å; W1734-F1750 AromaticContact CE3-CE2 3.89Å; W1734-F1750 HydrophobicContact CE3-CE2 3.98Å; W1734-F1750 HydrophobicContact CE3-CZ 4.33Å; W1734-F1750 HydrophobicContact CG-CE2 4.32Å; W1734-F1750 PolarHBondContact N-O 2.99Å; W1734-F1750 PolarHBondContact O-N 3.2Å; W1734-P1752 HydrophobicContact CB-CG 4.47Å; W1734-P1752 HydrophobicContact CD2-CB 4.41Å; W1734-P1752 HydrophobicContact CD2-CG 3.55Å; W1734-P1752 VanDerWaalsContact CD2-CG 3.5Å; W1734-P1752 VanDerWaalsContact CE2-CG 3.5Å; W1734-P1752 HydrophobicContact CE3-CB 4.41Å; W1734-P1752 HydrophobicContact CE3-CG 3.93Å; W1734-P1752 HydrophobicContact CG-CG 3.88Å; W1734-P1752 HydrophobicContact CH2-CG 4.19Å; W1734-P1752 HydrophobicContact CZ2-CG 4.01Å; W1734-P1752 HydrophobicContact CZ3-CG 4.29Å; W1734-L1754 HydrophobicContact CH2-CD1 3.59Å; W1734-L1754 VanDerWaalsContact CH2-CD1 3.49Å; W1734-L1754 HydrophobicContact CZ2-CD1 3.32Å; W1734-L1754 VanDerWaalsContact CZ2-CD1 3.49Å; W1734-L1754 HydrophobicContact CZ2-CG 4.47Å; W1734-L1754 HydrophobicContact CZ3-CD1 4.29Å; W1734-I1762 HydrophobicContact CH2-CG2 4.44Å; W1734-L1764 HydrophobicContact CH2-CD2 4.36Å; W1734-L1764 HydrophobicContact CZ3-CD2 3.9Å; W1734-V1777 HydrophobicContact CH2-CG1 4.39Å; W1734-V1777 HydrophobicContact CZ3-CG1 4.34Å; W1734-V1777 HydrophobicContact CZ3-CG2 4.12Å; W1734-I1782 HydrophobicContact CE3-CD1 4.38Å
1735	K	91.7	Very high	87.6	Confident	48.8 Å²	48.8	60.4 Å²	60.4	21%	0.212	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	124.8	-175.2	-169.1	-172.3	-177.7	-161.1	0	109.4	L1726 E1727 S1737 E1744 S1747 T1748 E1749	L1726-K1735 CarbonylContact C-O 3.57Å; L1726-K1735 WeakPolarHBondContact CA-O 3.28Å; E1727-K1735 HydrophobicContact CB-CB 4.43Å; E1727-K1735 PolarHBondContact N-O 2.99Å; E1727-K1735 PolarHBondContact O-N 2.98Å; K1735-S1737 VanDerWaalsContact CE-OG 3.28Å; K1735-S1737 WeakPolarHBondContact CE-OG 3.34Å; K1735-E1744 WeakPolarHBondContact CE-OE1 3.33Å; K1735-E1744 WeakPolarHBondContact CE-OE2 3.23Å; K1735-E1744 IonicContact NZ-OE1 3.51Å; K1735-E1744 PolarHBondContact NZ-OE1 2.99Å; K1735-E1744 IonicContact NZ-OE2 3.21Å; K1735-E1744 PolarHBondContact NZ-OE2 3.2Å; K1735-S1747 VanDerWaalsContact CE-CB 3.42Å; K1735-S1747 VanDerWaalsContact CE-OG 3.23Å; K1735-S1747 WeakPolarHBondContact CE-OG 3.46Å; K1735-T1748 WeakPolarHBondContact CA-O 3.34Å; K1735-E1749 HydrophobicContact CB-CG 4.37Å; K1735-E1749 HydrophobicContact CG-CG 4.27Å
1736	L	93.1	Very high	87.2	Confident	4.4 Å²	4.4	63 Å²	63	2%	0.023	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	123.8	170	-177.9	72.3	0	0	0	108.4	L1724 R1725 L1726 S1747 T1748 F1750 F1766 V1773 F1786	L1724-L1736 HydrophobicContact CD1-CD1 3.95Å; L1724-L1736 HydrophobicContact CD1-CD2 4.46Å; L1724-L1736 HydrophobicContact CD1-CG 4.12Å; L1724-L1736 HydrophobicContact CD2-CD1 4.33Å; L1724-L1736 HydrophobicContact CG-CD1 3.97Å; R1725-L1736 CarbonylContact O-C 3.48Å; R1725-L1736 WeakPolarHBondContact O-CA 3.34Å; L1726-L1736 HydrophobicContact CB-CD1 4.08Å; L1726-L1736 HydrophobicContact CD1-CB 4.34Å; L1726-L1736 HydrophobicContact CD1-CD1 4.41Å; L1736-S1747 CarbonylContact O-C 3.56Å; L1736-S1747 VanDerWaalsContact O-CA 3.25Å; L1736-S1747 WeakPolarHBondContact O-CA 3.41Å; L1736-S1747 WeakPolarHBondContact O-CB 3.34Å; L1736-T1748 HydrophobicContact CB-CG2 4.04Å; L1736-T1748 HydrophobicContact CD2-CG2 4.47Å; L1736-T1748 PolarHBondContact N-O 3.05Å; L1736-T1748 PolarHBondContact O-N 3.06Å; L1736-F1750 HydrophobicContact CB-CE1 3.83Å; L1736-F1750 HydrophobicContact CB-CZ 4.15Å; L1736-F1766 HydrophobicContact CD1-CE1 4.26Å; L1736-V1773 HydrophobicContact CD2-CG1 4.4Å; L1736-F1786 HydrophobicContact CD2-CB 3.96Å; L1736-F1786 HydrophobicContact CD2-CD1 3.81Å; L1736-F1786 HydrophobicContact CD2-CD2 4.39Å; L1736-F1786 HydrophobicContact CD2-CE1 4.42Å; L1736-F1786 HydrophobicContact CD2-CG 3.86Å; L1736-F1786 HydrophobicContact CG-CD1 4.1Å; L1736-F1786 HydrophobicContact CG-CE1 4.25Å; L1736-F1786 HydrophobicContact CG-CG 4.46Å; L1736-F1786 WeakPolarHBondContact O-CZ 3.3Å
1737	S	92.6	Very high	87	Confident	1.8 Å²	1.8	65.8 Å²	65.8	1%	0.013	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	138.1	-169.2	-60.9	0	0	0	0	112	L1724 R1725 K1735 E1744 K1746 S1747	L1724-S1737 WeakPolarHBondContact CA-O 3.43Å; R1725-S1737 PolarHBondContact N-O 2.89Å; R1725-S1737 PolarHBondContact O-N 2.91Å; K1735-S1737 VanDerWaalsContact CE-OG 3.28Å; K1735-S1737 WeakPolarHBondContact CE-OG 3.34Å; S1737-E1744 WeakPolarHBondContact CB-OE1 3.3Å; S1737-E1744 VanDerWaalsContact CB-OE2 3.25Å; S1737-E1744 WeakPolarHBondContact CB-OE2 3.41Å; S1737-E1744 VanDerWaalsContact OG-CD 3.26Å; S1737-E1744 PolarHBondContact OG-OE1 3Å; S1737-E1744 PolarHBondContact OG-OE2 2.93Å; S1737-K1746 CarbonylContact C-O 3.58Å; S1737-K1746 WeakPolarHBondContact CA-O 3.38Å; S1737-S1747 WeakPolarHBondContact OG-CB 3.24Å
1738	Q	92.1	Very high	86.8	Confident	15.2 Å²	15.2	65 Å²	65	7%	0.071	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	109.3	168.4	-174.6	-173.4	-21.2	0	0	107.7	V1740 E1744 E1745 K1746 F1786 P1789	Q1738-V1740 HydrophobicContact CG-CG2 4.39Å; Q1738-E1744 CarbonylContact O-C 3.54Å; Q1738-E1744 WeakPolarHBondContact O-CA 3.27Å; Q1738-E1745 HydrophobicContact CG-CB 4.47Å; Q1738-E1745 PolarHBondContact NE2-OE2 2.86Å; Q1738-E1745 PolarHBondContact O-N 2.91Å; Q1738-K1746 HydrophobicContact CB-CB 4.12Å; Q1738-K1746 PolarHBondContact N-O 2.91Å; Q1738-F1786 HydrophobicContact CB-CE1 3.99Å; Q1738-F1786 HydrophobicContact CB-CZ 4.22Å; Q1738-P1789 HydrophobicContact CG-CB 3.64Å; Q1738-P1789 VanDerWaalsContact CG-CB 3.43Å; Q1738-P1789 HydrophobicContact CG-CG 4.26Å
1739	I	89.7	Confident	86.7	Confident	19.4 Å²	19.4	71.1 Å²	71.1	10%	0.099	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	128.7	176.5	-56.4	173.7	0	0	0	108.4	A1722 T1723 R1725 N1743	A1722-I1739 CarbonylContact C-O 3.49Å; A1722-I1739 VanDerWaalsContact CA-O 3.29Å; A1722-I1739 WeakPolarHBondContact CA-O 3.31Å; T1723-I1739 PolarHBondContact N-O 2.87Å; T1723-I1739 WeakPolarHBondContact O-CB 3.31Å; T1723-I1739 PolarHBondContact O-N 2.98Å; R1725-I1739 HydrophobicContact CB-CD1 3.91Å; R1725-I1739 HydrophobicContact CG-CD1 4.36Å; I1739-N1743 CarbonylContact C-O 3.53Å; I1739-N1743 VanDerWaalsContact CA-O 3.27Å; I1739-N1743 WeakPolarHBondContact CA-O 3.32Å
1740	V	85.8	Confident	86.4	Confident	32 Å²	32	69.9 Å²	69.9	19%	0.194	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	123.7	176	-177.4	0	0	0	0	108.4	G1721 Q1738 G1742 N1743 E1745 P1789	G1721-V1740 CarbonylContact O-C 3.6Å; G1721-V1740 WeakPolarHBondContact O-CA 3.09Å; Q1738-V1740 HydrophobicContact CG-CG2 4.39Å; V1740-G1742 PolarHBondContact O-N 2.93Å; V1740-G1742 VanDerWaalsContact O-N 3.09Å; V1740-N1743 PolarHBondContact N-O 3.01Å; V1740-N1743 PolarHBondContact O-N 3.21Å; V1740-E1745 HydrophobicContact CB-CG 4.15Å; V1740-E1745 HydrophobicContact CG2-CG 4.15Å; V1740-E1745 VanDerWaalsContact CG2-OE2 3.26Å; V1740-E1745 WeakPolarHBondContact CG2-OE2 3.3Å; V1740-P1789 HydrophobicContact CG2-CB 4.05Å
1741	D	82.8	Confident	86.1	Confident	123.4 Å²	123.4	75.6 Å²	75.6	66%	0.66	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	37.9	-176.6	-64.9	-45.9	0	0	0	113.8	G1721 N1743	G1721-D1741 VanDerWaalsContact CA-OD1 3.27Å; G1721-D1741 WeakPolarHBondContact CA-OD1 3.41Å; G1721-D1741 PolarHBondContact O-N 2.92Å; D1741-N1743 VanDerWaalsContact C-N 3.32Å; D1741-N1743 PolarHBondContact O-N 3Å
1742	G	78.5	Confident	85.7	Confident	65.8 Å²	65.8	66.5 Å²	66.5	68%	0.678	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.2	-14.6	-179.6	0	0	0	0	0	115.3	V1740	V1740-G1742 PolarHBondContact O-N 2.93Å; V1740-G1742 VanDerWaalsContact O-N 3.09Å
1743	N	82.8	Confident	84.8	Confident	116.2 Å²	116.2	65.3 Å²	65.3	62%	0.621	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	140.6	179	-62.2	-62.1	0	0	0	111.5	I1739 V1740 D1741 E1745	I1739-N1743 CarbonylContact C-O 3.53Å; I1739-N1743 VanDerWaalsContact CA-O 3.27Å; I1739-N1743 WeakPolarHBondContact CA-O 3.32Å; V1740-N1743 PolarHBondContact N-O 3.01Å; V1740-N1743 PolarHBondContact O-N 3.21Å; D1741-N1743 VanDerWaalsContact C-N 3.32Å; D1741-N1743 PolarHBondContact O-N 3Å; N1743-E1745 PolarHBondContact O-N 3.11Å
1744	E	87.9	Confident	83.6	Confident	89.4 Å²	89.4	64.7 Å²	64.7	42%	0.418	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	101.2	173.9	-174.8	176.6	165	0	0	110.3	K1735 S1737 Q1738 S1747	K1735-E1744 WeakPolarHBondContact CE-OE1 3.33Å; K1735-E1744 WeakPolarHBondContact CE-OE2 3.23Å; K1735-E1744 IonicContact NZ-OE1 3.51Å; K1735-E1744 PolarHBondContact NZ-OE1 2.99Å; K1735-E1744 IonicContact NZ-OE2 3.21Å; K1735-E1744 PolarHBondContact NZ-OE2 3.2Å; S1737-E1744 WeakPolarHBondContact CB-OE1 3.3Å; S1737-E1744 VanDerWaalsContact CB-OE2 3.25Å; S1737-E1744 WeakPolarHBondContact CB-OE2 3.41Å; S1737-E1744 VanDerWaalsContact OG-CD 3.26Å; S1737-E1744 PolarHBondContact OG-OE1 3Å; S1737-E1744 PolarHBondContact OG-OE2 2.93Å; Q1738-E1744 CarbonylContact O-C 3.54Å; Q1738-E1744 WeakPolarHBondContact O-CA 3.27Å; E1744-S1747 WeakPolarHBondContact OE1-CB 3.41Å; E1744-S1747 PolarHBondContact OE1-OG 2.98Å
1745	E	84.9	Confident	82	Confident	113.2 Å²	113.2	69.4 Å²	69.4	53%	0.529	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	-37.6	-178.1	-66.1	-168.3	143.4	0	0	113	Q1738 V1740 N1743	Q1738-E1745 HydrophobicContact CG-CB 4.47Å; Q1738-E1745 PolarHBondContact NE2-OE2 2.86Å; Q1738-E1745 PolarHBondContact O-N 2.91Å; V1740-E1745 HydrophobicContact CB-CG 4.15Å; V1740-E1745 HydrophobicContact CG2-CG 4.15Å; V1740-E1745 VanDerWaalsContact CG2-OE2 3.26Å; V1740-E1745 WeakPolarHBondContact CG2-OE2 3.3Å; N1743-E1745 PolarHBondContact O-N 3.11Å
1746	K	87.2	Confident	79.7	Confident	113.2 Å²	113.2	72.8 Å²	72.8	49%	0.492	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	148	-178	-68.9	-176.6	-175.3	128.9	0	110.1	S1737 Q1738 F1786 P1787	S1737-K1746 CarbonylContact C-O 3.58Å; S1737-K1746 WeakPolarHBondContact CA-O 3.38Å; Q1738-K1746 HydrophobicContact CB-CB 4.12Å; Q1738-K1746 PolarHBondContact N-O 2.91Å; K1746-F1786 HydrophobicContact CB-CE2 4.42Å; K1746-F1786 HydrophobicContact CB-CZ 4.08Å; K1746-P1787 HydrophobicContact CD-CG 3.87Å
1747	S	89.3	Confident	77.3	Confident	58.4 Å²	58.4	75.9 Å²	75.9	41%	0.408	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	162.3	166.4	55.8	0	0	0	0	112.3	K1735 L1736 S1737 E1744	K1735-S1747 VanDerWaalsContact CE-CB 3.42Å; K1735-S1747 VanDerWaalsContact CE-OG 3.23Å; K1735-S1747 WeakPolarHBondContact CE-OG 3.46Å; L1736-S1747 CarbonylContact O-C 3.56Å; L1736-S1747 VanDerWaalsContact O-CA 3.25Å; L1736-S1747 WeakPolarHBondContact O-CA 3.41Å; L1736-S1747 WeakPolarHBondContact O-CB 3.34Å; S1737-S1747 WeakPolarHBondContact OG-CB 3.24Å; E1744-S1747 WeakPolarHBondContact OE1-CB 3.41Å; E1744-S1747 PolarHBondContact OE1-OG 2.98Å
1748	T	88.5	Confident	75.5	Confident	55 Å²	55	77.2 Å²	77.2	34%	0.337	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	136.8	172.4	-170.3	0	0	0	0	109.8	K1735 L1736 F1750 F1786	K1735-T1748 WeakPolarHBondContact CA-O 3.34Å; L1736-T1748 HydrophobicContact CB-CG2 4.04Å; L1736-T1748 HydrophobicContact CD2-CG2 4.47Å; L1736-T1748 PolarHBondContact N-O 3.05Å; L1736-T1748 PolarHBondContact O-N 3.06Å; T1748-F1750 HydrophobicContact CG2-CD1 4.3Å; T1748-F1750 HydrophobicContact CG2-CE1 4.25Å; T1748-F1786 HydrophobicContact CG2-CD2 3.48Å; T1748-F1786 VanDerWaalsContact CG2-CD2 3.43Å; T1748-F1786 HydrophobicContact CG2-CE2 3.68Å; T1748-F1786 HydrophobicContact CG2-CG 4.33Å; T1748-F1786 HydrophobicContact CG2-CZ 4.47Å
1749	E	88	Confident	74	Confident	127.6 Å²	127.6	78.4 Å²	78.4	60%	0.596	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.9	141.8	176.5	-70.4	-168.6	177.1	0	0	111.5	P1733 W1734 K1735	P1733-E1749 HydrophobicContact CB-CB 4.11Å; P1733-E1749 HydrophobicContact CB-CG 4.45Å; P1733-E1749 HydrophobicContact CG-CB 4.25Å; P1733-E1749 HydrophobicContact CG-CG 4.24Å; P1733-E1749 VanDerWaalsContact CG-OE2 3.25Å; P1733-E1749 WeakPolarHBondContact CG-OE2 3.46Å; W1734-E1749 CarbonylContact O-C 3.5Å; W1734-E1749 VanDerWaalsContact O-CA 3.28Å; W1734-E1749 WeakPolarHBondContact O-CA 3.4Å; K1735-E1749 HydrophobicContact CB-CG 4.37Å; K1735-E1749 HydrophobicContact CG-CG 4.27Å
1750	F	82.9	Confident	72.7	Confident	23 Å²	23	82.1 Å²	82.1	10%	0.101	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	151.5	176.3	48.3	-94.3	0	0	0	111	L1726 P1733 W1734 L1736 T1748 P1752 L1775 I1782	L1726-F1750 HydrophobicContact CD1-CE1 4.35Å; L1726-F1750 HydrophobicContact CD1-CE2 4.3Å; L1726-F1750 HydrophobicContact CD1-CZ 3.72Å; P1733-F1750 CarbonylContact C-O 3.59Å; P1733-F1750 WeakPolarHBondContact CA-O 3.25Å; P1733-F1750 WeakPolarHBondContact CB-O 3.32Å; W1734-F1750 HydrophobicContact CB-CD2 3.99Å; W1734-F1750 HydrophobicContact CB-CE2 3.56Å; W1734-F1750 VanDerWaalsContact CB-CE2 3.41Å; W1734-F1750 HydrophobicContact CB-CZ 4.06Å; W1734-F1750 HydrophobicContact CD2-CE2 4.36Å; W1734-F1750 AromaticContact CE3-CE2 3.89Å; W1734-F1750 HydrophobicContact CE3-CE2 3.98Å; W1734-F1750 HydrophobicContact CE3-CZ 4.33Å; W1734-F1750 HydrophobicContact CG-CE2 4.32Å; W1734-F1750 PolarHBondContact N-O 2.99Å; W1734-F1750 PolarHBondContact O-N 3.2Å; L1736-F1750 HydrophobicContact CB-CE1 3.83Å; L1736-F1750 HydrophobicContact CB-CZ 4.15Å; T1748-F1750 HydrophobicContact CG2-CD1 4.3Å; T1748-F1750 HydrophobicContact CG2-CE1 4.25Å; F1750-P1752 HydrophobicContact CD2-CG 4.45Å; F1750-P1752 VanDerWaalsContact O-CD 3.23Å; F1750-P1752 WeakPolarHBondContact O-CD 3.36Å; F1750-L1775 HydrophobicContact CE1-CD2 4.34Å; F1750-L1775 HydrophobicContact CE2-CD2 4.17Å; F1750-L1775 HydrophobicContact CZ-CD2 3.6Å; F1750-I1782 HydrophobicContact CB-CG2 3.77Å; F1750-I1782 WeakPolarHBondContact CB-O 3.35Å; F1750-I1782 HydrophobicContact CD1-CG2 4.27Å; F1750-I1782 HydrophobicContact CD2-CB 4.45Å; F1750-I1782 HydrophobicContact CD2-CD1 3.53Å; F1750-I1782 VanDerWaalsContact CD2-CD1 3.45Å; F1750-I1782 HydrophobicContact CD2-CG1 4.39Å; F1750-I1782 HydrophobicContact CD2-CG2 3.38Å; F1750-I1782 VanDerWaalsContact CD2-CG2 3.4Å; F1750-I1782 HydrophobicContact CE2-CD1 3.26Å; F1750-I1782 HydrophobicContact CE2-CG1 4.25Å; F1750-I1782 HydrophobicContact CE2-CG2 3.97Å; F1750-I1782 HydrophobicContact CG-CD1 4.26Å; F1750-I1782 HydrophobicContact CG-CG2 3.54Å; F1750-I1782 VanDerWaalsContact CG-CG2 3.49Å; F1750-I1782 HydrophobicContact CZ-CD1 3.98Å
1751	K	75	Confident	72	Confident	171.6 Å²	171.6	83.3 Å²	83.3	75%	0.746	44%	0.443	S	S	*	.			trans	-104.1	98.3	176.2	-107.6	178.5	-178.6	177.7	0	109	R1732 P1733 N1753	R1732-K1751 HydrophobicContact CB-CG 4.48Å; P1733-K1751 HydrophobicContact CB-CG 4.14Å; P1733-K1751 HydrophobicContact CG-CG 4.1Å; K1751-N1753 PolarHBondContact O-N 2.92Å
1752	P	68.5	Low	71.8	Confident	12.4 Å²	12.4	77.4 Å²	77.4	8%	0.081	41%	0.411	C	S	.	.			trans	-68.2	141.5	178.5	31.1	-35.9	0	0	0	109.9	R1732 W1734 F1750 L1754 V1777 I1782	R1732-P1752 PolarHBondContact NE-O 3.41Å; R1732-P1752 PolarHBondContact NH1-O 3.1Å; R1732-P1752 VanDerWaalsContact NH1-O 3.13Å; R1732-P1752 PolarHBondContact NH2-O 3.22Å; W1734-P1752 HydrophobicContact CB-CG 4.47Å; W1734-P1752 HydrophobicContact CD2-CB 4.41Å; W1734-P1752 HydrophobicContact CD2-CG 3.55Å; W1734-P1752 VanDerWaalsContact CD2-CG 3.5Å; W1734-P1752 VanDerWaalsContact CE2-CG 3.5Å; W1734-P1752 HydrophobicContact CE3-CB 4.41Å; W1734-P1752 HydrophobicContact CE3-CG 3.93Å; W1734-P1752 HydrophobicContact CG-CG 3.88Å; W1734-P1752 HydrophobicContact CH2-CG 4.19Å; W1734-P1752 HydrophobicContact CZ2-CG 4.01Å; W1734-P1752 HydrophobicContact CZ3-CG 4.29Å; F1750-P1752 HydrophobicContact CD2-CG 4.45Å; F1750-P1752 VanDerWaalsContact O-CD 3.23Å; F1750-P1752 WeakPolarHBondContact O-CD 3.36Å; P1752-L1754 HydrophobicContact CB-CD1 4.16Å; P1752-L1754 HydrophobicContact CB-CG 4.31Å; P1752-L1754 HydrophobicContact CG-CD1 4.07Å; P1752-L1754 HydrophobicContact CG-CG 4.34Å; P1752-L1754 PolarHBondContact O-N 2.95Å; P1752-V1777 HydrophobicContact CB-CG1 4.42Å; P1752-I1782 HydrophobicContact CB-CD1 4.09Å; P1752-I1782 HydrophobicContact CB-CG2 4.36Å
1753	N	63.5	Low	71.9	Confident	131.2 Å²	131.2	75.7 Å²	75.7	70%	0.702	39%	0.388	S	S	*	.			trans	-88.2	64.7	179.7	-159.6	-1.3	0	0	0	110.5	K1751	K1751-N1753 PolarHBondContact O-N 2.92Å
1754	L	60.3	Low	72.2	Confident	32.8 Å²	32.8	70.2 Å²	70.2	17%	0.172	36%	0.359	C	S	.	.			trans	-80.2	135.7	174.3	-70.6	169.1	0	0	0	110.5	R1732 W1734 P1752 D1758 I1762 V1777 N1778	R1732-L1754 PolarHBondContact NH2-O 2.76Å; W1734-L1754 HydrophobicContact CH2-CD1 3.59Å; W1734-L1754 VanDerWaalsContact CH2-CD1 3.49Å; W1734-L1754 HydrophobicContact CZ2-CD1 3.32Å; W1734-L1754 VanDerWaalsContact CZ2-CD1 3.49Å; W1734-L1754 HydrophobicContact CZ2-CG 4.47Å; W1734-L1754 HydrophobicContact CZ3-CD1 4.29Å; P1752-L1754 HydrophobicContact CB-CD1 4.16Å; P1752-L1754 HydrophobicContact CB-CG 4.31Å; P1752-L1754 HydrophobicContact CG-CD1 4.07Å; P1752-L1754 HydrophobicContact CG-CG 4.34Å; P1752-L1754 PolarHBondContact O-N 2.95Å; L1754-D1758 WeakPolarHBondContact CA-OD2 3.38Å; L1754-D1758 HydrophobicContact CD2-CB 3.87Å; L1754-D1758 WeakPolarHBondContact CD2-OD2 3.38Å; L1754-I1762 HydrophobicContact CD1-CD1 4.14Å; L1754-I1762 HydrophobicContact CD2-CG2 4.34Å; L1754-V1777 HydrophobicContact CD2-CG1 3.96Å; L1754-V1777 HydrophobicContact CG-CG1 4.37Å; L1754-N1778 WeakPolarHBondContact CD2-ND2 3.38Å
1755	Q	55.8	Low	72.2	Confident	102.6 Å²	102.6	67.4 Å²	67.4	48%	0.479	35%	0.348	S	S	.	.			trans	-96	158.4	168.5	-57.7	-173.5	-0.8	0	0	109.4	N1254 I1757 D1758	N1254-Q1755 PolarHBondContact ND2-OE1 3.36Å; Q1755-I1757 HydrophobicContact CB-CB 4.09Å; Q1755-I1757 HydrophobicContact CB-CD1 3.79Å; Q1755-I1757 VanDerWaalsContact CB-CD1 3.42Å; Q1755-I1757 HydrophobicContact CB-CG1 3.91Å; Q1755-I1757 HydrophobicContact CG-CD1 4.32Å; Q1755-I1757 PolarHBondContact O-N 3.04Å; Q1755-I1757 VanDerWaalsContact O-N 3.09Å; Q1755-D1758 PolarHBondContact N-OD2 2.98Å; Q1755-D1758 WeakPolarHBondContact O-CB 3.36Å; Q1755-D1758 PolarHBondContact O-N 3.06Å
1756	V	45.1	Very low	72.5	Confident	120.4 Å²	120.4	62.1 Å²	62.1	73%	0.73	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-56.8	-26	-179.2	-175	0	0	0	0	112.3	D1758 L1759	V1756-D1758 VanDerWaalsContact C-N 3.31Å; V1756-D1758 PolarHBondContact O-N 3.03Å; V1756-L1759 HydrophobicContact CG1-CD1 4.26Å; V1756-L1759 WeakPolarHBondContact O-CB 3.4Å; V1756-L1759 VanDerWaalsContact O-CD1 3.31Å; V1756-L1759 WeakPolarHBondContact O-CD1 3.43Å; V1756-L1759 VanDerWaalsContact O-CG 3.3Å; V1756-L1759 WeakPolarHBondContact O-CG 3.44Å; V1756-L1759 PolarHBondContact O-N 2.84Å
1757	I	43	Very low	72.6	Confident	68.4 Å²	68.4	59 Å²	59	35%	0.351	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-67.5	-24	174.7	-5.8	163.7	0	0	0	114	N1254 Q1528 R1586 A1587 Q1755 L1759	N1254-I1757 HydrophobicContact CB-CB 3.59Å; N1254-I1757 HydrophobicContact CB-CD1 3.35Å; N1254-I1757 HydrophobicContact CB-CG1 3.24Å; N1254-I1757 HydrophobicContact CB-CG2 3.68Å; N1254-I1757 WeakPolarHBondContact ND2-CD1 3.25Å; N1254-I1757 WeakPolarHBondContact O-CG2 3.35Å; Q1528-I1757 HydrophobicContact CG-CD1 4.28Å; R1586-I1757 HydrophobicContact CB-CG2 4.42Å; A1587-I1757 HydrophobicContact CB-CB 3.63Å; A1587-I1757 HydrophobicContact CB-CG2 3.68Å; Q1755-I1757 HydrophobicContact CB-CB 4.09Å; Q1755-I1757 HydrophobicContact CB-CD1 3.79Å; Q1755-I1757 VanDerWaalsContact CB-CD1 3.42Å; Q1755-I1757 HydrophobicContact CB-CG1 3.91Å; Q1755-I1757 HydrophobicContact CG-CD1 4.32Å; Q1755-I1757 PolarHBondContact O-N 3.04Å; Q1755-I1757 VanDerWaalsContact O-N 3.09Å; I1757-L1759 PolarHBondContact O-N 3.34Å
1758	D	54.1	Low	72.5	Confident	30.4 Å²	30.4	56.9 Å²	56.9	16%	0.163	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-79.6	-16.7	-175.6	-60.7	-35.2	0	0	0	112.8	L1754 Q1755 V1756 N1760 N1761 I1762 N1778	L1754-D1758 WeakPolarHBondContact CA-OD2 3.38Å; L1754-D1758 HydrophobicContact CD2-CB 3.87Å; L1754-D1758 WeakPolarHBondContact CD2-OD2 3.38Å; Q1755-D1758 PolarHBondContact N-OD2 2.98Å; Q1755-D1758 WeakPolarHBondContact O-CB 3.36Å; Q1755-D1758 PolarHBondContact O-N 3.06Å; V1756-D1758 VanDerWaalsContact C-N 3.31Å; V1756-D1758 PolarHBondContact O-N 3.03Å; D1758-N1760 VanDerWaalsContact C-N 3.29Å; D1758-N1760 PolarHBondContact O-N 3.02Å; D1758-N1761 CarbonylContact O-C 3.53Å; D1758-N1761 VanDerWaalsContact O-C 3.32Å; D1758-N1761 PolarHBondContact O-N 3.04Å; D1758-N1761 VanDerWaalsContact O-N 3.12Å; D1758-I1762 HydrophobicContact CB-CG1 4.45Å; D1758-I1762 VanDerWaalsContact O-CG1 3.25Å; D1758-I1762 WeakPolarHBondContact O-CG1 3.37Å; D1758-N1778 VanDerWaalsContact CB-ND2 3.3Å; D1758-N1778 WeakPolarHBondContact CB-ND2 3.39Å; D1758-N1778 VanDerWaalsContact CG-ND2 3.28Å; D1758-N1778 PolarHBondContact OD1-ND2 2.86Å; D1758-N1778 VanDerWaalsContact OD1-ND2 3.11Å; D1758-N1778 PolarHBondContact OD2-ND2 3.15Å; D1758-N1778 VanDerWaalsContact OD2-ND2 3.12Å
1759	L	60.5	Low	71.9	Confident	40.4 Å²	40.4	57.8 Å²	57.8	21%	0.212	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-62.4	-19.5	-170.6	-60	174.6	0	0	0	114.7	L1705 P1709 L1730 V1756 I1757 N1761	L1705-L1759 HydrophobicContact CB-CB 4.41Å; L1705-L1759 HydrophobicContact CD1-CB 4.35Å; L1705-L1759 HydrophobicContact CD1-CD2 3.94Å; L1705-L1759 PolarHBondContact N-O 3.09Å; L1705-L1759 VanDerWaalsContact N-O 3.12Å; P1709-L1759 HydrophobicContact CG-CD1 4.07Å; L1730-L1759 HydrophobicContact CD1-CD2 4.07Å; L1730-L1759 HydrophobicContact CD2-CD2 4.09Å; V1756-L1759 HydrophobicContact CG1-CD1 4.26Å; V1756-L1759 WeakPolarHBondContact O-CB 3.4Å; V1756-L1759 VanDerWaalsContact O-CD1 3.31Å; V1756-L1759 WeakPolarHBondContact O-CD1 3.43Å; V1756-L1759 VanDerWaalsContact O-CG 3.3Å; V1756-L1759 WeakPolarHBondContact O-CG 3.44Å; V1756-L1759 PolarHBondContact O-N 2.84Å; I1757-L1759 PolarHBondContact O-N 3.34Å; L1759-N1761 VanDerWaalsContact C-N 3.34Å
1760	N	63	Low	71.2	Confident	97.2 Å²	97.2	56.6 Å²	56.6	52%	0.52	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-81.1	-20.3	-179.9	-67.4	-24.5	0	0	0	113.4	R1255 N1589 A1704 D1758	R1255-N1760 PolarHBondContact NH2-ND2 3.23Å; N1589-N1760 PolarHBondContact ND2-O 3.35Å; A1704-N1760 WeakPolarHBondContact CA-O 3.29Å; A1704-N1760 VanDerWaalsContact CB-O 3.31Å; A1704-N1760 WeakPolarHBondContact CB-O 3.37Å; D1758-N1760 VanDerWaalsContact C-N 3.29Å; D1758-N1760 PolarHBondContact O-N 3.02Å
1761	N	70.4	Confident	71	Confident	57.2 Å²	57.2	57.6 Å²	57.6	31%	0.306	32%	0.323	S	S	.	.			trans	-163.8	101.7	174.7	-176.7	17.3	0	0	0	110.4	H1524 T1526 N1702 I1703 D1758 L1759 P1763	H1524-N1761 PolarHBondContact CE1-ND2 2.8Å; T1526-N1761 WeakPolarHBondContact OG1-CB 3.24Å; T1526-N1761 PolarHBondContact OG1-ND2 2.85Å; N1702-N1761 WeakPolarHBondContact CB-OD1 3.14Å; I1703-N1761 CarbonylContact O-C 3.53Å; I1703-N1761 WeakPolarHBondContact O-CA 3.38Å; D1758-N1761 CarbonylContact O-C 3.53Å; D1758-N1761 VanDerWaalsContact O-C 3.32Å; D1758-N1761 PolarHBondContact O-N 3.04Å; D1758-N1761 VanDerWaalsContact O-N 3.12Å; L1759-N1761 VanDerWaalsContact C-N 3.34Å; N1761-P1763 WeakPolarHBondContact O-CD 3.38Å
1762	I	79.2	Confident	71.6	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	97.3	178	-51.3	174.3	0	0	0	108.1	I1703 L1705 F1712 W1734 L1754 D1758 L1764 V1777	I1703-I1762 HydrophobicContact CB-CB 4.5Å; I1703-I1762 PolarHBondContact N-O 3.09Å; I1703-I1762 PolarHBondContact O-N 2.96Å; L1705-I1762 HydrophobicContact CD1-CD1 3.8Å; L1705-I1762 HydrophobicContact CG-CD1 4.28Å; F1712-I1762 HydrophobicContact CE1-CD1 4.09Å; F1712-I1762 HydrophobicContact CZ-CD1 4.32Å; W1734-I1762 HydrophobicContact CH2-CG2 4.44Å; L1754-I1762 HydrophobicContact CD1-CD1 4.14Å; L1754-I1762 HydrophobicContact CD2-CG2 4.34Å; D1758-I1762 HydrophobicContact CB-CG1 4.45Å; D1758-I1762 VanDerWaalsContact O-CG1 3.25Å; D1758-I1762 WeakPolarHBondContact O-CG1 3.37Å; I1762-L1764 HydrophobicContact CG2-CD2 3.67Å; I1762-L1764 HydrophobicContact CG2-CG 4.07Å; I1762-L1764 PolarHBondContact O-N 2.9Å; I1762-V1777 HydrophobicContact CG2-CG1 4Å
1763	P	80.7	Confident	72.6	Confident	30 Å²	30	53.3 Å²	53.3	20%	0.195	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	118	168.7	27.4	-34.1	0	0	0	110.8	T1700 N1702 N1761 V1777 N1778	T1700-P1763 HydrophobicContact CG2-CB 4.33Å; N1702-P1763 WeakPolarHBondContact OD1-CB 3.42Å; N1761-P1763 WeakPolarHBondContact O-CD 3.38Å; P1763-V1777 WeakPolarHBondContact O-CA 3.47Å; P1763-N1778 WeakPolarHBondContact CD-OD1 3.4Å; P1763-N1778 WeakPolarHBondContact CG-OD1 3.18Å; P1763-N1778 PolarHBondContact O-N 3.12Å; P1763-N1778 VanDerWaalsContact O-N 3.12Å
1764	L	88	Confident	73.8	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	101.8	176.8	-57.9	176	0	0	0	109	T1700 A1701 I1703 F1712 V1714 L1726 W1734 I1762 F1766 L1775 S1776 V1777	T1700-L1764 CarbonylContact C-O 3.53Å; T1700-L1764 VanDerWaalsContact CA-O 3.3Å; T1700-L1764 WeakPolarHBondContact CA-O 3.36Å; A1701-L1764 HydrophobicContact CB-CB 4.42Å; A1701-L1764 PolarHBondContact N-O 2.9Å; A1701-L1764 WeakPolarHBondContact O-CB 3.37Å; A1701-L1764 PolarHBondContact O-N 2.97Å; I1703-L1764 HydrophobicContact CD1-CD1 3.62Å; I1703-L1764 HydrophobicContact CD1-CG 4.42Å; I1703-L1764 HydrophobicContact CG1-CD1 4.38Å; F1712-L1764 HydrophobicContact CE2-CD1 3.57Å; F1712-L1764 VanDerWaalsContact CE2-CD1 3.49Å; F1712-L1764 HydrophobicContact CZ-CD1 3.89Å; V1714-L1764 HydrophobicContact CG2-CD1 4.06Å; L1726-L1764 HydrophobicContact CD2-CD1 4.04Å; L1726-L1764 HydrophobicContact CD2-CD2 4.45Å; W1734-L1764 HydrophobicContact CH2-CD2 4.36Å; W1734-L1764 HydrophobicContact CZ3-CD2 3.9Å; I1762-L1764 HydrophobicContact CG2-CD2 3.67Å; I1762-L1764 HydrophobicContact CG2-CG 4.07Å; I1762-L1764 PolarHBondContact O-N 2.9Å; L1764-F1766 HydrophobicContact CB-CE2 4.31Å; L1764-F1766 WeakPolarHBondContact O-CD2 3.47Å; L1764-L1775 HydrophobicContact CB-CD1 4.45Å; L1764-S1776 CarbonylContact C-O 3.58Å; L1764-S1776 WeakPolarHBondContact CA-O 3.37Å; L1764-V1777 HydrophobicContact CD2-CB 4.24Å; L1764-V1777 HydrophobicContact CD2-CG1 4.02Å; L1764-V1777 HydrophobicContact CD2-CG2 3.66Å; L1764-V1777 VanDerWaalsContact CD2-CG2 3.47Å
1765	T	89.3	Confident	75.2	Confident	30 Å²	30	47.1 Å²	47.1	18%	0.184	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	115.3	179.7	-59.1	0	0	0	0	110.4	T1698 T1700 T1767 L1775 S1776	T1698-T1765 HydrophobicContact CG2-CG2 4.32Å; T1700-T1765 VanDerWaalsContact CG2-OG1 3.31Å; T1700-T1765 WeakPolarHBondContact CG2-OG1 3.39Å; T1700-T1765 WeakPolarHBondContact OG1-CB 3.3Å; T1700-T1765 WeakPolarHBondContact OG1-CG2 3.34Å; T1700-T1765 PolarHBondContact OG1-OG1 3.05Å; T1765-T1767 PolarHBondContact O-N 2.77Å; T1765-L1775 CarbonylContact O-C 3.57Å; T1765-L1775 WeakPolarHBondContact O-CA 3.26Å; T1765-S1776 WeakPolarHBondContact CB-OG 3.42Å; T1765-S1776 PolarHBondContact N-O 3.09Å; T1765-S1776 PolarHBondContact O-N 3.09Å; T1765-S1776 PolarHBondContact O-OG 3.35Å
1766	F	90.8	Very high	76.7	Confident	2 Å²	2	42.6 Å²	42.6	1%	0.009	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	101.3	168.1	-59	-98.9	0	0	0	107.6	T1698 A1699 V1714 L1716 L1724 L1726 L1736 L1764 V1773 L1775	T1698-F1766 VanDerWaalsContact CA-O 3.31Å; T1698-F1766 WeakPolarHBondContact CA-O 3.4Å; A1699-F1766 HydrophobicContact CB-CB 4.45Å; A1699-F1766 PolarHBondContact N-O 3.03Å; A1699-F1766 WeakPolarHBondContact O-CB 3.32Å; A1699-F1766 WeakPolarHBondContact O-CD2 3.23Å; A1699-F1766 PolarHBondContact O-N 2.89Å; V1714-F1766 HydrophobicContact CB-CZ 4.42Å; V1714-F1766 HydrophobicContact CG1-CE2 4.14Å; V1714-F1766 HydrophobicContact CG1-CZ 4.13Å; L1716-F1766 HydrophobicContact CD1-CD1 4.15Å; L1716-F1766 HydrophobicContact CD1-CD2 4.12Å; L1716-F1766 HydrophobicContact CD1-CE1 3.87Å; L1716-F1766 HydrophobicContact CD1-CE2 3.86Å; L1716-F1766 HydrophobicContact CD1-CG 4.28Å; L1716-F1766 HydrophobicContact CD1-CZ 3.72Å; L1716-F1766 HydrophobicContact CD2-CB 4.19Å; L1716-F1766 HydrophobicContact CD2-CD1 4.16Å; L1716-F1766 HydrophobicContact CD2-CD2 4.34Å; L1716-F1766 HydrophobicContact CD2-CE1 4.49Å; L1716-F1766 HydrophobicContact CD2-CG 4.01Å; L1724-F1766 HydrophobicContact CD2-CD1 4Å; L1724-F1766 HydrophobicContact CD2-CE1 4.22Å; L1726-F1766 HydrophobicContact CB-CE1 4.47Å; L1726-F1766 HydrophobicContact CB-CZ 4.27Å; L1726-F1766 HydrophobicContact CD2-CZ 4.09Å; L1736-F1766 HydrophobicContact CD1-CE1 4.26Å; L1764-F1766 HydrophobicContact CB-CE2 4.31Å; L1764-F1766 WeakPolarHBondContact O-CD2 3.47Å; F1766-V1773 HydrophobicContact CB-CG2 3.78Å; F1766-V1773 HydrophobicContact CD1-CG2 3.96Å; F1766-V1773 HydrophobicContact CG-CG2 4.37Å; F1766-L1775 HydrophobicContact CD1-CD1 3.99Å; F1766-L1775 HydrophobicContact CD2-CD1 4.33Å; F1766-L1775 HydrophobicContact CE1-CD1 3.85Å; F1766-L1775 HydrophobicContact CE2-CD1 4.19Å; F1766-L1775 HydrophobicContact CG-CD1 4.23Å; F1766-L1775 HydrophobicContact CZ-CD1 3.95Å
1767	T	89.1	Confident	78.5	Confident	49.4 Å²	49.4	37.2 Å²	37.2	30%	0.303	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	119.6	173.6	-56.2	0	0	0	0	108.6	T1698 T1765 V1773 Q1774	T1698-T1767 HydrophobicContact CG2-CG2 4.33Å; T1765-T1767 PolarHBondContact O-N 2.77Å; T1767-V1773 CarbonylContact O-C 3.49Å; T1767-V1773 VanDerWaalsContact O-CA 3.31Å; T1767-V1773 WeakPolarHBondContact O-CA 3.32Å; T1767-Q1774 PolarHBondContact N-O 2.94Å; T1767-Q1774 PolarHBondContact O-N 3.02Å
1768	I	86.3	Confident	80	Confident	13.6 Å²	13.6	36.3 Å²	36.3	7%	0.07	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	123.5	-173.7	-67	169.8	0	0	0	108.7	L1695 P1696 K1697 M1718 F1772 V1773 L1788	L1695-I1768 HydrophobicContact CB-CG2 4.08Å; L1695-I1768 HydrophobicContact CD1-CG2 4Å; L1695-I1768 HydrophobicContact CD2-CD1 4.44Å; L1695-I1768 HydrophobicContact CG-CG2 4.35Å; P1696-I1768 HydrophobicContact CG-CD1 4.29Å; P1696-I1768 VanDerWaalsContact O-CB 3.3Å; P1696-I1768 WeakPolarHBondContact O-CB 3.44Å; P1696-I1768 WeakPolarHBondContact O-CD1 3.48Å; K1697-I1768 PolarHBondContact O-N 2.85Å; M1718-I1768 HydrophobicContact CE-CD1 4.31Å; I1768-F1772 WeakPolarHBondContact CA-O 3.33Å; I1768-V1773 HydrophobicContact CG1-CB 4.5Å; I1768-V1773 HydrophobicContact CG1-CG2 4.36Å; I1768-L1788 HydrophobicContact CG1-CD1 4.38Å; I1768-L1788 HydrophobicContact CG1-CD2 4.39Å; I1768-L1788 HydrophobicContact CG2-CD1 3.81Å; I1768-L1788 HydrophobicContact CG2-CD2 4.39Å
1769	D	77.2	Confident	80.9	Confident	73.4 Å²	73.4	37.4 Å²	37.4	39%	0.393	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.2	120.5	-170.8	173.9	29.9	0	0	0	110.5	G1771 F1772 K1785	D1769-G1771 VanDerWaalsContact C-N 3.31Å; D1769-G1771 PolarHBondContact O-N 2.98Å; D1769-G1771 VanDerWaalsContact O-N 3.14Å; D1769-F1772 PolarHBondContact N-O 3.03Å; D1769-F1772 WeakPolarHBondContact O-CA 3.29Å; D1769-F1772 PolarHBondContact O-N 2.83Å; D1769-F1772 VanDerWaalsContact O-O 3.11Å; D1769-K1785 PolarHBondContact O-NZ 2.81Å; D1769-K1785 VanDerWaalsContact O-NZ 3.14Å; D1769-K1785 WeakPolarHBondContact OD2-CE 3.36Å; D1769-K1785 IonicContact OD2-NZ 3.15Å; D1769-K1785 PolarHBondContact OD2-NZ 3.24Å
1770	S	73.5	Confident	81.6	Confident	102.8 Å²	102.8	43 Å²	43	72%	0.719	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.7	44.3	171.5	-55.2	0	0	0	0	115.2	F1772	S1770-F1772 VanDerWaalsContact C-N 3.3Å; S1770-F1772 VanDerWaalsContact O-CD2 3.28Å; S1770-F1772 WeakPolarHBondContact O-CD2 3.38Å; S1770-F1772 PolarHBondContact O-N 3.03Å
1771	G	78.4	Confident	82.5	Confident	44.4 Å²	44.4	43.6 Å²	43.6	46%	0.458	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.3	1.9	-179.8	0	0	0	0	0	115.1	D1769 L1788	D1769-G1771 VanDerWaalsContact C-N 3.31Å; D1769-G1771 PolarHBondContact O-N 2.98Å; D1769-G1771 VanDerWaalsContact O-N 3.14Å; G1771-L1788 WeakPolarHBondContact O-CB 3.37Å; G1771-L1788 WeakPolarHBondContact O-CG 3.4Å; G1771-L1788 PolarHBondContact O-N 2.82Å; G1771-L1788 VanDerWaalsContact O-N 3.1Å
1772	F	86.5	Confident	82.6	Confident	91.6 Å²	91.6	42.5 Å²	42.5	40%	0.402	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	158.1	176.8	-61.5	-90.8	0	0	0	112	I1768 D1769 S1770 K1785 F1786 P1787	I1768-F1772 WeakPolarHBondContact CA-O 3.33Å; D1769-F1772 PolarHBondContact N-O 3.03Å; D1769-F1772 WeakPolarHBondContact O-CA 3.29Å; D1769-F1772 PolarHBondContact O-N 2.83Å; D1769-F1772 VanDerWaalsContact O-O 3.11Å; S1770-F1772 VanDerWaalsContact C-N 3.3Å; S1770-F1772 VanDerWaalsContact O-CD2 3.28Å; S1770-F1772 WeakPolarHBondContact O-CD2 3.38Å; S1770-F1772 PolarHBondContact O-N 3.03Å; F1772-K1785 HydrophobicContact CB-CB 4.03Å; F1772-K1785 HydrophobicContact CB-CD 4.06Å; F1772-K1785 HydrophobicContact CB-CG 4.23Å; F1772-K1785 HydrophobicContact CD1-CB 4.23Å; F1772-K1785 HydrophobicContact CD2-CD 4.32Å; F1772-K1785 HydrophobicContact CG-CB 4.22Å; F1772-K1785 HydrophobicContact CG-CD 4.29Å; F1772-F1786 CarbonylContact C-O 3.35Å; F1772-F1786 VanDerWaalsContact CA-O 3.26Å; F1772-F1786 WeakPolarHBondContact CA-O 3.32Å; F1772-F1786 WeakPolarHBondContact CB-O 3.38Å; F1772-P1787 HydrophobicContact CD1-CB 4.35Å; F1772-P1787 HydrophobicContact CE1-CB 4.16Å
1773	V	89.3	Confident	82.2	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.006	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	137.1	166.8	64.6	0	0	0	0	110.6	L1724 L1736 F1766 T1767 I1768 K1785 F1786 L1788	L1724-V1773 HydrophobicContact CD1-CG1 4.23Å; L1724-V1773 HydrophobicContact CD2-CB 4.34Å; L1724-V1773 HydrophobicContact CD2-CG1 3.8Å; L1724-V1773 HydrophobicContact CD2-CG2 4.26Å; L1736-V1773 HydrophobicContact CD2-CG1 4.4Å; F1766-V1773 HydrophobicContact CB-CG2 3.78Å; F1766-V1773 HydrophobicContact CD1-CG2 3.96Å; F1766-V1773 HydrophobicContact CG-CG2 4.37Å; T1767-V1773 CarbonylContact O-C 3.49Å; T1767-V1773 VanDerWaalsContact O-CA 3.31Å; T1767-V1773 WeakPolarHBondContact O-CA 3.32Å; I1768-V1773 HydrophobicContact CG1-CB 4.5Å; I1768-V1773 HydrophobicContact CG1-CG2 4.36Å; V1773-K1785 WeakPolarHBondContact O-CA 3.34Å; V1773-F1786 HydrophobicContact CG1-CB 4.01Å; V1773-F1786 HydrophobicContact CG1-CD1 4.36Å; V1773-F1786 WeakPolarHBondContact CG1-O 3.13Å; V1773-F1786 PolarHBondContact N-O 3.13Å; V1773-F1786 PolarHBondContact O-N 3.01Å; V1773-L1788 HydrophobicContact CB-CD2 3.73Å; V1773-L1788 HydrophobicContact CB-CG 4.35Å; V1773-L1788 HydrophobicContact CG1-CD2 4.15Å
1774	Q	89.7	Confident	81.9	Confident	29.2 Å²	29.2	52.5 Å²	52.5	14%	0.136	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	110.1	165.1	-178.2	65.7	70.6	0	0	108	T1767 N1781 I1782 G1783 K1785	T1767-Q1774 PolarHBondContact N-O 2.94Å; T1767-Q1774 PolarHBondContact O-N 3.02Å; Q1774-N1781 HydrophobicContact CG-CB 4.16Å; Q1774-N1781 VanDerWaalsContact CG-ND2 3.33Å; Q1774-N1781 WeakPolarHBondContact CG-ND2 3.2Å; Q1774-I1782 PolarHBondContact NE2-O 3.16Å; Q1774-I1782 VanDerWaalsContact NE2-O 3.12Å; Q1774-G1783 PolarHBondContact NE2-O 2.82Å; Q1774-K1785 HydrophobicContact CB-CG 4.39Å
1775	L	90	Very high	81.6	Confident	4.4 Å²	4.4	57.2 Å²	57.2	2%	0.023	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	137.3	173.2	179.9	62	0	0	0	110.2	L1726 F1750 L1764 T1765 F1766 V1777 N1781 I1782	L1726-L1775 HydrophobicContact CD1-CD2 4.02Å; L1726-L1775 HydrophobicContact CD2-CD1 4.31Å; L1726-L1775 HydrophobicContact CD2-CD2 3.93Å; L1726-L1775 HydrophobicContact CG-CD2 4.49Å; F1750-L1775 HydrophobicContact CE1-CD2 4.34Å; F1750-L1775 HydrophobicContact CE2-CD2 4.17Å; F1750-L1775 HydrophobicContact CZ-CD2 3.6Å; L1764-L1775 HydrophobicContact CB-CD1 4.45Å; T1765-L1775 CarbonylContact O-C 3.57Å; T1765-L1775 WeakPolarHBondContact O-CA 3.26Å; F1766-L1775 HydrophobicContact CD1-CD1 3.99Å; F1766-L1775 HydrophobicContact CD2-CD1 4.33Å; F1766-L1775 HydrophobicContact CE1-CD1 3.85Å; F1766-L1775 HydrophobicContact CE2-CD1 4.19Å; F1766-L1775 HydrophobicContact CG-CD1 4.23Å; F1766-L1775 HydrophobicContact CZ-CD1 3.95Å; L1775-V1777 HydrophobicContact CD2-CG2 4.46Å; L1775-V1777 HydrophobicContact CG-CG2 4.37Å; L1775-N1781 WeakPolarHBondContact O-CA 3.33Å; L1775-I1782 HydrophobicContact CB-CG1 4.43Å; L1775-I1782 HydrophobicContact CD2-CD1 3.69Å; L1775-I1782 HydrophobicContact CD2-CG1 4.19Å; L1775-I1782 HydrophobicContact CG-CD1 3.91Å; L1775-I1782 HydrophobicContact CG-CG1 4.12Å; L1775-I1782 PolarHBondContact O-N 3.19Å
1776	S	85.7	Confident	81.5	Confident	8.6 Å²	8.6	56.5 Å²	56.5	6%	0.06	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	137.6	171.5	58	0	0	0	0	110.8	L1764 T1765 R1780 N1781	L1764-S1776 CarbonylContact C-O 3.58Å; L1764-S1776 WeakPolarHBondContact CA-O 3.37Å; T1765-S1776 WeakPolarHBondContact CB-OG 3.42Å; T1765-S1776 PolarHBondContact N-O 3.09Å; T1765-S1776 PolarHBondContact O-N 3.09Å; T1765-S1776 PolarHBondContact O-OG 3.35Å; S1776-R1780 CarbonylContact C-O 3.53Å; S1776-R1780 VanDerWaalsContact CA-O 3.24Å; S1776-R1780 WeakPolarHBondContact CA-O 3.29Å; S1776-R1780 WeakPolarHBondContact CB-O 3.17Å; S1776-R1780 PolarHBondContact OG-O 3.01Å; S1776-N1781 VanDerWaalsContact CB-OD1 3.29Å; S1776-N1781 WeakPolarHBondContact CB-OD1 3.37Å; S1776-N1781 WeakPolarHBondContact OG-CA 3.35Å; S1776-N1781 PolarHBondContact OG-N 2.87Å; S1776-N1781 VanDerWaalsContact OG-N 3.15Å; S1776-N1781 PolarHBondContact OG-OD1 2.76Å
1777	V	83.7	Confident	81.3	Confident	7.2 Å²	7.2	57.9 Å²	57.9	4%	0.044	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	127.6	178	-177.6	0	0	0	0	108	W1734 P1752 L1754 I1762 P1763 L1764 L1775 G1779 R1780 I1782	W1734-V1777 HydrophobicContact CH2-CG1 4.39Å; W1734-V1777 HydrophobicContact CZ3-CG1 4.34Å; W1734-V1777 HydrophobicContact CZ3-CG2 4.12Å; P1752-V1777 HydrophobicContact CB-CG1 4.42Å; L1754-V1777 HydrophobicContact CD2-CG1 3.96Å; L1754-V1777 HydrophobicContact CG-CG1 4.37Å; I1762-V1777 HydrophobicContact CG2-CG1 4Å; P1763-V1777 WeakPolarHBondContact O-CA 3.47Å; L1764-V1777 HydrophobicContact CD2-CB 4.24Å; L1764-V1777 HydrophobicContact CD2-CG1 4.02Å; L1764-V1777 HydrophobicContact CD2-CG2 3.66Å; L1764-V1777 VanDerWaalsContact CD2-CG2 3.47Å; L1775-V1777 HydrophobicContact CD2-CG2 4.46Å; L1775-V1777 HydrophobicContact CG-CG2 4.37Å; V1777-G1779 PolarHBondContact O-N 3.12Å; V1777-G1779 VanDerWaalsContact O-N 3.14Å; V1777-R1780 PolarHBondContact N-O 3Å; V1777-R1780 WeakPolarHBondContact O-CB 3.28Å; V1777-R1780 PolarHBondContact O-N 3.02Å; V1777-I1782 HydrophobicContact CB-CD1 4.24Å; V1777-I1782 HydrophobicContact CB-CG1 4.2Å; V1777-I1782 HydrophobicContact CB-CG2 4.07Å; V1777-I1782 HydrophobicContact CG2-CB 4.49Å; V1777-I1782 HydrophobicContact CG2-CD1 3.69Å; V1777-I1782 VanDerWaalsContact CG2-CD1 3.41Å; V1777-I1782 HydrophobicContact CG2-CG1 3.84Å; V1777-I1782 HydrophobicContact CG2-CG2 4.03Å
1778	N	75.2	Confident	81.1	Confident	49.4 Å²	49.4	56.6 Å²	56.6	26%	0.264	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	36.2	-176.1	-62	-2.5	0	0	0	112.3	L1754 D1758 P1763 R1780	L1754-N1778 WeakPolarHBondContact CD2-ND2 3.38Å; D1758-N1778 VanDerWaalsContact CB-ND2 3.3Å; D1758-N1778 WeakPolarHBondContact CB-ND2 3.39Å; D1758-N1778 VanDerWaalsContact CG-ND2 3.28Å; D1758-N1778 PolarHBondContact OD1-ND2 2.86Å; D1758-N1778 VanDerWaalsContact OD1-ND2 3.11Å; D1758-N1778 PolarHBondContact OD2-ND2 3.15Å; D1758-N1778 VanDerWaalsContact OD2-ND2 3.12Å; P1763-N1778 WeakPolarHBondContact CD-OD1 3.4Å; P1763-N1778 WeakPolarHBondContact CG-OD1 3.18Å; P1763-N1778 PolarHBondContact O-N 3.12Å; P1763-N1778 VanDerWaalsContact O-N 3.12Å; N1778-R1780 VanDerWaalsContact C-N 3.29Å; N1778-R1780 PolarHBondContact O-N 3.08Å
1779	G	72.4	Confident	81.1	Confident	52.6 Å²	52.6	56.8 Å²	56.8	54%	0.542	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.9	11.9	-177.4	0	0	0	0	0	115.6	V1777	V1777-G1779 PolarHBondContact O-N 3.12Å; V1777-G1779 VanDerWaalsContact O-N 3.14Å
1780	R	75	Confident	81.3	Confident	159.2 Å²	159.2	54.2 Å²	54.2	60%	0.601	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.5	125.3	174	-63.8	-175.2	-178.2	174.5	3.6	110.6	S1776 V1777 N1778 I1782	S1776-R1780 CarbonylContact C-O 3.53Å; S1776-R1780 VanDerWaalsContact CA-O 3.24Å; S1776-R1780 WeakPolarHBondContact CA-O 3.29Å; S1776-R1780 WeakPolarHBondContact CB-O 3.17Å; S1776-R1780 PolarHBondContact OG-O 3.01Å; V1777-R1780 PolarHBondContact N-O 3Å; V1777-R1780 WeakPolarHBondContact O-CB 3.28Å; V1777-R1780 PolarHBondContact O-N 3.02Å; N1778-R1780 VanDerWaalsContact C-N 3.29Å; N1778-R1780 PolarHBondContact O-N 3.08Å; R1780-I1782 WeakPolarHBondContact O-CD1 3.4Å; R1780-I1782 WeakPolarHBondContact O-CG1 3.43Å; R1780-I1782 PolarHBondContact O-N 3.03Å
1781	N	81.2	Confident	81.4	Confident	108.6 Å²	108.6	55.3 Å²	55.3	58%	0.581	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.7	131.6	172.9	-65.6	0.3	0	0	0	110.1	Q1774 L1775 S1776	Q1774-N1781 HydrophobicContact CG-CB 4.16Å; Q1774-N1781 VanDerWaalsContact CG-ND2 3.33Å; Q1774-N1781 WeakPolarHBondContact CG-ND2 3.2Å; L1775-N1781 WeakPolarHBondContact O-CA 3.33Å; S1776-N1781 VanDerWaalsContact CB-OD1 3.29Å; S1776-N1781 WeakPolarHBondContact CB-OD1 3.37Å; S1776-N1781 WeakPolarHBondContact OG-CA 3.35Å; S1776-N1781 PolarHBondContact OG-N 2.87Å; S1776-N1781 VanDerWaalsContact OG-N 3.15Å; S1776-N1781 PolarHBondContact OG-OD1 2.76Å
1782	I	74.2	Confident	81.3	Confident	36 Å²	36	58 Å²	58	19%	0.185	30%	0.302	C	S	.	.			trans	-115.1	86.8	-178.5	-14.7	-145.2	0	0	0	111.5	W1734 F1750 P1752 Q1774 L1775 V1777 R1780	W1734-I1782 HydrophobicContact CE3-CD1 4.38Å; F1750-I1782 HydrophobicContact CB-CG2 3.77Å; F1750-I1782 WeakPolarHBondContact CB-O 3.35Å; F1750-I1782 HydrophobicContact CD1-CG2 4.27Å; F1750-I1782 HydrophobicContact CD2-CB 4.45Å; F1750-I1782 HydrophobicContact CD2-CD1 3.53Å; F1750-I1782 VanDerWaalsContact CD2-CD1 3.45Å; F1750-I1782 HydrophobicContact CD2-CG1 4.39Å; F1750-I1782 HydrophobicContact CD2-CG2 3.38Å; F1750-I1782 VanDerWaalsContact CD2-CG2 3.4Å; F1750-I1782 HydrophobicContact CE2-CD1 3.26Å; F1750-I1782 HydrophobicContact CE2-CG1 4.25Å; F1750-I1782 HydrophobicContact CE2-CG2 3.97Å; F1750-I1782 HydrophobicContact CG-CD1 4.26Å; F1750-I1782 HydrophobicContact CG-CG2 3.54Å; F1750-I1782 VanDerWaalsContact CG-CG2 3.49Å; F1750-I1782 HydrophobicContact CZ-CD1 3.98Å; P1752-I1782 HydrophobicContact CB-CD1 4.09Å; P1752-I1782 HydrophobicContact CB-CG2 4.36Å; Q1774-I1782 PolarHBondContact NE2-O 3.16Å; Q1774-I1782 VanDerWaalsContact NE2-O 3.12Å; L1775-I1782 HydrophobicContact CB-CG1 4.43Å; L1775-I1782 HydrophobicContact CD2-CD1 3.69Å; L1775-I1782 HydrophobicContact CD2-CG1 4.19Å; L1775-I1782 HydrophobicContact CG-CD1 3.91Å; L1775-I1782 HydrophobicContact CG-CG1 4.12Å; L1775-I1782 PolarHBondContact O-N 3.19Å; V1777-I1782 HydrophobicContact CB-CD1 4.24Å; V1777-I1782 HydrophobicContact CB-CG1 4.2Å; V1777-I1782 HydrophobicContact CB-CG2 4.07Å; V1777-I1782 HydrophobicContact CG2-CB 4.49Å; V1777-I1782 HydrophobicContact CG2-CD1 3.69Å; V1777-I1782 VanDerWaalsContact CG2-CD1 3.41Å; V1777-I1782 HydrophobicContact CG2-CG1 3.84Å; V1777-I1782 HydrophobicContact CG2-CG2 4.03Å; R1780-I1782 WeakPolarHBondContact O-CD1 3.4Å; R1780-I1782 WeakPolarHBondContact O-CG1 3.43Å; R1780-I1782 PolarHBondContact O-N 3.03Å
1783	G	70.3	Confident	80.9	Confident	45.4 Å²	45.4	54.3 Å²	54.3	47%	0.468	29%	0.286	S	S	.	.	S	Bend	trans	112.2	-178.2	178.7	0	0	0	0	0	113.3	Q1774	Q1774-G1783 PolarHBondContact NE2-O 2.82Å
1784	K	75.1	Confident	80.3	Confident	193.4 Å²	193.4	57.9 Å²	57.9	84%	0.841	30%	0.303	S	S	*	.			trans	-73.7	163.7	168.4	-63.9	-179.4	179.7	179.3	0	109.9	F1786	K1784-F1786 PolarHBondContact O-N 3.2Å
1785	K	81.8	Confident	79.7	Confident	98 Å²	98	59.7 Å²	59.7	43%	0.426	32%	0.316	S	S	.	.			trans	-50.7	130.7	163.7	-81.6	-171.8	171.5	-166.9	0	109.8	D1769 F1772 V1773 Q1774	D1769-K1785 PolarHBondContact O-NZ 2.81Å; D1769-K1785 VanDerWaalsContact O-NZ 3.14Å; D1769-K1785 WeakPolarHBondContact OD2-CE 3.36Å; D1769-K1785 IonicContact OD2-NZ 3.15Å; D1769-K1785 PolarHBondContact OD2-NZ 3.24Å; F1772-K1785 HydrophobicContact CB-CB 4.03Å; F1772-K1785 HydrophobicContact CB-CD 4.06Å; F1772-K1785 HydrophobicContact CB-CG 4.23Å; F1772-K1785 HydrophobicContact CD1-CB 4.23Å; F1772-K1785 HydrophobicContact CD2-CD 4.32Å; F1772-K1785 HydrophobicContact CG-CB 4.22Å; F1772-K1785 HydrophobicContact CG-CD 4.29Å; V1773-K1785 WeakPolarHBondContact O-CA 3.34Å; Q1774-K1785 HydrophobicContact CB-CG 4.39Å
1786	F	86.8	Confident	79.3	Confident	15.6 Å²	15.6	60.9 Å²	60.9	7%	0.068	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	142	-178.6	-170.1	-98.6	0	0	0	109.2	L1724 L1736 Q1738 K1746 T1748 F1772 V1773 K1784	L1724-F1786 HydrophobicContact CD1-CD1 3.8Å; L1724-F1786 HydrophobicContact CD1-CE1 3.84Å; L1736-F1786 HydrophobicContact CD2-CB 3.96Å; L1736-F1786 HydrophobicContact CD2-CD1 3.81Å; L1736-F1786 HydrophobicContact CD2-CD2 4.39Å; L1736-F1786 HydrophobicContact CD2-CE1 4.42Å; L1736-F1786 HydrophobicContact CD2-CG 3.86Å; L1736-F1786 HydrophobicContact CG-CD1 4.1Å; L1736-F1786 HydrophobicContact CG-CE1 4.25Å; L1736-F1786 HydrophobicContact CG-CG 4.46Å; L1736-F1786 WeakPolarHBondContact O-CZ 3.3Å; Q1738-F1786 HydrophobicContact CB-CE1 3.99Å; Q1738-F1786 HydrophobicContact CB-CZ 4.22Å; K1746-F1786 HydrophobicContact CB-CE2 4.42Å; K1746-F1786 HydrophobicContact CB-CZ 4.08Å; T1748-F1786 HydrophobicContact CG2-CD2 3.48Å; T1748-F1786 VanDerWaalsContact CG2-CD2 3.43Å; T1748-F1786 HydrophobicContact CG2-CE2 3.68Å; T1748-F1786 HydrophobicContact CG2-CG 4.33Å; T1748-F1786 HydrophobicContact CG2-CZ 4.47Å; F1772-F1786 CarbonylContact C-O 3.35Å; F1772-F1786 VanDerWaalsContact CA-O 3.26Å; F1772-F1786 WeakPolarHBondContact CA-O 3.32Å; F1772-F1786 WeakPolarHBondContact CB-O 3.38Å; V1773-F1786 HydrophobicContact CG1-CB 4.01Å; V1773-F1786 HydrophobicContact CG1-CD1 4.36Å; V1773-F1786 WeakPolarHBondContact CG1-O 3.13Å; V1773-F1786 PolarHBondContact N-O 3.13Å; V1773-F1786 PolarHBondContact O-N 3.01Å; K1784-F1786 PolarHBondContact O-N 3.2Å
1787	P	85.2	Confident	79.1	Confident	32.4 Å²	32.4	61.8 Å²	61.8	21%	0.21	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.5	153.2	-178.6	26.8	-34.5	0	0	0	112.7	K1746 F1772	K1746-P1787 HydrophobicContact CD-CG 3.87Å; F1772-P1787 HydrophobicContact CD1-CB 4.35Å; F1772-P1787 HydrophobicContact CE1-CB 4.16Å
1788	L	85.5	Confident	79.2	Confident	21.8 Å²	21.8	62 Å²	62	11%	0.114	33%	0.334	C	S	.	.			trans	-87.6	137.8	173.6	-63.5	173.1	0	0	0	111.3	L1695 M1718 L1724 I1768 G1771 V1773 G1790	L1695-L1788 HydrophobicContact CD1-CD1 3.8Å; L1695-L1788 HydrophobicContact CD2-CD1 4.38Å; M1718-L1788 HydrophobicContact CE-CB 4.46Å; M1718-L1788 HydrophobicContact CE-CD1 4.36Å; M1718-L1788 HydrophobicContact CE-CD2 3.89Å; M1718-L1788 HydrophobicContact CE-CG 4.48Å; M1718-L1788 HydrophobicContact SD-CB 4.38Å; M1718-L1788 HydrophobicContact SD-CD2 3.9Å; L1724-L1788 HydrophobicContact CD2-CD2 4.09Å; I1768-L1788 HydrophobicContact CG1-CD1 4.38Å; I1768-L1788 HydrophobicContact CG1-CD2 4.39Å; I1768-L1788 HydrophobicContact CG2-CD1 3.81Å; I1768-L1788 HydrophobicContact CG2-CD2 4.39Å; G1771-L1788 WeakPolarHBondContact O-CB 3.37Å; G1771-L1788 WeakPolarHBondContact O-CG 3.4Å; G1771-L1788 PolarHBondContact O-N 2.82Å; G1771-L1788 VanDerWaalsContact O-N 3.1Å; V1773-L1788 HydrophobicContact CB-CD2 3.73Å; V1773-L1788 HydrophobicContact CB-CG 4.35Å; V1773-L1788 HydrophobicContact CG1-CD2 4.15Å; L1788-G1790 VanDerWaalsContact C-N 3.29Å; L1788-G1790 PolarHBondContact O-N 3.08Å
1789	P	86	Confident	79.6	Confident	17.2 Å²	17.2	61.4 Å²	61.4	11%	0.112	33%	0.334	C	S	.	.	S	Bend	trans	-71.7	-16.2	172.7	20.1	-23.9	0	0	0	114	M1718 A1722 T1723 L1724 Q1738 V1740	M1718-P1789 HydrophobicContact CB-CG 4.42Å; M1718-P1789 HydrophobicContact CG-CG 4.34Å; M1718-P1789 HydrophobicContact SD-CG 4.18Å; A1722-P1789 HydrophobicContact CB-CB 4.01Å; A1722-P1789 VanDerWaalsContact CB-O 3.27Å; A1722-P1789 WeakPolarHBondContact CB-O 3.25Å; T1723-P1789 VanDerWaalsContact C-CG 3.43Å; T1723-P1789 WeakPolarHBondContact O-CG 3.36Å; L1724-P1789 HydrophobicContact CB-CG 3.82Å; Q1738-P1789 HydrophobicContact CG-CB 3.64Å; Q1738-P1789 VanDerWaalsContact CG-CB 3.43Å; Q1738-P1789 HydrophobicContact CG-CG 4.26Å; V1740-P1789 HydrophobicContact CG2-CB 4.05Å
1790	G	81.8	Confident	80.2	Confident	18.6 Å²	18.6	61.1 Å²	61.1	19%	0.192	33%	0.33	C	S	.	.			trans	-161.2	166.2	-174.9	0	0	0	0	0	113.4	M1718 L1788	M1718-G1790 VanDerWaalsContact CE-O 3.25Å; M1718-G1790 WeakPolarHBondContact CE-O 3.26Å; M1718-G1790 CarbonylContact O-C 3.54Å; M1718-G1790 WeakPolarHBondContact O-CA 3.26Å; L1788-G1790 VanDerWaalsContact C-N 3.29Å; L1788-G1790 PolarHBondContact O-N 3.08Å
1791	N	76.2	Confident	80.7	Confident	127.6 Å²	127.6	55.5 Å²	55.5	68%	0.682	31%	0.312	S	S	*	.	S	Bend	trans	-102.3	4.6	-171.1	65.8	-2	0	0	0	114.4	L1695 M1718	L1695-N1791 WeakPolarHBondContact CD2-O 3.31Å; L1695-N1791 WeakPolarHBondContact CG-O 3.4Å; M1718-N1791 PolarHBondContact O-N 3.03Å
1792	R	75.2	Confident	80.6	Confident	101.2 Å²	101.2	50.3 Å²	50.3	38%	0.382	28%	0.284	S	S	.	.	S	Bend	trans	-139.9	131.1	-177.6	128.1	-171.3	176	-175.1	-1.3	110.6	M1718 G1719 E1794	M1718-R1792 CarbonylContact C-O 3.48Å; M1718-R1792 WeakPolarHBondContact CA-O 3.29Å; M1718-R1792 VanDerWaalsContact CB-O 3.27Å; M1718-R1792 WeakPolarHBondContact CB-O 3.24Å; M1718-R1792 WeakPolarHBondContact CE-O 3.5Å; M1718-R1792 WeakPolarHBondContact CG-O 3.09Å; M1718-R1792 CarbonylContact O-C 3.58Å; M1718-R1792 WeakPolarHBondContact O-CG 3.3Å; M1718-R1792 PolarHBondContact O-N 3.19Å; M1718-R1792 VanDerWaalsContact O-O 3.05Å; G1719-R1792 VanDerWaalsContact CA-NE 3.31Å; G1719-R1792 PolarHBondContact N-O 3.42Å; R1792-E1794 WeakPolarHBondContact CD-OE1 3.43Å; R1792-E1794 HydrophobicContact CG-CG 4.36Å; R1792-E1794 IonicContact CZ-OE1 2.76Å; R1792-E1794 VanDerWaalsContact CZ-OE1 3.23Å; R1792-E1794 IonicContact NE-OE1 2.83Å; R1792-E1794 PolarHBondContact NE-OE1 3Å; R1792-E1794 IonicContact NH1-OE1 3.09Å; R1792-E1794 PolarHBondContact NH1-OE1 2.98Å; R1792-E1794 IonicContact NH2-OE1 2.74Å; R1792-E1794 PolarHBondContact NH2-OE1 3.04Å; R1792-E1794 WeakPolarHBondContact O-CG 3.32Å; R1792-E1794 PolarHBondContact O-N 3.14Å
1793	L	79.2	Confident	80.6	Confident	12.8 Å²	12.8	52.3 Å²	52.3	7%	0.067	30%	0.295	C	S	.	.			trans	-90.5	118.9	172.6	-174.3	73.8	0	0	0	109.8	R1693 L1695 P1696 L1716 M1718 I1796 T1809	R1693-L1793 WeakPolarHBondContact CD-O 3.16Å; R1693-L1793 PolarHBondContact NH1-O 3.18Å; L1695-L1793 HydrophobicContact CD2-CB 4.39Å; P1696-L1793 HydrophobicContact CG-CB 4.37Å; P1696-L1793 HydrophobicContact CG-CD2 3.7Å; L1716-L1793 HydrophobicContact CB-CD1 3.91Å; L1716-L1793 HydrophobicContact CD2-CD1 4.27Å; L1716-L1793 HydrophobicContact CG-CD1 4.18Å; M1718-L1793 HydrophobicContact CE-CD1 4.28Å; M1718-L1793 HydrophobicContact CG-CD1 4.35Å; L1793-I1796 HydrophobicContact CD1-CD1 4.4Å; L1793-I1796 HydrophobicContact CD1-CG1 4.09Å; L1793-I1796 HydrophobicContact CD2-CD1 3.93Å; L1793-I1796 HydrophobicContact CD2-CG1 4.06Å; L1793-I1796 HydrophobicContact CG-CG1 4.43Å; L1793-T1809 HydrophobicContact CD2-CG2 4.39Å
1794	E	75.6	Confident	80.6	Confident	76 Å²	76	52.2 Å²	52.2	36%	0.355	29%	0.288	S	S	.	.			trans	-96.9	-61.6	178.9	-59.5	-166	152.2	0	0	110.8	W1686 R1693 N1717 G1719 R1792	W1686-E1794 WeakPolarHBondContact CH2-O 3.48Å; W1686-E1794 VanDerWaalsContact CZ3-O 3.29Å; W1686-E1794 WeakPolarHBondContact CZ3-O 3.13Å; R1693-E1794 PolarHBondContact NH1-O 3.09Å; N1717-E1794 HydrophobicContact CB-CB 4.31Å; N1717-E1794 PolarHBondContact O-N 3.21Å; G1719-E1794 VanDerWaalsContact C-OE1 3.31Å; G1719-E1794 VanDerWaalsContact C-OE2 3.28Å; G1719-E1794 VanDerWaalsContact CA-CD 3.48Å; G1719-E1794 VanDerWaalsContact CA-OE1 3.3Å; G1719-E1794 WeakPolarHBondContact CA-OE1 3.47Å; G1719-E1794 WeakPolarHBondContact CA-OE2 3.44Å; R1792-E1794 WeakPolarHBondContact CD-OE1 3.43Å; R1792-E1794 HydrophobicContact CG-CG 4.36Å; R1792-E1794 IonicContact CZ-OE1 2.76Å; R1792-E1794 VanDerWaalsContact CZ-OE1 3.23Å; R1792-E1794 IonicContact NE-OE1 2.83Å; R1792-E1794 PolarHBondContact NE-OE1 3Å; R1792-E1794 IonicContact NH1-OE1 3.09Å; R1792-E1794 PolarHBondContact NH1-OE1 2.98Å; R1792-E1794 IonicContact NH2-OE1 2.74Å; R1792-E1794 PolarHBondContact NH2-OE1 3.04Å; R1792-E1794 WeakPolarHBondContact O-CG 3.32Å; R1792-E1794 PolarHBondContact O-N 3.14Å
1795	T	77.4	Confident	80.8	Confident	67.6 Å²	67.6	44.7 Å²	44.7	42%	0.415	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	157.9	179.7	51.4	0	0	0	0	112	W1686 N1717	W1686-T1795 HydrophobicContact CH2-CG2 4.23Å; W1686-T1795 HydrophobicContact CZ3-CG2 3.98Å; N1717-T1795 WeakPolarHBondContact CB-OG1 3.42Å; N1717-T1795 PolarHBondContact N-O 3.01Å; N1717-T1795 PolarHBondContact ND2-OG1 3.07Å
1796	I	82.3	Confident	80.2	Confident	30 Å²	30	41.2 Å²	41.2	15%	0.154	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	119	166.3	-57.3	-174.6	0	0	0	108	A1699 V1714 D1715 L1716 L1793 I1807 T1809	A1699-I1796 HydrophobicContact CB-CD1 3.78Å; V1714-I1796 HydrophobicContact CG1-CG2 4.14Å; D1715-I1796 CarbonylContact O-C 3.52Å; D1715-I1796 VanDerWaalsContact O-CA 3.29Å; D1715-I1796 WeakPolarHBondContact O-CA 3.31Å; L1716-I1796 HydrophobicContact CD1-CD1 4.33Å; L1716-I1796 HydrophobicContact CD1-CG1 4.47Å; L1716-I1796 HydrophobicContact CD1-CG2 4.21Å; L1716-I1796 HydrophobicContact CD2-CD1 4.43Å; L1716-I1796 HydrophobicContact CG-CD1 4.08Å; L1716-I1796 HydrophobicContact CG-CG1 4.09Å; L1716-I1796 HydrophobicContact CG-CG2 4.48Å; L1793-I1796 HydrophobicContact CD1-CD1 4.4Å; L1793-I1796 HydrophobicContact CD1-CG1 4.09Å; L1793-I1796 HydrophobicContact CD2-CD1 3.93Å; L1793-I1796 HydrophobicContact CD2-CG1 4.06Å; L1793-I1796 HydrophobicContact CG-CG1 4.43Å; I1796-I1807 HydrophobicContact CB-CD1 4.04Å; I1796-I1807 HydrophobicContact CB-CG1 4.32Å; I1796-I1807 HydrophobicContact CB-CG2 4.43Å; I1796-I1807 HydrophobicContact CD1-CG2 3.94Å; I1796-I1807 HydrophobicContact CG2-CD1 3.82Å; I1796-I1807 HydrophobicContact CG2-CG1 4.13Å; I1796-I1807 WeakPolarHBondContact O-CD1 3.38Å; I1796-T1809 HydrophobicContact CD1-CG2 4.28Å
1797	G	82	Confident	79.8	Confident	27.4 Å²	27.4	40.8 Å²	40.8	28%	0.282	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	145	173.9	0	0	0	0	0	111.7	V1714 D1715	V1714-G1797 CarbonylContact C-O 3.45Å; V1714-G1797 VanDerWaalsContact CA-O 3.32Å; V1714-G1797 WeakPolarHBondContact CA-O 3.16Å; D1715-G1797 PolarHBondContact N-O 2.97Å; D1715-G1797 PolarHBondContact O-N 3.04Å
1798	V	83.8	Confident	79.2	Confident	10.4 Å²	10.4	41.1 Å²	41.1	6%	0.063	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	130.6	172.5	177.9	0	0	0	0	107.9	A1701 I1703 R1713 V1714 V1802 Y1805 I1807	A1701-V1798 HydrophobicContact CB-CG2 4.46Å; I1703-V1798 HydrophobicContact CD1-CG1 3.83Å; I1703-V1798 HydrophobicContact CD1-CG2 4.33Å; I1703-V1798 HydrophobicContact CG1-CG1 4.27Å; I1703-V1798 HydrophobicContact CG2-CG1 4.31Å; R1713-V1798 WeakPolarHBondContact O-CA 3.31Å; V1714-V1798 HydrophobicContact CG1-CG2 4.26Å; V1714-V1798 HydrophobicContact CG2-CG2 4.35Å; V1798-V1802 HydrophobicContact CG1-CB 4.4Å; V1798-V1802 HydrophobicContact CG1-CG1 4.15Å; V1798-V1802 HydrophobicContact CG1-CG2 3.95Å; V1798-Y1805 HydrophobicContact CB-CD1 4Å; V1798-Y1805 HydrophobicContact CB-CD2 3.93Å; V1798-Y1805 HydrophobicContact CB-CE1 4.11Å; V1798-Y1805 HydrophobicContact CB-CE2 4.04Å; V1798-Y1805 HydrophobicContact CB-CG 3.91Å; V1798-Y1805 HydrophobicContact CG1-CD1 4.02Å; V1798-Y1805 HydrophobicContact CG1-CD2 4.38Å; V1798-Y1805 HydrophobicContact CG1-CE1 4.36Å; V1798-Y1805 HydrophobicContact CG1-CG 3.95Å; V1798-Y1805 HydrophobicContact CG2-CD2 3.76Å; V1798-Y1805 HydrophobicContact CG2-CE2 4.01Å; V1798-Y1805 HydrophobicContact CG2-CG 4.13Å; V1798-I1807 HydrophobicContact CG2-CD1 4.04Å
1799	S	84.7	Confident	78.7	Confident	38.2 Å²	38.2	40.4 Å²	40.4	27%	0.267	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	173.9	-174.8	61.1	0	0	0	0	112.9	F1712 R1713	F1712-S1799 CarbonylContact C-O 3.56Å; F1712-S1799 VanDerWaalsContact CA-O 3.32Å; F1712-S1799 WeakPolarHBondContact CA-O 3.41Å; F1712-S1799 WeakPolarHBondContact CB-O 3.33Å; R1713-S1799 PolarHBondContact N-O 3.08Å; R1713-S1799 PolarHBondContact O-N 3.1Å
1800	G	84.5	Confident	78.1	Confident	45.2 Å²	45.2	43 Å²	43	47%	0.466	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	95.9	-147.3	-175.4	0	0	0	0	0	112.6	V1802	G1800-V1802 PolarHBondContact O-N 3.02Å
1801	D	84.9	Confident	77.6	Confident	41.6 Å²	41.6	45.3 Å²	45.3	22%	0.222	25%	0.251	C	S	.	.	S	Bend	trans	-76.6	49.4	-174.8	-60.8	-59.5	0	0	0	113.4	L1705 K1706 P1709 K1710 G1711	L1705-D1801 CarbonylContact C-O 3.51Å; L1705-D1801 VanDerWaalsContact CA-O 3.27Å; L1705-D1801 WeakPolarHBondContact CA-O 3.41Å; L1705-D1801 WeakPolarHBondContact CB-O 3.49Å; L1705-D1801 WeakPolarHBondContact CD2-O 3.47Å; K1706-D1801 HydrophobicContact CB-CB 4.44Å; K1706-D1801 PolarHBondContact N-O 2.86Å; P1709-D1801 HydrophobicContact CB-CB 3.63Å; K1710-D1801 VanDerWaalsContact CA-OD2 3.29Å; K1710-D1801 WeakPolarHBondContact CA-OD2 3.39Å; K1710-D1801 VanDerWaalsContact CB-OD2 3.26Å; K1710-D1801 WeakPolarHBondContact CB-OD2 3.33Å; K1710-D1801 PolarHBondContact N-OD2 2.9Å; G1711-D1801 PolarHBondContact N-OD2 2.89Å; G1711-D1801 VanDerWaalsContact O-CB 3.3Å; G1711-D1801 WeakPolarHBondContact O-CB 3.43Å; G1711-D1801 PolarHBondContact O-N 2.72Å; G1711-D1801 VanDerWaalsContact O-OD2 3.11Å
1802	V	80	Confident	76.8	Confident	0.2 Å²	0.2	41.1 Å²	41.1	0%	0.001	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	129	-177.5	176.1	0	0	0	0	109.9	L1671 I1703 A1704 L1705 K1706 F1712 V1798 G1800 S1804 Y1805	L1671-V1802 HydrophobicContact CD1-CB 3.7Å; L1671-V1802 HydrophobicContact CD1-CG1 3.92Å; I1703-V1802 HydrophobicContact CG2-CB 4.39Å; I1703-V1802 HydrophobicContact CG2-CG1 3.9Å; I1703-V1802 HydrophobicContact CG2-CG2 3.7Å; A1704-V1802 CarbonylContact O-C 3.53Å; A1704-V1802 WeakPolarHBondContact O-CG1 3.44Å; L1705-V1802 HydrophobicContact CD2-CG2 4Å; K1706-V1802 VanDerWaalsContact CE-O 3.28Å; K1706-V1802 WeakPolarHBondContact CE-O 3.36Å; F1712-V1802 HydrophobicContact CB-CG2 3.67Å; F1712-V1802 HydrophobicContact CG-CG2 4.44Å; V1798-V1802 HydrophobicContact CG1-CB 4.4Å; V1798-V1802 HydrophobicContact CG1-CG1 4.15Å; V1798-V1802 HydrophobicContact CG1-CG2 3.95Å; G1800-V1802 PolarHBondContact O-N 3.02Å; V1802-S1804 WeakPolarHBondContact CG1-O 3.17Å; V1802-Y1805 HydrophobicContact CG1-CD1 4.21Å
1803	D	74.5	Confident	75.4	Confident	76.8 Å²	76.8	42 Å²	42	41%	0.411	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-43	177.9	174.2	95.1	0	0	0	110.8	K1605 A1704 K1706	K1605-D1803 WeakPolarHBondContact CD-OD1 3.37Å; K1605-D1803 WeakPolarHBondContact CD-OD2 3.37Å; K1605-D1803 VanDerWaalsContact CE-CG 3.42Å; K1605-D1803 WeakPolarHBondContact CE-OD1 3.2Å; K1605-D1803 WeakPolarHBondContact CE-OD2 3.07Å; K1605-D1803 IonicContact NZ-OD1 2.93Å; K1605-D1803 PolarHBondContact NZ-OD1 3.03Å; K1605-D1803 IonicContact NZ-OD2 2.76Å; K1605-D1803 PolarHBondContact NZ-OD2 3.07Å; A1704-D1803 PolarHBondContact O-N 3.06Å; K1706-D1803 HydrophobicContact CG-CB 4.16Å
1804	S	70.7	Confident	73.7	Confident	44.8 Å²	44.8	44.8 Å²	44.8	31%	0.313	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	155.3	173.1	50.9	0	0	0	0	111.1	A1704 V1802	A1704-S1804 PolarHBondContact N-O 2.77Å; A1704-S1804 PolarHBondContact O-N 2.82Å; V1802-S1804 WeakPolarHBondContact CG1-O 3.17Å
1805	Y	79.4	Confident	72	Confident	36 Å²	36	47.3 Å²	47.3	14%	0.141	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	160.9	175.3	70.3	-84.8	0	0	0	112.4	R1667 S1668 L1671 N1702 V1798 V1802 I1807	R1667-Y1805 HydrophobicContact CB-CD1 4.22Å; R1667-Y1805 HydrophobicContact CB-CE1 3.71Å; R1667-Y1805 WeakPolarHBondContact CD-OH 3.28Å; R1667-Y1805 HydrophobicContact CG-CE1 4.4Å; R1667-Y1805 PolarHBondContact N-O 3.3Å; R1667-Y1805 VanDerWaalsContact N-O 3.08Å; R1667-Y1805 PolarHBondContact O-N 3.07Å; R1667-Y1805 VanDerWaalsContact O-N 3.1Å; S1668-Y1805 WeakPolarHBondContact CA-O 3.37Å; L1671-Y1805 HydrophobicContact CD1-CD1 4.36Å; L1671-Y1805 HydrophobicContact CD1-CE1 4.34Å; L1671-Y1805 HydrophobicContact CD2-CE1 4.43Å; L1671-Y1805 HydrophobicContact CG-CE1 4.33Å; N1702-Y1805 CarbonylContact O-C 3.53Å; N1702-Y1805 VanDerWaalsContact O-CA 3.25Å; N1702-Y1805 WeakPolarHBondContact O-CA 3.38Å; N1702-Y1805 WeakPolarHBondContact O-CB 3.33Å; V1798-Y1805 HydrophobicContact CB-CD1 4Å; V1798-Y1805 HydrophobicContact CB-CD2 3.93Å; V1798-Y1805 HydrophobicContact CB-CE1 4.11Å; V1798-Y1805 HydrophobicContact CB-CE2 4.04Å; V1798-Y1805 HydrophobicContact CB-CG 3.91Å; V1798-Y1805 HydrophobicContact CG1-CD1 4.02Å; V1798-Y1805 HydrophobicContact CG1-CD2 4.38Å; V1798-Y1805 HydrophobicContact CG1-CE1 4.36Å; V1798-Y1805 HydrophobicContact CG1-CG 3.95Å; V1798-Y1805 HydrophobicContact CG2-CD2 3.76Å; V1798-Y1805 HydrophobicContact CG2-CE2 4.01Å; V1798-Y1805 HydrophobicContact CG2-CG 4.13Å; V1802-Y1805 HydrophobicContact CG1-CD1 4.21Å; Y1805-I1807 HydrophobicContact CD2-CD1 4.08Å; Y1805-I1807 HydrophobicContact CD2-CG1 4.07Å; Y1805-I1807 HydrophobicContact CE2-CD1 3.83Å; Y1805-I1807 HydrophobicContact CE2-CG1 4.14Å
1806	S	69.1	Low	70	Confident	24.4 Å²	24.4	51.2 Å²	51.2	17%	0.171	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	145.8	165.1	70	0	0	0	0	110.8	T1665 A1701 N1702	T1665-S1806 CarbonylContact O-C 3.51Å; T1665-S1806 VanDerWaalsContact O-CA 3.31Å; T1665-S1806 WeakPolarHBondContact O-CA 3.4Å; A1701-S1806 CarbonylContact C-O 3.59Å; A1701-S1806 WeakPolarHBondContact CA-O 3.35Å; N1702-S1806 PolarHBondContact N-O 3Å; N1702-S1806 PolarHBondContact ND2-OG 3.05Å; N1702-S1806 VanDerWaalsContact ND2-OG 3.08Å; N1702-S1806 PolarHBondContact O-N 2.99Å
1807	I	77.8	Confident	67.5	Low	7.6 Å²	7.6	60.6 Å²	60.6	4%	0.039	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	129.9	174.9	-61.6	170.1	0	0	0	109	R1664 T1665 I1666 T1700 A1701 I1796 V1798 Y1805 T1809	R1664-I1807 VanDerWaalsContact CA-O 3.29Å; R1664-I1807 WeakPolarHBondContact CA-O 3.36Å; T1665-I1807 WeakPolarHBondContact CA-O 3.3Å; T1665-I1807 WeakPolarHBondContact CB-O 3.41Å; T1665-I1807 HydrophobicContact CG2-CB 4.07Å; T1665-I1807 WeakPolarHBondContact CG2-O 3.37Å; T1665-I1807 PolarHBondContact N-O 3Å; T1665-I1807 PolarHBondContact O-N 3.06Å; I1666-I1807 PolarHBondContact N-O 2.94Å; T1700-I1807 CarbonylContact O-C 3.5Å; T1700-I1807 VanDerWaalsContact O-CA 3.25Å; T1700-I1807 WeakPolarHBondContact O-CA 3.44Å; A1701-I1807 HydrophobicContact CB-CD1 3.45Å; A1701-I1807 VanDerWaalsContact CB-CD1 3.45Å; I1796-I1807 HydrophobicContact CB-CD1 4.04Å; I1796-I1807 HydrophobicContact CB-CG1 4.32Å; I1796-I1807 HydrophobicContact CB-CG2 4.43Å; I1796-I1807 HydrophobicContact CD1-CG2 3.94Å; I1796-I1807 HydrophobicContact CG2-CD1 3.82Å; I1796-I1807 HydrophobicContact CG2-CG1 4.13Å; I1796-I1807 WeakPolarHBondContact O-CD1 3.38Å; V1798-I1807 HydrophobicContact CG2-CD1 4.04Å; Y1805-I1807 HydrophobicContact CD2-CD1 4.08Å; Y1805-I1807 HydrophobicContact CD2-CG1 4.07Å; Y1805-I1807 HydrophobicContact CE2-CD1 3.83Å; Y1805-I1807 HydrophobicContact CE2-CG1 4.14Å; I1807-T1809 HydrophobicContact CG2-CG2 4.21Å
1808	D	71.7	Confident	65	Low	38.4 Å²	38.4	65.6 Å²	65.6	21%	0.205	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	138.6	169.6	-79.1	-50.2	0	0	0	109.9	R1664 T1665 A1699 T1700 N1702	R1664-D1808 IonicContact CZ-OD1 2.65Å; R1664-D1808 IonicContact CZ-OD2 3.49Å; R1664-D1808 IonicContact NE-OD1 2.75Å; R1664-D1808 PolarHBondContact NE-OD1 2.74Å; R1664-D1808 IonicContact NE-OD2 3.07Å; R1664-D1808 IonicContact NH2-OD1 3.18Å; R1664-D1808 PolarHBondContact NH2-OD1 2.86Å; R1664-D1808 IonicContact NH2-OD2 2.9Å; R1664-D1808 PolarHBondContact NH2-OD2 3.36Å; T1665-D1808 PolarHBondContact OG1-OD1 3.12Å; A1699-D1808 CarbonylContact C-O 3.11Å; A1699-D1808 WeakPolarHBondContact CA-O 3.31Å; T1700-D1808 PolarHBondContact N-O 3.18Å; T1700-D1808 PolarHBondContact O-N 2.88Å; N1702-D1808 PolarHBondContact ND2-OD2 2.99Å
1809	T	76.7	Confident	62.4	Low	5.8 Å²	5.8	71.7 Å²	71.7	4%	0.036	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	142.8	173.4	55.4	0	0	0	0	111.7	V1662 R1663 R1664 I1666 T1698 A1699 L1793 I1796 I1807 Y1811	V1662-T1809 VanDerWaalsContact CA-O 3.31Å; V1662-T1809 WeakPolarHBondContact CA-O 3.39Å; R1663-T1809 WeakPolarHBondContact CA-O 3.37Å; R1663-T1809 PolarHBondContact N-O 2.99Å; R1663-T1809 PolarHBondContact O-N 2.86Å; R1664-T1809 PolarHBondContact N-O 3.02Å; R1664-T1809 PolarHBondContact O-N 2.85Å; R1664-T1809 PolarHBondContact O-OG1 2.96Å; R1664-T1809 VanDerWaalsContact O-OG1 3.12Å; I1666-T1809 HydrophobicContact CD1-CG2 3.96Å; T1698-T1809 WeakPolarHBondContact O-CA 3.38Å; A1699-T1809 HydrophobicContact CB-CG2 4.07Å; L1793-T1809 HydrophobicContact CD2-CG2 4.39Å; I1796-T1809 HydrophobicContact CD1-CG2 4.28Å; I1807-T1809 HydrophobicContact CG2-CG2 4.21Å; T1809-Y1811 WeakPolarHBondContact OG1-CE2 3.25Å
1810	E	73.5	Confident	59.8	Low	72.6 Å²	72.6	74.3 Å²	74.3	34%	0.339	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	124.7	176.5	-165	-179.1	-172.8	0	0	108.7	Y1661 P1696 K1697 T1698	Y1661-E1810 HydrophobicContact CD1-CG 4.42Å; P1696-E1810 CarbonylContact C-O 3.56Å; P1696-E1810 VanDerWaalsContact C-O 3.29Å; P1696-E1810 VanDerWaalsContact CA-O 3.26Å; P1696-E1810 WeakPolarHBondContact CA-O 3.25Å; P1696-E1810 VanDerWaalsContact CB-O 3.28Å; P1696-E1810 WeakPolarHBondContact CB-O 3.37Å; K1697-E1810 PolarHBondContact N-O 2.95Å; T1698-E1810 PolarHBondContact N-O 2.91Å; T1698-E1810 PolarHBondContact O-N 3.11Å; T1698-E1810 VanDerWaalsContact OG1-CB 3.32Å; T1698-E1810 WeakPolarHBondContact OG1-CB 3.29Å; T1698-E1810 PolarHBondContact OG1-OE2 2.9Å; T1698-E1810 VanDerWaalsContact OG1-OE2 3.1Å
1811	Y	71.1	Confident	57.3	Low	67.2 Å²	67.2	79.9 Å²	79.9	26%	0.264	42%	0.42	S	S	.	.			trans	-102.7	147.1	178.8	-69	-96.6	0	0	0	111.2	P1660 Y1661 R1663 M1694 P1696 T1809	P1660-Y1811 WeakPolarHBondContact O-CD2 3.4Å; Y1661-Y1811 WeakPolarHBondContact CD1-O 3.4Å; Y1661-Y1811 WeakPolarHBondContact CE1-O 3.31Å; Y1661-Y1811 PolarHBondContact O-N 3.05Å; R1663-Y1811 HydrophobicContact CG-CE2 4.14Å; R1663-Y1811 PolarHBondContact NH1-OH 3.23Å; M1694-Y1811 WeakPolarHBondContact O-CE1 3.34Å; P1696-Y1811 HydrophobicContact CB-CD1 3.95Å; P1696-Y1811 HydrophobicContact CB-CD2 4.35Å; P1696-Y1811 HydrophobicContact CB-CE1 3.83Å; P1696-Y1811 HydrophobicContact CB-CE2 4.23Å; P1696-Y1811 HydrophobicContact CB-CG 4.21Å; P1696-Y1811 HydrophobicContact CG-CE1 4.23Å; T1809-Y1811 WeakPolarHBondContact OG1-CE2 3.25Å
1812	P	59.3	Low	54.7	Low	39.4 Å²	39.4	86.6 Å²	86.6	26%	0.256	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-61.9	159.8	169.7	-4.2	14.4	0	0	0	111.3	M1694 L1695 K1697	M1694-P1812 HydrophobicContact CB-CG 4.19Å; M1694-P1812 HydrophobicContact CE-CB 3.82Å; M1694-P1812 HydrophobicContact CE-CG 3.82Å; M1694-P1812 HydrophobicContact SD-CG 3.86Å; L1695-P1812 VanDerWaalsContact O-CD 3.25Å; L1695-P1812 WeakPolarHBondContact O-CD 3.32Å; K1697-P1812 HydrophobicContact CB-CG 4.21Å
1813	K	44.7	Very low	52.4	Low	120.4 Å²	120.4	92.8 Å²	92.8	52%	0.523	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-70.9	146.8	171	-73	-176.7	175.3	-174.4	0	110.3	K1658 D1659 Y1661 D1815 E1816	K1658-K1813 PolarHBondContact O-NZ 3.05Å; D1659-K1813 WeakPolarHBondContact O-CE 3.45Å; D1659-K1813 PolarHBondContact O-NZ 2.87Å; Y1661-K1813 HydrophobicContact CD2-CG 4.33Å; Y1661-K1813 HydrophobicContact CE1-CG 4.14Å; Y1661-K1813 HydrophobicContact CE2-CD 4.16Å; Y1661-K1813 HydrophobicContact CE2-CG 3.88Å; Y1661-K1813 WeakPolarHBondContact OH-CE 3.01Å; Y1661-K1813 PolarHBondContact OH-NZ 2.92Å; K1813-D1815 PolarHBondContact O-N 3.04Å; K1813-E1816 PolarHBondContact O-N 2.82Å; K1813-E1816 VanDerWaalsContact O-N 3.11Å
1814	A	45	Very low	50.4	Low	71.8 Å²	71.8	95.1 Å²	95.1	59%	0.593	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	15.9	176.2	0	0	0	0	0	113.9	K1658	K1658-A1814 PolarHBondContact NZ-O 2.77Å
1815	D	39	Very low	48.5	Very low	127.8 Å²	127.8	100.7 Å²	100.7	68%	0.683	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.5	5.7	-176.2	-55.6	-34.6	0	0	0	114.1	K1658 K1813 R1817	K1658-D1815 HydrophobicContact CB-CB 4.44Å; K1658-D1815 WeakPolarHBondContact CB-OD1 3.49Å; K1658-D1815 WeakPolarHBondContact CD-OD1 3.37Å; K1658-D1815 WeakPolarHBondContact CD-OD2 3.14Å; K1658-D1815 VanDerWaalsContact CE-CG 3.49Å; K1658-D1815 WeakPolarHBondContact CE-OD1 3.45Å; K1658-D1815 VanDerWaalsContact CE-OD2 3.32Å; K1658-D1815 WeakPolarHBondContact CE-OD2 3.4Å; K1658-D1815 IonicContact NZ-OD1 3.37Å; K1658-D1815 PolarHBondContact NZ-OD1 3.18Å; K1658-D1815 IonicContact NZ-OD2 3.88Å; K1658-D1815 PolarHBondContact NZ-OD2 2.85Å; K1813-D1815 PolarHBondContact O-N 3.04Å; D1815-R1817 VanDerWaalsContact C-N 3.26Å; D1815-R1817 PolarHBondContact O-N 2.82Å; D1815-R1817 VanDerWaalsContact O-N 3.08Å
1816	E	34.5	Very low	46.1	Very low	148.2 Å²	148.2	104.9 Å²	104.9	69%	0.693	54%	0.539	S	S	*	.			trans	-93.8	83	162.1	-80.2	172.4	174.8	0	0	109.4	K1813 V1818	K1813-E1816 PolarHBondContact O-N 2.82Å; K1813-E1816 VanDerWaalsContact O-N 3.11Å; E1816-V1818 PolarHBondContact O-N 3.07Å; E1816-V1818 VanDerWaalsContact O-N 3.16Å
1817	R	30	Very low	44.3	Very low	228.4 Å²	228.4	113.1 Å²	113.1	86%	0.862	57%	0.566	S	S	*	*			trans	-78.2	119.4	166.5	-83.3	-170.6	175.2	-170.9	-1.6	109.2	D1815 T1819	D1815-R1817 VanDerWaalsContact C-N 3.26Å; D1815-R1817 PolarHBondContact O-N 2.82Å; D1815-R1817 VanDerWaalsContact O-N 3.08Å; R1817-T1819 PolarHBondContact O-N 3.07Å; R1817-T1819 VanDerWaalsContact O-N 3.13Å
1818	V	29.5	Very low	41.9	Very low	133.2 Å²	133.2	121.5 Å²	121.5	81%	0.807	60%	0.597	S	S	*	*			trans	-66.3	115.5	169.6	177.8	0	0	0	0	109.2	E1816 S1820	E1816-V1818 PolarHBondContact O-N 3.07Å; E1816-V1818 VanDerWaalsContact O-N 3.16Å; V1818-S1820 PolarHBondContact O-N 2.85Å; V1818-S1820 VanDerWaalsContact O-N 3.15Å
1819	T	28.8	Very low	40	Very low	137.4 Å²	137.4	126.9 Å²	126.9	84%	0.843	63%	0.626	S	S	*	*			trans	-102.4	104.1	160.3	41.4	0	0	0	0	108.8	R1817	R1817-T1819 PolarHBondContact O-N 3.07Å; R1817-T1819 VanDerWaalsContact O-N 3.13Å
1820	S	31.1	Very low	37.9	Very low	92.2 Å²	92.2	132 Å²	132	65%	0.645	66%	0.659	S	S	*	*			trans	-80.7	139.1	173	47.6	0	0	0	0	111.4	V1818 K1822	V1818-S1820 PolarHBondContact O-N 2.85Å; V1818-S1820 VanDerWaalsContact O-N 3.15Å; S1820-K1822 PolarHBondContact O-N 3.04Å
1821	E	31.5	Very low	35.9	Very low	164.4 Å²	164.4	136.4 Å²	136.4	77%	0.768	68%	0.679	S	S	*	*			trans	3.3	128.6	155.3	-64.8	160.3	164.6	0	0	115.5	D1823	E1821-D1823 HydrophobicContact CB-CB 4.48Å; E1821-D1823 WeakPolarHBondContact CG-OD1 3.44Å; E1821-D1823 PolarHBondContact O-N 2.8Å
1822	K	31.4	Very low	34.1	Very low	181.8 Å²	181.8	141.4 Å²	141.4	79%	0.79	70%	0.702	S	S	*	*				-169.5	144.9	113.7	-106.6	179.2	177.3	-179.1	0	113.9	S1820	S1820-K1822 PolarHBondContact O-N 3.04Å
1823	D	32.2	Very low	32.7	Very low	131.2 Å²	131.2	146.1 Å²	146.1	70%	0.702	72%	0.721	S	S	*	*			trans	54.5	132.5	160.1	-57.2	-30.7	0	0	0	118.5	E1821	E1821-D1823 HydrophobicContact CB-CB 4.48Å; E1821-D1823 WeakPolarHBondContact CG-OD1 3.44Å; E1821-D1823 PolarHBondContact O-N 2.8Å
1824	T	31	Very low	32.2	Very low	124 Å²	124	147.3 Å²	147.3	76%	0.761	73%	0.732	S	S	*	*			trans	-52.6	166.2	170.5	33.4	0	0	0	0	116.2
1825	E	31.2	Very low	31.5	Very low	163 Å²	163	150.2 Å²	150.2	76%	0.762	74%	0.737	S	S	*	*			trans	160.4	143.3	131.1	-85.6	174.3	-166.9	0	0	114.7
1826	H	29.3	Very low	31.2	Very low	123.8 Å²	123.8	151.2 Å²	151.2	57%	0.573	74%	0.741	S	S	*	*			trans	47.9	140.7	137.4	-107.8	-78.2	0	0	0	118.2	R1828	H1826-R1828 VanDerWaalsContact CE1-CD 3.49Å; H1826-R1828 WeakPolarHBondContact CE1-CD 3.28Å; H1826-R1828 PolarHBondContact CE1-NE 3.43Å; H1826-R1828 WeakPolarHBondContact NE2-CG 2.83Å; H1826-R1828 PolarHBondContact NE2-NE 2.83Å
1827	W	30.2	Very low	31.1	Very low	196.2 Å²	196.2	151.6 Å²	151.6	74%	0.743	74%	0.743	S	S	*	*				-161.2	155.4	58.6	-76.4	113.2	0	0	0	113
1828	R	28.4	Very low	31.1	Very low	184.4 Å²	184.4	146.9 Å²	146.9	70%	0.696	74%	0.735	S	S	*	*			trans	-149.8	158.5	165	-95.9	179.2	-173.5	171.5	-1.2	116.2	H1826 D2066 A2067	H1826-R1828 VanDerWaalsContact CE1-CD 3.49Å; H1826-R1828 WeakPolarHBondContact CE1-CD 3.28Å; H1826-R1828 PolarHBondContact CE1-NE 3.43Å; H1826-R1828 WeakPolarHBondContact NE2-CG 2.83Å; H1826-R1828 PolarHBondContact NE2-NE 2.83Å; R1828-D2066 PolarHBondContact NH1-O 3.4Å; R1828-D2066 PolarHBondContact NH2-O 2.78Å; R1828-A2067 PolarHBondContact NE-O 3.27Å; R1828-A2067 PolarHBondContact NH2-O 2.81Å
1829	L	31.9	Very low	31.2	Very low	152.4 Å²	152.4	146.7 Å²	146.7	80%	0.798	73%	0.734	S	S	*	*			trans	-116.3	170.2	162.3	-73.6	167.3	0	0	0	109.8	K2068	L1829-K2068 HydrophobicContact CB-CD 3.98Å; L1829-K2068 HydrophobicContact CD1-CD 4.33Å
1830	P	33.2	Very low	31.2	Very low	113 Å²	113	147 Å²	147	73%	0.734	73%	0.73	S	S	*	*				-134.3	167.1	112.2	33.5	-16	0	0	0	114.8
1831	E	31.4	Very low	31.2	Very low	165 Å²	165	148.8 Å²	148.8	77%	0.771	74%	0.738	S	S	*	*				166	155.9	117.4	-100.7	153	-146.8	0	0	113.6	K2068	E1831-K2068 IonicContact OE1-NZ 2.63Å; E1831-K2068 PolarHBondContact OE1-NZ 3.35Å; E1831-K2068 IonicContact OE2-NZ 3.9Å; E1831-K2068 PolarHBondContact OE2-NZ 2.72Å
1832	K	32.1	Very low	31.1	Very low	171.2 Å²	171.2	149.1 Å²	149.1	74%	0.744	74%	0.739	S	S	*	*				153.1	150.3	118.3	-97.6	-171.8	174.6	-122.6	0	113.1
1833	E	29.7	Very low	31	Very low	137.6 Å²	137.6	147.2 Å²	147.2	64%	0.643	74%	0.736	S	S	*	*			cis	-171.8	164.9	-9.7	-147.6	158.2	-136.3	0	0	111
1834	I	34.2	Very low	31	Very low	147.2 Å²	147.2	146.9 Å²	146.9	76%	0.755	74%	0.739	S	S	*	*			trans	124.2	117.3	154.1	-58.4	178.1	0	0	0	113.9
1835	D	30.8	Very low	31.1	Very low	131.6 Å²	131.6	149.5 Å²	149.5	70%	0.704	74%	0.743	S	S	*	*				-158.7	154.3	103.5	-73.6	-37.4	0	0	0	115.2
1836	I	33.1	Very low	31.3	Very low	148 Å²	148	149.2 Å²	149.2	76%	0.759	75%	0.746	S	S	*	*				167	132.2	119.8	-93.4	164.1	0	0	0	114.2
1837	E	31.9	Very low	31.6	Very low	158.2 Å²	158.2	150.6 Å²	150.6	74%	0.739	76%	0.758	S	S	*	*			trans	-17	157.4	163.5	-75.1	180	174.3	0	0	121.1
1838	N	30.7	Very low	31.7	Very low	128.8 Å²	128.8	150.1 Å²	150.1	69%	0.689	76%	0.764	S	S	*	*			trans	71.5	151.9	132.9	-69.2	-34.7	0	0	0	117.4
1839	T	31.5	Very low	32	Very low	129 Å²	129	148.6 Å²	148.6	79%	0.791	77%	0.77	S	S	*	*				-141.8	159	100.8	23.6	0	0	0	0	112.8
1840	D	28.3	Very low	32	Very low	143.4 Å²	143.4	145.7 Å²	145.7	77%	0.767	77%	0.768	S	S	*	*			trans	-103.1	156.7	168.2	-67.4	-73.6	0	0	0	113.9
1841	T	30.4	Very low	31.9	Very low	131.6 Å²	131.6	146.3 Å²	146.3	81%	0.807	77%	0.769	S	S	*	*			trans	177.8	144.6	144.4	7.5	0	0	0	0	113
1842	E	30.6	Very low	32.1	Very low	169 Å²	169	147.3 Å²	147.3	79%	0.79	77%	0.771	S	S	*	*			trans	-149.8	161.7	167.9	-86.1	-174.1	151.2	0	0	114
1843	I	28.5	Very low	32.1	Very low	143.4 Å²	143.4	145.7 Å²	145.7	74%	0.735	77%	0.766	S	S	*	*			trans	139.7	151.5	157.3	-74.4	165.7	0	0	0	111.5
1844	T	33.5	Very low	32.2	Very low	124.6 Å²	124.6	147.8 Å²	147.8	76%	0.764	77%	0.768	S	S	*	*			trans	-176.5	142.4	142.9	27.2	0	0	0	0	113.9	D1846	T1844-D1846 PolarHBondContact O-N 2.85Å
1845	E	31.9	Very low	32.2	Very low	178.8 Å²	178.8	147.4 Å²	147.4	84%	0.836	76%	0.761	S	S	*	*			trans	-49.8	139.4	142.5	-60.8	177.1	138.2	0	0	113.8
1846	D	35.2	Very low	32.3	Very low	155.2 Å²	155.2	145 Å²	145	83%	0.83	75%	0.753	S	S	*	*			trans	162.9	149.4	151.2	-88.6	-25.3	0	0	0	114.1	T1844	T1844-D1846 PolarHBondContact O-N 2.85Å
1847	D	35.4	Very low	32.5	Very low	154.6 Å²	154.6	141.7 Å²	141.7	83%	0.827	74%	0.743	S	S	*	*			trans	72.1	105.4	168	-78	-14	0	0	0	117.8
1848	E	32.6	Very low	32.8	Very low	185.8 Å²	185.8	138 Å²	138	87%	0.868	73%	0.731	S	S	*	*				-65	151.8	124.4	-66.8	-160.2	137	0	0	113	A1850	E1848-A1850 PolarHBondContact O-N 3.03Å
1849	D	34.5	Very low	33	Very low	151.4 Å²	151.4	135.1 Å²	135.1	81%	0.81	72%	0.718	S	S	*	*			trans	63.4	87.6	159.5	-102.7	-5.8	0	0	0	119.6	V1851 K1873	D1849-V1851 WeakPolarHBondContact O-CG2 3.39Å; D1849-V1851 PolarHBondContact O-N 2.82Å; D1849-K1873 IonicContact OD1-NZ 3.49Å; D1849-K1873 PolarHBondContact OD1-NZ 2.87Å; D1849-K1873 IonicContact OD2-NZ 2.71Å; D1849-K1873 PolarHBondContact OD2-NZ 2.83Å
1850	A	33.2	Very low	33.4	Very low	92.2 Å²	92.2	133.3 Å²	133.3	76%	0.762	70%	0.703	S	S	*	*			trans	-148.6	77.8	154.4	0	0	0	0	0	114.6	E1848 K1852	E1848-A1850 PolarHBondContact O-N 3.03Å; A1850-K1852 PolarHBondContact O-N 3.03Å
1851	V	30.4	Very low	33.7	Very low	126.2 Å²	126.2	132.8 Å²	132.8	77%	0.765	70%	0.7	S	S	*	*			trans	-74.9	104.5	170	179.9	0	0	0	0	110.4	D1849 E1853 Q1871	D1849-V1851 WeakPolarHBondContact O-CG2 3.39Å; D1849-V1851 PolarHBondContact O-N 2.82Å; V1851-E1853 PolarHBondContact O-N 2.79Å; V1851-Q1871 HydrophobicContact CG1-CB 3.82Å; V1851-Q1871 HydrophobicContact CG1-CG 3.9Å
1852	K	35.1	Very low	33.9	Very low	185.4 Å²	185.4	133.3 Å²	133.3	81%	0.806	70%	0.697	S	S	*	*			trans	-106.6	121	171.9	-86.1	-179.2	178.8	172.1	0	112.8	A1850 W1854	A1850-K1852 PolarHBondContact O-N 3.03Å; K1852-W1854 VanDerWaalsContact O-CD1 3.29Å; K1852-W1854 PolarHBondContact O-N 2.77Å
1853	E	31.8	Very low	33.9	Very low	137.6 Å²	137.6	129.8 Å²	129.8	64%	0.643	69%	0.687	S	S	*	*			trans	-51.5	135.2	174.8	-78.1	-176.3	117.6	0	0	114.1	V1851 K1855 S1869	V1851-E1853 PolarHBondContact O-N 2.79Å; E1853-K1855 HydrophobicContact CB-CG 4.29Å; E1853-K1855 PolarHBondContact O-N 3.42Å; E1853-K1855 VanDerWaalsContact O-N 3.13Å; E1853-K1855 VanDerWaalsContact OE1-CE 3.26Å; E1853-K1855 WeakPolarHBondContact OE1-CE 3.37Å; E1853-K1855 IonicContact OE1-NZ 3.03Å; E1853-K1855 PolarHBondContact OE1-NZ 2.9Å; E1853-K1855 WeakPolarHBondContact OE2-CE 3.32Å; E1853-K1855 IonicContact OE2-NZ 2.92Å; E1853-K1855 PolarHBondContact OE2-NZ 3.16Å; E1853-S1869 WeakPolarHBondContact OE1-CB 3.41Å; E1853-S1869 PolarHBondContact OE1-OG 3.44Å
1854	W	31.9	Very low	34.4	Very low	182.2 Å²	182.2	132.3 Å²	132.3	69%	0.69	69%	0.688	S	S	*	*			trans	-103	113.8	169.7	-103.9	69.8	0	0	0	110.6	K1852 P1856 S1869 F1870 P1874 F1884	K1852-W1854 VanDerWaalsContact O-CD1 3.29Å; K1852-W1854 PolarHBondContact O-N 2.77Å; W1854-P1856 HydrophobicContact CE3-CB 4.39Å; W1854-P1856 HydrophobicContact CZ3-CB 4.2Å; W1854-P1856 WeakPolarHBondContact O-CD 3.3Å; W1854-S1869 WeakPolarHBondContact O-CA 3.41Å; W1854-F1870 HydrophobicContact CB-CD1 3.72Å; W1854-F1870 HydrophobicContact CB-CD2 4.05Å; W1854-F1870 HydrophobicContact CB-CE1 3.32Å; W1854-F1870 HydrophobicContact CB-CE2 3.66Å; W1854-F1870 HydrophobicContact CB-CG 4.09Å; W1854-F1870 HydrophobicContact CB-CZ 3.27Å; W1854-F1870 HydrophobicContact CD2-CE2 4.32Å; W1854-F1870 AromaticContact CD2-CZ 3.98Å; W1854-F1870 HydrophobicContact CD2-CZ 3.98Å; W1854-F1870 HydrophobicContact CE3-CZ 4.19Å; W1854-F1870 HydrophobicContact CG-CD2 4.44Å; W1854-F1870 HydrophobicContact CG-CE1 4.18Å; W1854-F1870 AromaticContact CG-CE2 3.76Å; W1854-F1870 HydrophobicContact CG-CE2 3.76Å; W1854-F1870 AromaticContact CG-CZ 3.61Å; W1854-F1870 HydrophobicContact CG-CZ 3.61Å; W1854-F1870 PolarHBondContact N-O 2.79Å; W1854-F1870 WeakPolarHBondContact O-CD1 3.33Å; W1854-F1870 PolarHBondContact O-N 2.96Å; W1854-P1874 HydrophobicContact CZ2-CB 4.22Å; W1854-F1884 HydrophobicContact CZ3-CE2 4.29Å
1855	K	34.4	Very low	34.8	Very low	139 Å²	139	133.4 Å²	133.4	60%	0.604	68%	0.684	S	S	*	*			trans	-107.7	110	172.4	-73.2	176.8	175.5	161.9	0	110.5	E1853 S1857 Q1866 D1868	E1853-K1855 HydrophobicContact CB-CG 4.29Å; E1853-K1855 PolarHBondContact O-N 3.42Å; E1853-K1855 VanDerWaalsContact O-N 3.13Å; E1853-K1855 VanDerWaalsContact OE1-CE 3.26Å; E1853-K1855 WeakPolarHBondContact OE1-CE 3.37Å; E1853-K1855 IonicContact OE1-NZ 3.03Å; E1853-K1855 PolarHBondContact OE1-NZ 2.9Å; E1853-K1855 WeakPolarHBondContact OE2-CE 3.32Å; E1853-K1855 IonicContact OE2-NZ 2.92Å; E1853-K1855 PolarHBondContact OE2-NZ 3.16Å; K1855-S1857 PolarHBondContact O-N 2.92Å; K1855-S1857 VanDerWaalsContact O-N 3.1Å; K1855-Q1866 HydrophobicContact CB-CG 4.06Å; K1855-D1868 VanDerWaalsContact CD-OD1 3.32Å; K1855-D1868 WeakPolarHBondContact CD-OD1 3.27Å; K1855-D1868 WeakPolarHBondContact CE-OD1 3.21Å; K1855-D1868 IonicContact NZ-OD1 2.87Å; K1855-D1868 PolarHBondContact NZ-OD1 2.82Å
1856	P	34.4	Very low	35	Very low	81.4 Å²	81.4	132.1 Å²	132.1	53%	0.529	68%	0.678	S	S	.	*			trans	-88.4	113.4	177.9	31.4	-29.6	0	0	0	111.9	W1854 Q1867 F1870	W1854-P1856 HydrophobicContact CE3-CB 4.39Å; W1854-P1856 HydrophobicContact CZ3-CB 4.2Å; W1854-P1856 WeakPolarHBondContact O-CD 3.3Å; P1856-Q1867 HydrophobicContact CG-CB 4.17Å; P1856-Q1867 VanDerWaalsContact O-CB 3.26Å; P1856-Q1867 WeakPolarHBondContact O-CB 3.17Å; P1856-Q1867 WeakPolarHBondContact O-CG 3.32Å; P1856-Q1867 PolarHBondContact O-N 3.15Å; P1856-F1870 HydrophobicContact CG-CB 4.11Å; P1856-F1870 HydrophobicContact CG-CD1 4.05Å; P1856-F1870 HydrophobicContact CG-CD2 4.13Å; P1856-F1870 HydrophobicContact CG-CE1 3.9Å
1857	S	35.9	Very low	35.1	Very low	78.8 Å²	78.8	130.2 Å²	130.2	55%	0.551	66%	0.664	S	S	*	*			trans	-141.6	143.4	164.2	13.2	0	0	0	0	110.1	K1855 W1864 E1865	K1855-S1857 PolarHBondContact O-N 2.92Å; K1855-S1857 VanDerWaalsContact O-N 3.1Å; S1857-W1864 WeakPolarHBondContact OG-CZ3 3.13Å; S1857-E1865 CarbonylContact C-O 3.59Å; S1857-E1865 WeakPolarHBondContact CA-O 3.33Å
1858	T	37.8	Very low	35.2	Very low	79 Å²	79	129.2 Å²	129.2	49%	0.485	66%	0.659	S	S	.	*			trans	-127.7	140.7	149.7	-52.7	0	0	0	0	110	I1860 E1865 Q1867 Y2015	T1858-I1860 HydrophobicContact CG2-CD1 4.46Å; T1858-I1860 HydrophobicContact CG2-CG1 4.33Å; T1858-E1865 PolarHBondContact N-O 3.36Å; T1858-E1865 PolarHBondContact O-N 3Å; T1858-Q1867 PolarHBondContact OG1-NE2 2.72Å; T1858-Y2015 WeakPolarHBondContact CG2-OH 3.35Å
1859	V	35.7	Very low	35.4	Very low	68.4 Å²	68.4	124 Å²	124	42%	0.415	64%	0.643	S	S	.	*			trans	-88.8	122.3	169.4	176.9	0	0	0	0	109.3	V1863 W1864	V1859-V1863 CarbonylContact C-O 3.54Å; V1859-V1863 VanDerWaalsContact CA-O 3.29Å; V1859-V1863 WeakPolarHBondContact CA-O 3.28Å; V1859-W1864 HydrophobicContact CG2-CD2 3.57Å; V1859-W1864 HydrophobicContact CG2-CE3 3.7Å; V1859-W1864 VanDerWaalsContact CG2-CE3 3.47Å; V1859-W1864 HydrophobicContact CG2-CG 4.24Å; V1859-W1864 HydrophobicContact CG2-CH2 3.77Å; V1859-W1864 HydrophobicContact CG2-CZ2 3.71Å; V1859-W1864 HydrophobicContact CG2-CZ3 3.8Å
1860	I	39.4	Very low	35.3	Very low	92.2 Å²	92.2	122.3 Å²	122.3	47%	0.473	63%	0.628	S	S	.	*	B	Isolated β-bridge	trans	-113.3	130.1	169.3	-60.6	175	0	0	0	107.2	T1858 N1862 V1863 E1865	T1858-I1860 HydrophobicContact CG2-CD1 4.46Å; T1858-I1860 HydrophobicContact CG2-CG1 4.33Å; I1860-N1862 VanDerWaalsContact C-N 3.26Å; I1860-N1862 PolarHBondContact O-N 2.93Å; I1860-N1862 VanDerWaalsContact O-N 3.11Å; I1860-V1863 PolarHBondContact N-O 3.07Å; I1860-V1863 WeakPolarHBondContact O-CA 3.42Å; I1860-V1863 WeakPolarHBondContact O-CB 3.48Å; I1860-V1863 PolarHBondContact O-N 2.98Å; I1860-E1865 HydrophobicContact CD1-CB 4.47Å; I1860-E1865 VanDerWaalsContact CD1-CD 3.44Å; I1860-E1865 HydrophobicContact CD1-CG 4.48Å; I1860-E1865 WeakPolarHBondContact CD1-OE1 3.3Å; I1860-E1865 WeakPolarHBondContact CD1-OE2 3.45Å
1861	D	35.8	Very low	35.2	Very low	131.8 Å²	131.8	125.1 Å²	125.1	71%	0.705	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	47.7	35	174.2	-61.5	-30.1	0	0	0	116.3	V1863	D1861-V1863 PolarHBondContact O-N 3Å
1862	N	33.8	Very low	35.3	Very low	141.4 Å²	141.4	122.9 Å²	122.9	76%	0.756	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	66	10.2	-177	-76	-38.5	0	0	0	116.1	I1860	I1860-N1862 VanDerWaalsContact C-N 3.26Å; I1860-N1862 PolarHBondContact O-N 2.93Å; I1860-N1862 VanDerWaalsContact O-N 3.11Å
1863	V	31.4	Very low	35.2	Very low	96.2 Å²	96.2	121.8 Å²	121.8	58%	0.583	61%	0.611	S	S	*	*	B	Isolated β-bridge	trans	-100	139.6	172.9	-177.8	0	0	0	0	109.8	V1859 I1860 D1861	V1859-V1863 CarbonylContact C-O 3.54Å; V1859-V1863 VanDerWaalsContact CA-O 3.29Å; V1859-V1863 WeakPolarHBondContact CA-O 3.28Å; I1860-V1863 PolarHBondContact N-O 3.07Å; I1860-V1863 WeakPolarHBondContact O-CA 3.42Å; I1860-V1863 WeakPolarHBondContact O-CB 3.48Å; I1860-V1863 PolarHBondContact O-N 2.98Å; D1861-V1863 PolarHBondContact O-N 3Å
1864	W	38.8	Very low	35.2	Very low	195.6 Å²	195.6	119.2 Å²	119.2	74%	0.741	61%	0.606	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-93.6	113.2	171.1	-73.4	87.4	0	0	0	109.7	S1857 V1859	S1857-W1864 WeakPolarHBondContact OG-CZ3 3.13Å; V1859-W1864 HydrophobicContact CG2-CD2 3.57Å; V1859-W1864 HydrophobicContact CG2-CE3 3.7Å; V1859-W1864 VanDerWaalsContact CG2-CE3 3.47Å; V1859-W1864 HydrophobicContact CG2-CG 4.24Å; V1859-W1864 HydrophobicContact CG2-CH2 3.77Å; V1859-W1864 HydrophobicContact CG2-CZ2 3.71Å; V1859-W1864 HydrophobicContact CG2-CZ3 3.8Å
1865	E	40.4	Very low	35.1	Very low	149 Å²	149	118.9 Å²	118.9	70%	0.696	61%	0.606	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-85	135.4	169.1	-70.5	-168.1	152	0	0	110.9	S1857 T1858 I1860 Q1867	S1857-E1865 CarbonylContact C-O 3.59Å; S1857-E1865 WeakPolarHBondContact CA-O 3.33Å; T1858-E1865 PolarHBondContact N-O 3.36Å; T1858-E1865 PolarHBondContact O-N 3Å; I1860-E1865 HydrophobicContact CD1-CB 4.47Å; I1860-E1865 VanDerWaalsContact CD1-CD 3.44Å; I1860-E1865 HydrophobicContact CD1-CG 4.48Å; I1860-E1865 WeakPolarHBondContact CD1-OE1 3.3Å; I1860-E1865 WeakPolarHBondContact CD1-OE2 3.45Å; E1865-Q1867 PolarHBondContact O-N 2.85Å; E1865-Q1867 PolarHBondContact O-NE2 3.09Å; E1865-Q1867 VanDerWaalsContact O-NE2 3.17Å
1866	Q	36.9	Very low	35	Very low	150.8 Å²	150.8	118.2 Å²	118.2	71%	0.705	61%	0.608	S	S	*	*			trans	-95.4	125.6	178.2	-176.5	175.1	-16.6	0	0	109.5	K1855 D1868	K1855-Q1866 HydrophobicContact CB-CG 4.06Å; Q1866-D1868 PolarHBondContact O-N 2.78Å
1867	Q	38	Very low	34.8	Very low	115.2 Å²	115.2	116.6 Å²	116.6	54%	0.538	61%	0.606	S	S	.	*			trans	-86.4	135.3	175.9	-72.1	-155.1	-31.4	0	0	112.3	P1856 T1858 E1865 S1869 K1973	P1856-Q1867 HydrophobicContact CG-CB 4.17Å; P1856-Q1867 VanDerWaalsContact O-CB 3.26Å; P1856-Q1867 WeakPolarHBondContact O-CB 3.17Å; P1856-Q1867 WeakPolarHBondContact O-CG 3.32Å; P1856-Q1867 PolarHBondContact O-N 3.15Å; T1858-Q1867 PolarHBondContact OG1-NE2 2.72Å; E1865-Q1867 PolarHBondContact O-N 2.85Å; E1865-Q1867 PolarHBondContact O-NE2 3.09Å; E1865-Q1867 VanDerWaalsContact O-NE2 3.17Å; Q1867-S1869 PolarHBondContact O-N 3.02Å; Q1867-S1869 VanDerWaalsContact O-N 3.13Å; Q1867-K1973 VanDerWaalsContact OE1-NZ 3.16Å
1868	D	37.2	Very low	34.5	Very low	134.2 Å²	134.2	117.7 Å²	117.7	72%	0.718	61%	0.614	S	S	*	*			trans	-67.8	49.4	-178.9	-68	-57.5	0	0	0	114.7	K1855 Q1866 F1870	K1855-D1868 VanDerWaalsContact CD-OD1 3.32Å; K1855-D1868 WeakPolarHBondContact CD-OD1 3.27Å; K1855-D1868 WeakPolarHBondContact CE-OD1 3.21Å; K1855-D1868 IonicContact NZ-OD1 2.87Å; K1855-D1868 PolarHBondContact NZ-OD1 2.82Å; Q1866-D1868 PolarHBondContact O-N 2.78Å; D1868-F1870 PolarHBondContact O-N 3.28Å
1869	S	36.3	Very low	34.1	Very low	75 Å²	75	120.1 Å²	120.1	52%	0.524	62%	0.619	S	S	.	*			trans	-114.2	54.3	-175.3	59.7	0	0	0	0	114.8	E1853 W1854 Q1867 K1973	E1853-S1869 WeakPolarHBondContact OE1-CB 3.41Å; E1853-S1869 PolarHBondContact OE1-OG 3.44Å; W1854-S1869 WeakPolarHBondContact O-CA 3.41Å; Q1867-S1869 PolarHBondContact O-N 3.02Å; Q1867-S1869 VanDerWaalsContact O-N 3.13Å; S1869-K1973 WeakPolarHBondContact O-CE 3.35Å; S1869-K1973 PolarHBondContact O-NZ 2.85Å; S1869-K1973 PolarHBondContact OG-NZ 2.7Å
1870	F	32.2	Very low	34	Very low	116.2 Å²	116.2	124 Å²	124	51%	0.51	63%	0.631	S	S	.	*			trans	-127.8	90.8	174.5	-120.8	-77.4	0	0	0	113.4	W1854 P1856 D1868 S1872 A1916 R1972 K1973	W1854-F1870 HydrophobicContact CB-CD1 3.72Å; W1854-F1870 HydrophobicContact CB-CD2 4.05Å; W1854-F1870 HydrophobicContact CB-CE1 3.32Å; W1854-F1870 HydrophobicContact CB-CE2 3.66Å; W1854-F1870 HydrophobicContact CB-CG 4.09Å; W1854-F1870 HydrophobicContact CB-CZ 3.27Å; W1854-F1870 HydrophobicContact CD2-CE2 4.32Å; W1854-F1870 AromaticContact CD2-CZ 3.98Å; W1854-F1870 HydrophobicContact CD2-CZ 3.98Å; W1854-F1870 HydrophobicContact CE3-CZ 4.19Å; W1854-F1870 HydrophobicContact CG-CD2 4.44Å; W1854-F1870 HydrophobicContact CG-CE1 4.18Å; W1854-F1870 AromaticContact CG-CE2 3.76Å; W1854-F1870 HydrophobicContact CG-CE2 3.76Å; W1854-F1870 AromaticContact CG-CZ 3.61Å; W1854-F1870 HydrophobicContact CG-CZ 3.61Å; W1854-F1870 PolarHBondContact N-O 2.79Å; W1854-F1870 WeakPolarHBondContact O-CD1 3.33Å; W1854-F1870 PolarHBondContact O-N 2.96Å; P1856-F1870 HydrophobicContact CG-CB 4.11Å; P1856-F1870 HydrophobicContact CG-CD1 4.05Å; P1856-F1870 HydrophobicContact CG-CD2 4.13Å; P1856-F1870 HydrophobicContact CG-CE1 3.9Å; D1868-F1870 PolarHBondContact O-N 3.28Å; F1870-S1872 PolarHBondContact O-N 2.66Å; F1870-A1916 HydrophobicContact CE1-CB 3.56Å; F1870-A1916 HydrophobicContact CE2-CB 3.91Å; F1870-A1916 HydrophobicContact CZ-CB 3.07Å; F1870-R1972 HydrophobicContact CE2-CB 4.07Å; F1870-R1972 WeakPolarHBondContact CE2-O 3.45Å; F1870-R1972 WeakPolarHBondContact CZ-O 3.4Å; F1870-K1973 HydrophobicContact CE1-CD 4.28Å; F1870-K1973 HydrophobicContact CE2-CD 4.28Å; F1870-K1973 VanDerWaalsContact CE2-CE 3.49Å; F1870-K1973 HydrophobicContact CZ-CD 4.06Å; F1870-K1973 HydrophobicContact CZ-CG 4.44Å
1871	Q	32.2	Very low	33.5	Very low	152.2 Å²	152.2	123.4 Å²	123.4	71%	0.711	63%	0.632	S	S	*	*			trans	-101.1	119.2	172.3	-69.6	-173	-6.9	0	0	112.7	N1566 V1851 K1873	N1566-Q1871 VanDerWaalsContact OD1-CD 3.27Å; N1566-Q1871 PolarHBondContact OD1-NE2 2.85Å; N1566-Q1871 PolarHBondContact OD1-OE1 2.83Å; V1851-Q1871 HydrophobicContact CG1-CB 3.82Å; V1851-Q1871 HydrophobicContact CG1-CG 3.9Å; Q1871-K1873 PolarHBondContact O-N 2.74Å; Q1871-K1873 VanDerWaalsContact O-N 3.08Å
1872	S	32.5	Very low	33.3	Very low	78.4 Å²	78.4	122.3 Å²	122.3	55%	0.548	62%	0.621	S	S	.	*			trans	-78.9	126.3	164.3	65.6	0	0	0	0	112.3	F1870 P1874	F1870-S1872 PolarHBondContact O-N 2.66Å; S1872-P1874 WeakPolarHBondContact O-CD 3.31Å
1873	K	31.8	Very low	33.2	Very low	162.2 Å²	162.2	119.9 Å²	119.9	71%	0.705	61%	0.608	S	S	*	*			trans	-92.5	134.9	176.7	-75.4	-178.7	179.9	178.2	0	108	N1544 D1849 Q1871 Y1875	N1544-K1873 HydrophobicContact CB-CD 4.17Å; N1544-K1873 VanDerWaalsContact O-CD 3.26Å; N1544-K1873 WeakPolarHBondContact O-CD 3.36Å; N1544-K1873 PolarHBondContact O-NZ 3.47Å; D1849-K1873 IonicContact OD1-NZ 3.49Å; D1849-K1873 PolarHBondContact OD1-NZ 2.87Å; D1849-K1873 IonicContact OD2-NZ 2.71Å; D1849-K1873 PolarHBondContact OD2-NZ 2.83Å; Q1871-K1873 PolarHBondContact O-N 2.74Å; Q1871-K1873 VanDerWaalsContact O-N 3.08Å; K1873-Y1875 PolarHBondContact O-N 3.26Å
1874	P	32.6	Very low	33.3	Very low	84.2 Å²	84.2	119.5 Å²	119.5	55%	0.547	60%	0.599	S	S	.	*			trans	-87.4	147.8	177	19.1	-12.5	0	0	0	111.6	W1854 S1872 I1876 N1900	W1854-P1874 HydrophobicContact CZ2-CB 4.22Å; S1872-P1874 WeakPolarHBondContact O-CD 3.31Å; P1874-I1876 HydrophobicContact CB-CD1 4.09Å; P1874-I1876 HydrophobicContact CB-CG1 4.17Å; P1874-I1876 HydrophobicContact CG-CD1 4.46Å; P1874-I1876 HydrophobicContact CG-CG1 4.42Å; P1874-I1876 PolarHBondContact O-N 3.22Å; P1874-I1876 VanDerWaalsContact O-N 3.14Å; P1874-N1900 WeakPolarHBondContact CB-ND2 3.37Å
1875	Y	30.1	Very low	33.1	Very low	176 Å²	176	114.8 Å²	114.8	69%	0.69	59%	0.591	S	S	*	*			trans	-100	104	179.5	-149.7	-96.8	0	0	0	111.5	N1544 K1873 G1877	N1544-Y1875 VanDerWaalsContact OD1-CD2 3.31Å; N1544-Y1875 WeakPolarHBondContact OD1-CD2 3.03Å; K1873-Y1875 PolarHBondContact O-N 3.26Å; Y1875-G1877 VanDerWaalsContact C-N 3.28Å; Y1875-G1877 PolarHBondContact O-N 3.08Å; Y1875-G1877 VanDerWaalsContact O-N 3.14Å
1876	I	32.5	Very low	32.9	Very low	125 Å²	125	109.5 Å²	109.5	64%	0.641	57%	0.573	S	S	*	*			trans	-95.7	113.1	-179.9	-56.5	175.5	0	0	0	109.5	P1874 F1882	P1874-I1876 HydrophobicContact CB-CD1 4.09Å; P1874-I1876 HydrophobicContact CB-CG1 4.17Å; P1874-I1876 HydrophobicContact CG-CD1 4.46Å; P1874-I1876 HydrophobicContact CG-CG1 4.42Å; P1874-I1876 PolarHBondContact O-N 3.22Å; P1874-I1876 VanDerWaalsContact O-N 3.14Å; I1876-F1882 HydrophobicContact CD1-CD1 4.08Å; I1876-F1882 HydrophobicContact CD1-CE1 4.02Å; I1876-F1882 HydrophobicContact CD1-CG 4.49Å; I1876-F1882 HydrophobicContact CD1-CZ 4.38Å; I1876-F1882 HydrophobicContact CG1-CB 4.37Å; I1876-F1882 HydrophobicContact CG1-CD1 3.91Å; I1876-F1882 HydrophobicContact CG1-CE1 4.37Å; I1876-F1882 HydrophobicContact CG1-CG 4.03Å; I1876-F1882 HydrophobicContact CG2-CD1 4.25Å
1877	G	29.3	Very low	32.8	Very low	47.2 Å²	47.2	106.7 Å²	106.7	49%	0.487	56%	0.563	S	S	.	*			trans	-138.3	167.3	173.4	0	0	0	0	0	113	Y1875 E1879	Y1875-G1877 VanDerWaalsContact C-N 3.28Å; Y1875-G1877 PolarHBondContact O-N 3.08Å; Y1875-G1877 VanDerWaalsContact O-N 3.14Å; G1877-E1879 PolarHBondContact O-N 2.84Å
1878	S	29.4	Very low	32.8	Very low	101.2 Å²	101.2	104.5 Å²	104.5	71%	0.708	56%	0.557	S	S	*	*	S	Bend	trans	-33.5	98.3	-174.3	51	0	0	0	0	116.7	S2026	S1878-S2026 VanDerWaalsContact CB-O 3.31Å; S1878-S2026 WeakPolarHBondContact CB-O 3.37Å; S1878-S2026 WeakPolarHBondContact CB-OG 3.17Å; S1878-S2026 PolarHBondContact O-OG 3.47Å; S1878-S2026 WeakPolarHBondContact OG-CB 3.22Å; S1878-S2026 PolarHBondContact OG-O 2.8Å; S1878-S2026 PolarHBondContact OG-OG 3.4Å
1879	E	30.6	Very low	32.6	Very low	129.4 Å²	129.4	104 Å²	104	61%	0.605	55%	0.549	S	S	*	.			trans	-49.3	122.8	171	-68.8	178.6	148.7	0	0	114.8	G1877 T1881 R2289 D2290	G1877-E1879 PolarHBondContact O-N 2.84Å; E1879-T1881 PolarHBondContact O-N 3.08Å; E1879-R2289 IonicContact OE1-CZ 2.67Å; E1879-R2289 IonicContact OE1-NE 2.59Å; E1879-R2289 PolarHBondContact OE1-NE 2.83Å; E1879-R2289 IonicContact OE1-NH2 2.74Å; E1879-R2289 PolarHBondContact OE1-NH2 2.7Å; E1879-R2289 IonicContact OE2-CZ 3.6Å; E1879-R2289 IonicContact OE2-NE 2.61Å; E1879-R2289 IonicContact OE2-NH2 3.82Å; E1879-D2290 HydrophobicContact CG-CB 4.49Å
1880	K	33	Very low	32.7	Very low	150.4 Å²	150.4	106 Å²	106	65%	0.654	55%	0.553	S	S	*	*			trans	-80.4	99.4	171.6	-67.7	177.9	-179.7	173.1	0	113.6	F1882 V2025 D2027	K1880-F1882 HydrophobicContact CB-CE2 4.39Å; K1880-F1882 HydrophobicContact CB-CZ 4.4Å; K1880-V2025 HydrophobicContact CB-CG2 4.45Å; K1880-V2025 HydrophobicContact CD-CG1 4.3Å; K1880-D2027 IonicContact NZ-OD1 3.13Å; K1880-D2027 IonicContact NZ-OD2 2.82Å; K1880-D2027 PolarHBondContact NZ-OD2 2.95Å
1881	T	29.6	Very low	32.7	Very low	80.8 Å²	80.8	102.4 Å²	102.4	50%	0.496	55%	0.549	S	S	.	.			trans	-116.7	131.4	177.8	47	0	0	0	0	111.9	E1879	E1879-T1881 PolarHBondContact O-N 3.08Å
1882	F	31.5	Very low	32.5	Very low	107.6 Å²	107.6	98.2 Å²	98.2	47%	0.472	53%	0.534	S	S	.	.			trans	-106.1	135.5	-178.1	-44.7	-84.2	0	0	0	111.7	I1876 K1880 F1884 A2081 L2082	I1876-F1882 HydrophobicContact CD1-CD1 4.08Å; I1876-F1882 HydrophobicContact CD1-CE1 4.02Å; I1876-F1882 HydrophobicContact CD1-CG 4.49Å; I1876-F1882 HydrophobicContact CD1-CZ 4.38Å; I1876-F1882 HydrophobicContact CG1-CB 4.37Å; I1876-F1882 HydrophobicContact CG1-CD1 3.91Å; I1876-F1882 HydrophobicContact CG1-CE1 4.37Å; I1876-F1882 HydrophobicContact CG1-CG 4.03Å; I1876-F1882 HydrophobicContact CG2-CD1 4.25Å; K1880-F1882 HydrophobicContact CB-CE2 4.39Å; K1880-F1882 HydrophobicContact CB-CZ 4.4Å; F1882-F1884 HydrophobicContact CB-CD2 4.37Å; F1882-F1884 HydrophobicContact CB-CE2 4.01Å; F1882-F1884 HydrophobicContact CB-CZ 3.68Å; F1882-F1884 HydrophobicContact CD2-CB 4.34Å; F1882-F1884 HydrophobicContact CE2-CB 4.12Å; F1882-F1884 HydrophobicContact CG-CZ 4.27Å; F1882-F1884 PolarHBondContact O-N 2.94Å; F1882-A2081 HydrophobicContact CE2-CB 4.47Å; F1882-A2081 HydrophobicContact CZ-CB 4.19Å; F1882-L2082 HydrophobicContact CD1-CB 4.11Å; F1882-L2082 HydrophobicContact CD1-CD2 4.17Å; F1882-L2082 HydrophobicContact CE1-CB 3.69Å; F1882-L2082 HydrophobicContact CZ-CB 4Å
1883	N	31.1	Very low	32.5	Very low	91 Å²	91	95.9 Å²	95.9	49%	0.487	52%	0.516	S	S	.	.			trans	-99.3	105.1	179	-82	-68.5	0	0	0	110.5	V1885 R1903 Q2103	N1883-V1885 PolarHBondContact O-N 3.03Å; N1883-R1903 PolarHBondContact ND2-NH2 3.25Å; N1883-R1903 VanDerWaalsContact ND2-NH2 3.13Å; N1883-Q2103 HydrophobicContact CB-CB 4.44Å; N1883-Q2103 PolarHBondContact O-N 2.58Å; N1883-Q2103 VanDerWaalsContact O-N 3.13Å
1884	F	33.8	Very low	32.5	Very low	88.8 Å²	88.8	93.5 Å²	93.5	39%	0.389	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	123.9	174.5	-108.8	-90.8	0	0	0	111.2	W1854 F1882 A1886 Y1895 S2018 I2086 L2100 M2102	W1854-F1884 HydrophobicContact CZ3-CE2 4.29Å; F1882-F1884 HydrophobicContact CB-CD2 4.37Å; F1882-F1884 HydrophobicContact CB-CE2 4.01Å; F1882-F1884 HydrophobicContact CB-CZ 3.68Å; F1882-F1884 HydrophobicContact CD2-CB 4.34Å; F1882-F1884 HydrophobicContact CE2-CB 4.12Å; F1882-F1884 HydrophobicContact CG-CZ 4.27Å; F1882-F1884 PolarHBondContact O-N 2.94Å; F1884-A1886 HydrophobicContact CD1-CB 4.43Å; F1884-A1886 HydrophobicContact CE1-CB 4.11Å; F1884-A1886 PolarHBondContact O-N 2.96Å; F1884-Y1895 HydrophobicContact CB-CD1 4.23Å; F1884-Y1895 AromaticContact CD1-CD1 3.74Å; F1884-Y1895 HydrophobicContact CD1-CD1 3.74Å; F1884-Y1895 HydrophobicContact CD1-CG 4.5Å; F1884-Y1895 HydrophobicContact CE1-CD1 4.36Å; F1884-Y1895 HydrophobicContact CG-CD1 4.12Å; F1884-S2018 WeakPolarHBondContact O-CA 3.2Å; F1884-S2018 WeakPolarHBondContact O-CB 3.12Å; F1884-I2086 PolarHBondContact N-O 2.74Å; F1884-L2100 HydrophobicContact CE1-CD1 4.41Å; F1884-L2100 HydrophobicContact CE2-CD1 3.9Å; F1884-L2100 HydrophobicContact CZ-CD1 3.59Å; F1884-M2102 HydrophobicContact CD2-CE 3.93Å; F1884-M2102 HydrophobicContact CE2-CE 4.33Å
1885	V	33.9	Very low	32.4	Very low	95 Å²	95	93.5 Å²	93.5	58%	0.576	50%	0.497	S	S	*	.			trans	-114.2	96.9	174.6	-176.5	0	0	0	0	109.1	N1883 N1887 L1896 R2101	N1883-V1885 PolarHBondContact O-N 3.03Å; V1885-N1887 PolarHBondContact O-N 3.46Å; V1885-L1896 PolarHBondContact O-N 2.8Å; V1885-L1896 VanDerWaalsContact O-N 3.14Å; V1885-R2101 PolarHBondContact N-O 2.76Å
1886	A	35.5	Very low	32.4	Very low	38.8 Å²	38.8	90.7 Å²	90.7	32%	0.321	49%	0.494	S	S	.	.			trans	-82.1	121.8	169.2	0	0	0	0	0	109.7	F1884 V1888 V1893 Q1894	F1884-A1886 HydrophobicContact CD1-CB 4.43Å; F1884-A1886 HydrophobicContact CE1-CB 4.11Å; F1884-A1886 PolarHBondContact O-N 2.96Å; A1886-V1888 PolarHBondContact O-N 2.95Å; A1886-V1893 HydrophobicContact CB-CG1 3.93Å; A1886-V1893 HydrophobicContact CB-CG2 4.07Å; A1886-Q1894 CarbonylContact C-O 3.55Å; A1886-Q1894 WeakPolarHBondContact CA-O 3.45Å
1887	N	36.5	Very low	32.2	Very low	92.8 Å²	92.8	88.6 Å²	88.6	50%	0.496	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	112.9	173.8	-165.7	8.4	0	0	0	108.8	V1885 K1889 V1893 Q1894 L1896	V1885-N1887 PolarHBondContact O-N 3.46Å; N1887-K1889 PolarHBondContact O-N 3.24Å; N1887-V1893 HydrophobicContact CB-CG1 4.46Å; N1887-Q1894 PolarHBondContact N-O 3.41Å; N1887-Q1894 PolarHBondContact ND2-O 2.76Å; N1887-Q1894 PolarHBondContact O-N 2.81Å; N1887-L1896 HydrophobicContact CB-CD1 4.44Å
1888	V	36.8	Very low	32.2	Very low	69 Å²	69	93.5 Å²	93.5	42%	0.418	50%	0.498	S	S	.	.			trans	-102	110	-176.4	-179.4	0	0	0	0	109.1	A1886 D1890 T1892 V1893	A1886-V1888 PolarHBondContact O-N 2.95Å; V1888-D1890 PolarHBondContact O-N 3.43Å; V1888-T1892 WeakPolarHBondContact CA-O 3.34Å; V1888-V1893 HydrophobicContact CB-CG2 3.99Å; V1888-V1893 HydrophobicContact CG2-CG2 3.99Å; V1888-V1893 VanDerWaalsContact CG2-CG2 3.44Å
1889	K	34	Very low	32	Very low	123.8 Å²	123.8	94.5 Å²	94.5	54%	0.538	50%	0.495	S	S	.	.	B	Isolated β-bridge	trans	-118	124.5	169.5	-150.1	-175	178	-171.5	0	109	N1887 G1891 T1892	N1887-K1889 PolarHBondContact O-N 3.24Å; K1889-G1891 VanDerWaalsContact C-N 3.26Å; K1889-G1891 PolarHBondContact O-N 3.14Å; K1889-G1891 VanDerWaalsContact O-N 3.11Å; K1889-T1892 PolarHBondContact N-O 2.98Å; K1889-T1892 VanDerWaalsContact N-O 3.12Å; K1889-T1892 PolarHBondContact O-N 3.18Å; K1889-T1892 VanDerWaalsContact O-O 3.14Å; K1889-T1892 PolarHBondContact O-OG1 3.23Å
1890	D	37	Very low	31.9	Very low	116.6 Å²	116.6	93.7 Å²	93.7	62%	0.624	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	34.3	169.9	-49.6	-41.9	0	0	0	115.7	V1888 T1892 R1918 K2092	V1888-D1890 PolarHBondContact O-N 3.43Å; D1890-T1892 VanDerWaalsContact C-N 3.3Å; D1890-T1892 PolarHBondContact O-N 3.06Å; D1890-R1918 VanDerWaalsContact CG-NH2 3.29Å; D1890-R1918 IonicContact OD1-CZ 3.83Å; D1890-R1918 VanDerWaalsContact OD1-CZ 3.23Å; D1890-R1918 IonicContact OD1-NH1 3.6Å; D1890-R1918 PolarHBondContact OD1-NH1 2.89Å; D1890-R1918 IonicContact OD1-NH2 3.83Å; D1890-R1918 PolarHBondContact OD1-NH2 2.81Å; D1890-R1918 IonicContact OD2-NH2 3.99Å; D1890-K2092 HydrophobicContact CB-CD 3.61Å; D1890-K2092 HydrophobicContact CB-CG 4.27Å; D1890-K2092 VanDerWaalsContact O-CE 3.27Å; D1890-K2092 WeakPolarHBondContact O-CE 3.22Å; D1890-K2092 IonicContact OD1-NZ 2.69Å
1891	G	32.8	Very low	31.7	Very low	40.6 Å²	40.6	91.5 Å²	91.5	42%	0.419	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.8	-2.7	169.5	0	0	0	0	0	116.3	K1889	K1889-G1891 VanDerWaalsContact C-N 3.26Å; K1889-G1891 PolarHBondContact O-N 3.14Å; K1889-G1891 VanDerWaalsContact O-N 3.11Å
1892	T	29.2	Very low	31.6	Very low	63.2 Å²	63.2	97.2 Å²	97.2	39%	0.388	51%	0.512	S	S	.	.	B	Isolated β-bridge	trans	-112.5	142	173.5	44.9	0	0	0	0	112.7	V1888 K1889 D1890 T2011	V1888-T1892 WeakPolarHBondContact CA-O 3.34Å; K1889-T1892 PolarHBondContact N-O 2.98Å; K1889-T1892 VanDerWaalsContact N-O 3.12Å; K1889-T1892 PolarHBondContact O-N 3.18Å; K1889-T1892 VanDerWaalsContact O-O 3.14Å; K1889-T1892 PolarHBondContact O-OG1 3.23Å; D1890-T1892 VanDerWaalsContact C-N 3.3Å; D1890-T1892 PolarHBondContact O-N 3.06Å; T1892-T2011 HydrophobicContact CG2-CG2 3.81Å
1893	V	32.4	Very low	31.5	Very low	30.4 Å²	30.4	101.6 Å²	101.6	18%	0.184	53%	0.526	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	115.9	173.3	178.5	0	0	0	0	108.4	A1886 N1887 V1888 Y1895 Y2017	A1886-V1893 HydrophobicContact CB-CG1 3.93Å; A1886-V1893 HydrophobicContact CB-CG2 4.07Å; N1887-V1893 HydrophobicContact CB-CG1 4.46Å; V1888-V1893 HydrophobicContact CB-CG2 3.99Å; V1888-V1893 HydrophobicContact CG2-CG2 3.99Å; V1888-V1893 VanDerWaalsContact CG2-CG2 3.44Å; V1893-Y1895 HydrophobicContact CB-CE2 4.07Å; V1893-Y1895 HydrophobicContact CG1-CD1 4.25Å; V1893-Y1895 HydrophobicContact CG1-CD2 3.98Å; V1893-Y1895 HydrophobicContact CG1-CE1 4Å; V1893-Y1895 HydrophobicContact CG1-CE2 3.73Å; V1893-Y1895 VanDerWaalsContact CG1-CE2 3.49Å; V1893-Y1895 WeakPolarHBondContact O-CD2 3.46Å; V1893-Y1895 PolarHBondContact O-N 3.4Å; V1893-Y2017 HydrophobicContact CB-CE1 3.83Å; V1893-Y2017 HydrophobicContact CG2-CE1 4.33Å; V1893-Y2017 PolarHBondContact O-OH 2.88Å; V1893-Y2017 VanDerWaalsContact O-OH 3.14Å
1894	Q	31.8	Very low	31.5	Very low	111.4 Å²	111.4	101.7 Å²	101.7	52%	0.521	54%	0.539	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	128.4	173	-71.7	-176.2	-23.9	0	0	110.4	A1886 N1887 E2009 T2087 K2515	A1886-Q1894 CarbonylContact C-O 3.55Å; A1886-Q1894 WeakPolarHBondContact CA-O 3.45Å; N1887-Q1894 PolarHBondContact N-O 3.41Å; N1887-Q1894 PolarHBondContact ND2-O 2.76Å; N1887-Q1894 PolarHBondContact O-N 2.81Å; Q1894-E2009 HydrophobicContact CG-CG 4.36Å; Q1894-E2009 PolarHBondContact NE2-OE1 2.88Å; Q1894-T2087 PolarHBondContact O-OG1 2.84Å; Q1894-K2515 PolarHBondContact O-NZ 2.85Å; Q1894-K2515 VanDerWaalsContact O-NZ 3.11Å
1895	Y	30.4	Very low	31.8	Very low	83.8 Å²	83.8	100.6 Å²	100.6	33%	0.329	54%	0.54	S	S	.	.			trans	-89.6	137.1	179.2	-96.7	-110.7	0	0	0	110.6	F1884 V1893 P1897 A2007 Y2017 L2100 K2515	F1884-Y1895 HydrophobicContact CB-CD1 4.23Å; F1884-Y1895 AromaticContact CD1-CD1 3.74Å; F1884-Y1895 HydrophobicContact CD1-CD1 3.74Å; F1884-Y1895 HydrophobicContact CD1-CG 4.5Å; F1884-Y1895 HydrophobicContact CE1-CD1 4.36Å; F1884-Y1895 HydrophobicContact CG-CD1 4.12Å; V1893-Y1895 HydrophobicContact CB-CE2 4.07Å; V1893-Y1895 HydrophobicContact CG1-CD1 4.25Å; V1893-Y1895 HydrophobicContact CG1-CD2 3.98Å; V1893-Y1895 HydrophobicContact CG1-CE1 4Å; V1893-Y1895 HydrophobicContact CG1-CE2 3.73Å; V1893-Y1895 VanDerWaalsContact CG1-CE2 3.49Å; V1893-Y1895 WeakPolarHBondContact O-CD2 3.46Å; V1893-Y1895 PolarHBondContact O-N 3.4Å; Y1895-P1897 HydrophobicContact CD1-CG 4.38Å; Y1895-P1897 HydrophobicContact CE1-CB 3.83Å; Y1895-P1897 HydrophobicContact CE1-CG 3.85Å; Y1895-P1897 VanDerWaalsContact O-CD 3.28Å; Y1895-P1897 WeakPolarHBondContact O-CD 3.4Å; Y1895-A2007 WeakPolarHBondContact O-CA 3.36Å; Y1895-A2007 WeakPolarHBondContact O-CB 3.43Å; Y1895-Y2017 PolarHBondContact OH-OH 3.38Å; Y1895-L2100 VanDerWaalsContact OH-CD1 3.23Å; Y1895-L2100 WeakPolarHBondContact OH-CD1 3.34Å; Y1895-K2515 WeakPolarHBondContact O-CE 3.43Å; Y1895-K2515 PolarHBondContact O-NZ 2.79Å
1896	L	28.5	Very low	32.7	Very low	118 Å²	118	101.7 Å²	101.7	62%	0.618	54%	0.539	S	S	*	.			trans	-125.3	111.8	171.1	-88.3	168.9	0	0	0	109.1	V1885 N1887 Q1898 A2007 K2515	V1885-L1896 PolarHBondContact O-N 2.8Å; V1885-L1896 VanDerWaalsContact O-N 3.14Å; N1887-L1896 HydrophobicContact CB-CD1 4.44Å; L1896-Q1898 PolarHBondContact O-N 3.05Å; L1896-A2007 HydrophobicContact CD2-CB 4.37Å; L1896-K2515 HydrophobicContact CD1-CG 4.5Å; L1896-K2515 HydrophobicContact CG-CD 4.48Å
1897	P	28.8	Very low	34	Very low	81 Å²	81	101.9 Å²	101.9	53%	0.526	53%	0.534	S	S	.	.			trans	-79.3	119.7	175.5	30.7	-31.5	0	0	0	110.8	Y1895 L1899 E2006	Y1895-P1897 HydrophobicContact CD1-CG 4.38Å; Y1895-P1897 HydrophobicContact CE1-CB 3.83Å; Y1895-P1897 HydrophobicContact CE1-CG 3.85Å; Y1895-P1897 VanDerWaalsContact O-CD 3.28Å; Y1895-P1897 WeakPolarHBondContact O-CD 3.4Å; P1897-L1899 HydrophobicContact CB-CD1 4.33Å; P1897-L1899 HydrophobicContact CB-CG 4.39Å; P1897-L1899 PolarHBondContact O-N 2.86Å; P1897-E2006 VanDerWaalsContact CD-O 3.31Å; P1897-E2006 WeakPolarHBondContact CD-O 3.27Å
1898	Q	29.2	Very low	35.4	Very low	149.6 Å²	149.6	97.6 Å²	97.6	70%	0.699	51%	0.511	S	S	*	.			trans	-105.1	110.1	161.7	-77.4	-163.8	-20.6	0	0	110.3	L1896 N1900 V2019	L1896-Q1898 PolarHBondContact O-N 3.05Å; Q1898-N1900 PolarHBondContact O-N 2.9Å; Q1898-V2019 PolarHBondContact NE2-O 2.88Å
1899	L	26.7	Very low	37.4	Very low	123 Å²	123	100.6 Å²	100.6	64%	0.644	52%	0.519	S	S	*	.			trans	-88	129.4	174.1	-91.9	122.9	0	0	0	110.4	P1897 T1901 V1905 L2023	P1897-L1899 HydrophobicContact CB-CD1 4.33Å; P1897-L1899 HydrophobicContact CB-CG 4.39Å; P1897-L1899 PolarHBondContact O-N 2.86Å; L1899-T1901 VanDerWaalsContact C-N 3.31Å; L1899-T1901 HydrophobicContact CD2-CG2 4.28Å; L1899-T1901 PolarHBondContact O-N 2.93Å; L1899-V1905 HydrophobicContact CD1-CG2 3.29Å; L1899-L2023 HydrophobicContact CD1-CD1 4.33Å
1900	N	26.8	Very low	39.6	Very low	112.2 Å²	112.2	99 Å²	99	60%	0.6	51%	0.511	S	S	*	.			trans	-116.6	82	167.3	-100.6	-16.7	0	0	0	112.1	P1874 Q1898	P1874-N1900 WeakPolarHBondContact CB-ND2 3.37Å; Q1898-N1900 PolarHBondContact O-N 2.9Å
1901	T	28.8	Very low	41.7	Very low	104.6 Å²	104.6	93.4 Å²	93.4	64%	0.642	48%	0.482	S	S	*	.			trans	-149.1	152.4	168	21.6	0	0	0	0	110.5	L1899 R1903	L1899-T1901 VanDerWaalsContact C-N 3.31Å; L1899-T1901 HydrophobicContact CD2-CG2 4.28Å; L1899-T1901 PolarHBondContact O-N 2.93Å; T1901-R1903 PolarHBondContact O-N 2.96Å; T1901-R1903 VanDerWaalsContact O-N 3.16Å
1902	K	27.5	Very low	44.1	Very low	200 Å²	200	91.6 Å²	91.6	87%	0.87	46%	0.463	S	S	*	.			trans	-57.4	82.5	176.8	-63.7	179.2	178.1	-179.9	0	113	E2192	K1902-E2192 IonicContact NZ-OE1 2.94Å; K1902-E2192 PolarHBondContact NZ-OE1 2.77Å
1903	R	29.3	Very low	46.7	Very low	199.8 Å²	199.8	88.6 Å²	88.6	75%	0.754	44%	0.444	S	S	*	.			trans	-124.6	141.6	158.9	-86.4	-171	171.8	-167.1	-3.8	108.9	N1883 T1901 V1905	N1883-R1903 PolarHBondContact ND2-NH2 3.25Å; N1883-R1903 VanDerWaalsContact ND2-NH2 3.13Å; T1901-R1903 PolarHBondContact O-N 2.96Å; T1901-R1903 VanDerWaalsContact O-N 3.16Å; R1903-V1905 PolarHBondContact O-N 2.95Å; R1903-V1905 VanDerWaalsContact O-N 3.16Å
1904	A	30.9	Very low	49	Very low	93.2 Å²	93.2	89.5 Å²	89.5	77%	0.77	45%	0.448	S	S	*	.			trans	-63.7	131.6	172	0	0	0	0	0	109.5	E1906	A1904-E1906 PolarHBondContact O-N 3.04Å
1905	V	41.5	Very low	51.4	Low	66.2 Å²	66.2	84.2 Å²	84.2	40%	0.401	42%	0.424	S	S	.	.			trans	-94.8	114.5	175.3	-177.2	0	0	0	0	107.3	L1899 R1903 H2004 L2023	L1899-V1905 HydrophobicContact CD1-CG2 3.29Å; R1903-V1905 PolarHBondContact O-N 2.95Å; R1903-V1905 VanDerWaalsContact O-N 3.16Å; V1905-H2004 HydrophobicContact CB-CB 4.27Å; V1905-H2004 HydrophobicContact CG1-CB 3.87Å; V1905-H2004 WeakPolarHBondContact O-CB 3.3Å; V1905-L2023 HydrophobicContact CG1-CB 4.48Å; V1905-L2023 HydrophobicContact CG1-CD2 3.6Å
1906	E	52	Low	53.6	Low	118.2 Å²	118.2	80.9 Å²	80.9	55%	0.552	41%	0.413	S	S	*	.	P	Polyproline II helix	trans	-59.7	146.7	173.2	-67.1	-175.5	167.2	0	0	111.2	A1904 P1908 P2024	A1904-E1906 PolarHBondContact O-N 3.04Å; E1906-P1908 WeakPolarHBondContact O-CD 3.38Å; E1906-P1908 VanDerWaalsContact O-N 3.11Å; E1906-P2024 HydrophobicContact CB-CB 3.96Å; E1906-P2024 HydrophobicContact CB-CG 3.84Å; E1906-P2024 HydrophobicContact CG-CB 4.49Å; E1906-P2024 WeakPolarHBondContact OE2-CB 3.46Å; E1906-P2024 WeakPolarHBondContact OE2-CG 3.36Å
1907	L	62.5	Low	56.1	Low	43.4 Å²	43.4	75.8 Å²	75.8	23%	0.227	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-56.5	123.1	177.6	-112.6	145.1	0	0	0	110.8	K1909 M1930 M1980 L2000 N2003	L1907-K1909 PolarHBondContact O-N 3.1Å; L1907-M1930 HydrophobicContact CD2-CE 3.91Å; L1907-M1930 HydrophobicContact CG-CE 4.26Å; L1907-M1980 HydrophobicContact CD1-SD 4.15Å; L1907-M1980 HydrophobicContact CD2-CB 3.87Å; L1907-M1980 VanDerWaalsContact CD2-CB 3.48Å; L1907-M1980 HydrophobicContact CD2-CG 4.12Å; L1907-M1980 HydrophobicContact CD2-SD 3.86Å; L1907-M1980 VanDerWaalsContact CD2-SD 3.54Å; L1907-M1980 HydrophobicContact CG-CB 4.13Å; L1907-L2000 HydrophobicContact CD1-CD1 3.75Å; L1907-L2000 HydrophobicContact CD2-CD1 3.87Å; L1907-L2000 VanDerWaalsContact CD2-CD1 3.49Å; L1907-L2000 HydrophobicContact CD2-CD2 4.24Å; L1907-L2000 HydrophobicContact CG-CD1 4.4Å; L1907-N2003 WeakPolarHBondContact CB-O 3.41Å; L1907-N2003 WeakPolarHBondContact CD1-O 3.3Å; L1907-N2003 VanDerWaalsContact CG-O 3.27Å; L1907-N2003 WeakPolarHBondContact CG-O 3.31Å
1908	P	67.3	Low	58.2	Low	2.2 Å²	2.2	77.7 Å²	77.7	1%	0.014	38%	0.383	C	S	.	.	P	Polyproline II helix	trans	-68.2	127	179.5	26.8	-33.5	0	0	0	110.6	E1906 K1910 T1911 M1980 V2005 T2021 D2022 L2023	E1906-P1908 WeakPolarHBondContact O-CD 3.38Å; E1906-P1908 VanDerWaalsContact O-N 3.11Å; P1908-K1910 PolarHBondContact O-N 2.94Å; P1908-T1911 VanDerWaalsContact CG-OG1 3.31Å; P1908-T1911 WeakPolarHBondContact CG-OG1 3.15Å; P1908-M1980 HydrophobicContact CG-SD 4.28Å; P1908-M1980 WeakPolarHBondContact O-CB 3.31Å; P1908-V2005 HydrophobicContact CG-CB 4.3Å; P1908-V2005 HydrophobicContact CG-CG2 3.89Å; P1908-T2021 HydrophobicContact CB-CG2 3.34Å; P1908-T2021 VanDerWaalsContact CB-CG2 3.46Å; P1908-T2021 HydrophobicContact CG-CG2 3.7Å; P1908-D2022 CarbonylContact C-O 3.54Å; P1908-D2022 VanDerWaalsContact C-O 3.26Å; P1908-D2022 WeakPolarHBondContact CA-O 3.31Å; P1908-D2022 VanDerWaalsContact CB-O 3.3Å; P1908-D2022 WeakPolarHBondContact CB-O 3.33Å; P1908-L2023 HydrophobicContact CB-CD2 4.34Å
1909	K	77.3	Confident	60.3	Low	131.8 Å²	131.8	79 Å²	79	57%	0.573	39%	0.386	S	S	*	.	S	Bend	trans	-55.2	-30.5	-175.6	-72	-177	177.3	175.5	0	112.6	L1907 M1980 D2022	L1907-K1909 PolarHBondContact O-N 3.1Å; K1909-M1980 CarbonylContact C-O 3.44Å; K1909-M1980 WeakPolarHBondContact CA-O 3.4Å; K1909-M1980 PolarHBondContact O-N 3.06Å; K1909-M1980 VanDerWaalsContact O-O 3.14Å; K1909-D2022 PolarHBondContact N-O 2.96Å; K1909-D2022 VanDerWaalsContact N-O 3.11Å
1910	K	81.7	Confident	62.5	Low	88.8 Å²	88.8	79.6 Å²	79.6	39%	0.386	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	145.4	171.3	-66.9	-179.3	-161.5	126.8	0	111	P1908 T1977 F1978 T1979 T2021 D2022	P1908-K1910 PolarHBondContact O-N 2.94Å; K1910-T1977 HydrophobicContact CB-CG2 4.07Å; K1910-T1977 HydrophobicContact CD-CG2 4.27Å; K1910-T1977 HydrophobicContact CG-CG2 4.14Å; K1910-T1977 VanDerWaalsContact CG-CG2 3.47Å; K1910-F1978 CarbonylContact C-O 3.54Å; K1910-F1978 VanDerWaalsContact CA-O 3.27Å; K1910-F1978 WeakPolarHBondContact CA-O 3.32Å; K1910-T1979 HydrophobicContact CG-CG2 4.19Å; K1910-T2021 CarbonylContact O-C 3.57Å; K1910-T2021 WeakPolarHBondContact O-CA 3.47Å; K1910-D2022 HydrophobicContact CB-CB 4.25Å; K1910-D2022 WeakPolarHBondContact CB-OD2 3.17Å; K1910-D2022 WeakPolarHBondContact CD-OD2 3.17Å; K1910-D2022 WeakPolarHBondContact CE-OD2 3.37Å; K1910-D2022 VanDerWaalsContact CG-OD2 3.25Å; K1910-D2022 WeakPolarHBondContact CG-OD2 3.48Å; K1910-D2022 IonicContact NZ-OD2 3.2Å; K1910-D2022 PolarHBondContact NZ-OD2 3.12Å; K1910-D2022 PolarHBondContact O-N 2.83Å; K1910-D2022 VanDerWaalsContact O-N 3.09Å
1911	T	80.4	Confident	64.8	Low	0 Å²	0	75 Å²	75	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	117.3	163.6	-55.7	0	0	0	0	110.2	P1908 V1913 T1977 F1978 M1980 I2008 V2019 D2020 T2021	P1908-T1911 VanDerWaalsContact CG-OG1 3.31Å; P1908-T1911 WeakPolarHBondContact CG-OG1 3.15Å; T1911-V1913 HydrophobicContact CG2-CG2 4.19Å; T1911-T1977 CarbonylContact O-C 3.54Å; T1911-T1977 WeakPolarHBondContact O-CA 3.38Å; T1911-F1978 HydrophobicContact CG2-CD2 4.47Å; T1911-F1978 PolarHBondContact N-O 3.01Å; T1911-F1978 PolarHBondContact O-N 3.15Å; T1911-M1980 WeakPolarHBondContact OG1-CE 3.19Å; T1911-I2008 HydrophobicContact CG2-CD1 3.35Å; T1911-I2008 HydrophobicContact CG2-CG1 4.31Å; T1911-V2019 HydrophobicContact CG2-CG1 3.9Å; T1911-D2020 CarbonylContact C-O 3.6Å; T1911-T2021 HydrophobicContact CG2-CG2 4.34Å; T1911-T2021 VanDerWaalsContact CG2-OG1 3.31Å; T1911-T2021 WeakPolarHBondContact CG2-OG1 3.42Å
1912	T	82.9	Confident	67.4	Low	3.8 Å²	3.8	74.7 Å²	74.7	2%	0.023	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	127.3	174.2	-64	0	0	0	0	110	R1975 L1976 T1977 V2019 D2020	T1912-R1975 HydrophobicContact CG2-CG 3.7Å; T1912-R1975 VanDerWaalsContact CG2-NE 3.27Å; T1912-R1975 PolarHBondContact OG1-NH2 2.97Å; T1912-R1975 VanDerWaalsContact OG1-NH2 3.12Å; T1912-L1976 CarbonylContact C-O 3.53Å; T1912-L1976 VanDerWaalsContact CA-O 3.28Å; T1912-L1976 WeakPolarHBondContact CA-O 3.26Å; T1912-L1976 WeakPolarHBondContact CG2-O 3.32Å; T1912-T1977 PolarHBondContact OG1-OG1 3.02Å; T1912-V2019 CarbonylContact O-C 3.54Å; T1912-V2019 WeakPolarHBondContact O-CA 3.31Å; T1912-D2020 WeakPolarHBondContact CA-O 3.4Å; T1912-D2020 WeakPolarHBondContact CB-O 3.43Å; T1912-D2020 HydrophobicContact CG2-CB 4.32Å; T1912-D2020 PolarHBondContact N-O 3.08Å; T1912-D2020 PolarHBondContact O-N 3.17Å
1913	V	83.7	Confident	70.3	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	112.2	171.9	-173.7	0	0	0	0	108.6	T1911 V1915 V1926 L1976 F1978 I2008 V2010 Y2017 S2018 V2019	T1911-V1913 HydrophobicContact CG2-CG2 4.19Å; V1913-V1915 HydrophobicContact CG1-CG2 3.86Å; V1913-V1926 HydrophobicContact CG1-CG1 4.4Å; V1913-V1926 HydrophobicContact CG1-CG2 4.42Å; V1913-V1926 HydrophobicContact CG2-CG1 4.27Å; V1913-L1976 HydrophobicContact CB-CB 4.34Å; V1913-L1976 HydrophobicContact CB-CD1 4.4Å; V1913-L1976 PolarHBondContact N-O 2.96Å; V1913-L1976 VanDerWaalsContact O-CB 3.31Å; V1913-L1976 WeakPolarHBondContact O-CB 3.32Å; V1913-L1976 PolarHBondContact O-N 3.1Å; V1913-F1978 HydrophobicContact CB-CE2 4.47Å; V1913-F1978 HydrophobicContact CG2-CD2 4.31Å; V1913-F1978 HydrophobicContact CG2-CE2 4Å; V1913-I2008 HydrophobicContact CG2-CD1 4.4Å; V1913-I2008 HydrophobicContact CG2-CG2 4Å; V1913-V2010 HydrophobicContact CG1-CG2 3.74Å; V1913-Y2017 HydrophobicContact CG1-CD2 4.26Å; V1913-S2018 CarbonylContact C-O 3.46Å; V1913-S2018 WeakPolarHBondContact CA-O 3.44Å; V1913-V2019 HydrophobicContact CG1-CG2 4.49Å; V1913-V2019 HydrophobicContact CG2-CG2 4.42Å
1914	N	81.3	Confident	73.1	Confident	48 Å²	48	59.3 Å²	59.3	26%	0.257	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	106.1	175.3	-61.2	-73.2	0	0	0	109.1	I1974 R1975 Y2017 S2018	N1914-I1974 CarbonylContact C-O 3.55Å; N1914-I1974 WeakPolarHBondContact CA-O 3.37Å; N1914-R1975 WeakPolarHBondContact OD1-CB 3.37Å; N1914-R1975 VanDerWaalsContact OD1-CG 3.23Å; N1914-R1975 WeakPolarHBondContact OD1-CG 3.34Å; N1914-Y2017 CarbonylContact O-C 3.57Å; N1914-Y2017 WeakPolarHBondContact O-CA 3.29Å; N1914-Y2017 VanDerWaalsContact O-CB 3.24Å; N1914-Y2017 WeakPolarHBondContact O-CB 3.28Å; N1914-S2018 PolarHBondContact N-O 2.91Å; N1914-S2018 PolarHBondContact ND2-OG 3.09Å; N1914-S2018 PolarHBondContact O-N 3.02Å; N1914-S2018 VanDerWaalsContact O-N 3.09Å
1915	V	81.9	Confident	75.9	Confident	1.4 Å²	1.4	58.9 Å²	58.9	1%	0.008	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	126.6	-179.5	-172.2	0	0	0	0	110.1	V1913 L1917 F1924 V1926 K1973 I1974 L1976 V2010 V2014	V1913-V1915 HydrophobicContact CG1-CG2 3.86Å; V1915-L1917 HydrophobicContact CG1-CD2 3.72Å; V1915-L1917 HydrophobicContact CG1-CG 4.47Å; V1915-F1924 HydrophobicContact CB-CD2 4.34Å; V1915-F1924 HydrophobicContact CB-CE2 4.27Å; V1915-F1924 HydrophobicContact CG1-CD2 4.21Å; V1915-F1924 HydrophobicContact CG1-CE2 4.31Å; V1915-F1924 HydrophobicContact CG1-CG 4.37Å; V1915-F1924 HydrophobicContact CG2-CD2 4.34Å; V1915-F1924 HydrophobicContact CG2-CE2 4.28Å; V1915-V1926 HydrophobicContact CG2-CG2 4.32Å; V1915-K1973 CarbonylContact O-C 3.56Å; V1915-K1973 WeakPolarHBondContact O-CA 3.39Å; V1915-I1974 HydrophobicContact CB-CB 4.47Å; V1915-I1974 PolarHBondContact N-O 3.13Å; V1915-I1974 PolarHBondContact O-N 3.06Å; V1915-L1976 HydrophobicContact CG2-CD1 3.78Å; V1915-L1976 HydrophobicContact CG2-CG 4.44Å; V1915-V2010 HydrophobicContact CG1-CG1 4.2Å; V1915-V2010 HydrophobicContact CG2-CG1 4.06Å; V1915-V2014 HydrophobicContact CG1-CB 4.47Å; V1915-V2014 HydrophobicContact CG1-CG1 4.01Å; V1915-V2014 HydrophobicContact CG1-CG2 3.79Å
1916	A	77.4	Confident	78.2	Confident	13.2 Å²	13.2	55.8 Å²	55.8	11%	0.109	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	128.5	168.3	0	0	0	0	0	109.5	F1870 R1972 K1973 V2014 Y2015 G2016	F1870-A1916 HydrophobicContact CE1-CB 3.56Å; F1870-A1916 HydrophobicContact CE2-CB 3.91Å; F1870-A1916 HydrophobicContact CZ-CB 3.07Å; A1916-R1972 CarbonylContact C-O 3.5Å; A1916-R1972 VanDerWaalsContact CA-O 3.27Å; A1916-R1972 WeakPolarHBondContact CA-O 3.36Å; A1916-R1972 WeakPolarHBondContact CB-O 3.43Å; A1916-K1973 HydrophobicContact CB-CG 4.31Å; A1916-V2014 WeakPolarHBondContact O-CG1 3.37Å; A1916-Y2015 HydrophobicContact CB-CD1 4.3Å; A1916-Y2015 PolarHBondContact O-N 3.02Å; A1916-G2016 WeakPolarHBondContact CA-O 3.33Å; A1916-G2016 WeakPolarHBondContact CB-O 3.37Å; A1916-G2016 PolarHBondContact N-O 3.13Å; A1916-G2016 PolarHBondContact O-N 3.11Å
1917	L	79.2	Confident	80	Confident	12.2 Å²	12.2	50.6 Å²	50.6	6%	0.064	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	151.1	-177.4	-61.2	-175.5	0	0	0	112.6	V1915 A1921 F1924 L1942 L1971 R1972 I1974 V2014	V1915-L1917 HydrophobicContact CG1-CD2 3.72Å; V1915-L1917 HydrophobicContact CG1-CG 4.47Å; L1917-A1921 HydrophobicContact CB-CB 3.99Å; L1917-A1921 HydrophobicContact CD1-CB 4.35Å; L1917-F1924 HydrophobicContact CD1-CD1 3.93Å; L1917-F1924 HydrophobicContact CD1-CE1 4.19Å; L1917-F1924 HydrophobicContact CD2-CB 3.94Å; L1917-F1924 HydrophobicContact CD2-CD1 3.67Å; L1917-F1924 HydrophobicContact CD2-CE1 4.39Å; L1917-F1924 HydrophobicContact CD2-CG 3.94Å; L1917-F1924 HydrophobicContact CG-CD1 4.38Å; L1917-L1942 HydrophobicContact CD1-CD1 3.81Å; L1917-L1942 HydrophobicContact CD1-CD2 3.89Å; L1917-L1942 HydrophobicContact CD1-CG 4.36Å; L1917-L1971 HydrophobicContact CB-CD2 4.48Å; L1917-L1971 HydrophobicContact CD1-CB 4.34Å; L1917-L1971 HydrophobicContact CD1-CD2 4.34Å; L1917-L1971 WeakPolarHBondContact CD1-O 3.34Å; L1917-L1971 PolarHBondContact N-O 2.78Å; L1917-L1971 VanDerWaalsContact N-O 3.17Å; L1917-R1972 PolarHBondContact N-O 2.91Å; L1917-R1972 VanDerWaalsContact N-O 3.14Å; L1917-I1974 HydrophobicContact CD1-CD1 3.66Å; L1917-I1974 HydrophobicContact CG-CD1 4.19Å; L1917-V2014 HydrophobicContact CD2-CG2 4.09Å
1918	R	74.4	Confident	81.2	Confident	119.8 Å²	119.8	48.5 Å²	48.5	45%	0.452	23%	0.226	S	C	.	.	P	Polyproline II helix	trans	-66.7	157.9	171.8	-65.6	-178.6	179.8	-139.2	-3	110.7	D1890 N1920 A1921 D2013 V2014	D1890-R1918 VanDerWaalsContact CG-NH2 3.29Å; D1890-R1918 IonicContact OD1-CZ 3.83Å; D1890-R1918 VanDerWaalsContact OD1-CZ 3.23Å; D1890-R1918 IonicContact OD1-NH1 3.6Å; D1890-R1918 PolarHBondContact OD1-NH1 2.89Å; D1890-R1918 IonicContact OD1-NH2 3.83Å; D1890-R1918 PolarHBondContact OD1-NH2 2.81Å; D1890-R1918 IonicContact OD2-NH2 3.99Å; R1918-N1920 PolarHBondContact O-N 2.98Å; R1918-A1921 WeakPolarHBondContact O-CB 3.38Å; R1918-A1921 PolarHBondContact O-N 3.14Å; R1918-D2013 PolarHBondContact N-O 3.13Å; R1918-V2014 PolarHBondContact NE-O 3.07Å
1919	K	71.8	Confident	82	Confident	176.2 Å²	176.2	51.2 Å²	51.2	77%	0.766	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.5	134.3	166.1	-171.4	-178.5	178.2	-173.1	0	107.9	A1921	K1919-A1921 VanDerWaalsContact C-N 3.27Å; K1919-A1921 PolarHBondContact O-N 3.03Å
1920	N	74.4	Confident	82.2	Confident	137 Å²	137	45 Å²	45	73%	0.733	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.5	22	-178.5	-54.5	-2.5	0	0	0	116	R1918 Q1922	R1918-N1920 PolarHBondContact O-N 2.98Å; N1920-Q1922 PolarHBondContact O-N 3.32Å; N1920-Q1922 PolarHBondContact O-NE2 2.86Å
1921	A	75.4	Confident	81.6	Confident	15 Å²	15	41.1 Å²	41.1	12%	0.124	20%	0.196	C	C	.	.			trans	-49	140.8	171	0	0	0	0	0	113	L1917 R1918 K1919 L1942 D2013	L1917-A1921 HydrophobicContact CB-CB 3.99Å; L1917-A1921 HydrophobicContact CD1-CB 4.35Å; R1918-A1921 WeakPolarHBondContact O-CB 3.38Å; R1918-A1921 PolarHBondContact O-N 3.14Å; K1919-A1921 VanDerWaalsContact C-N 3.27Å; K1919-A1921 PolarHBondContact O-N 3.03Å; A1921-L1942 VanDerWaalsContact C-CD1 3.49Å; A1921-L1942 HydrophobicContact CB-CD1 3.92Å; A1921-L1942 VanDerWaalsContact O-CD1 3.28Å; A1921-L1942 WeakPolarHBondContact O-CD1 3.35Å; A1921-D2013 HydrophobicContact CB-CB 3.43Å; A1921-D2013 VanDerWaalsContact CB-CB 3.44Å
1922	Q	82.7	Confident	81	Confident	99.2 Å²	99.2	46.4 Å²	46.4	46%	0.464	23%	0.23	S	C	.	.			trans	-107.8	-34.6	175	-60	-124	5.3	0	0	112.4	N1920 L1942 D2013	N1920-Q1922 PolarHBondContact O-N 3.32Å; N1920-Q1922 PolarHBondContact O-NE2 2.86Å; Q1922-L1942 WeakPolarHBondContact O-CB 3.29Å; Q1922-L1942 WeakPolarHBondContact O-CG 3.5Å; Q1922-L1942 PolarHBondContact O-N 3.06Å; Q1922-D2013 WeakPolarHBondContact CA-OD2 3.35Å; Q1922-D2013 PolarHBondContact N-OD2 3.09Å
1923	N	87.3	Confident	80.7	Confident	74.4 Å²	74.4	52.7 Å²	52.7	40%	0.398	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	161.5	-179.1	73.6	90.5	0	0	0	112.8	A1940 D2013	N1923-A1940 WeakPolarHBondContact CA-O 3.44Å; N1923-D2013 PolarHBondContact N-OD2 3.06Å; N1923-D2013 PolarHBondContact ND2-OD2 3.19Å; N1923-D2013 VanDerWaalsContact O-CB 3.3Å; N1923-D2013 WeakPolarHBondContact O-CB 3.35Å; N1923-D2013 PolarHBondContact O-N 2.96Å
1924	F	88.1	Confident	80.6	Confident	1.4 Å²	1.4	53.2 Å²	53.2	1%	0.006	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	164.1	157.7	67.5	-84.7	0	0	0	110	V1915 L1917 V1926 A1940 L1942 W1946 I1974 L1976 T2011 V2014	V1915-F1924 HydrophobicContact CB-CD2 4.34Å; V1915-F1924 HydrophobicContact CB-CE2 4.27Å; V1915-F1924 HydrophobicContact CG1-CD2 4.21Å; V1915-F1924 HydrophobicContact CG1-CE2 4.31Å; V1915-F1924 HydrophobicContact CG1-CG 4.37Å; V1915-F1924 HydrophobicContact CG2-CD2 4.34Å; V1915-F1924 HydrophobicContact CG2-CE2 4.28Å; L1917-F1924 HydrophobicContact CD1-CD1 3.93Å; L1917-F1924 HydrophobicContact CD1-CE1 4.19Å; L1917-F1924 HydrophobicContact CD2-CB 3.94Å; L1917-F1924 HydrophobicContact CD2-CD1 3.67Å; L1917-F1924 HydrophobicContact CD2-CE1 4.39Å; L1917-F1924 HydrophobicContact CD2-CG 3.94Å; L1917-F1924 HydrophobicContact CG-CD1 4.38Å; F1924-V1926 HydrophobicContact CD2-CG2 4.14Å; F1924-V1926 HydrophobicContact CE2-CG2 4.14Å; F1924-A1940 HydrophobicContact CD1-CB 3.84Å; F1924-A1940 HydrophobicContact CD2-CB 3.92Å; F1924-A1940 HydrophobicContact CE1-CB 3.47Å; F1924-A1940 VanDerWaalsContact CE1-CB 3.48Å; F1924-A1940 HydrophobicContact CE2-CB 3.53Å; F1924-A1940 VanDerWaalsContact CE2-CB 3.48Å; F1924-A1940 HydrophobicContact CG-CB 4.07Å; F1924-A1940 HydrophobicContact CZ-CB 3.3Å; F1924-A1940 PolarHBondContact N-O 3.05Å; F1924-A1940 VanDerWaalsContact N-O 3.11Å; F1924-A1940 CarbonylContact O-C 3.34Å; F1924-A1940 WeakPolarHBondContact O-CA 3.33Å; F1924-A1940 WeakPolarHBondContact O-CB 3.34Å; F1924-A1940 PolarHBondContact O-N 2.9Å; F1924-L1942 HydrophobicContact CD1-CD2 4.23Å; F1924-L1942 HydrophobicContact CE1-CD2 4.11Å; F1924-W1946 HydrophobicContact CE1-CH2 4.21Å; F1924-W1946 AromaticContact CE1-CZ2 3.92Å; F1924-W1946 HydrophobicContact CE1-CZ2 3.96Å; F1924-W1946 AromaticContact CZ-CH2 3.77Å; F1924-W1946 HydrophobicContact CZ-CH2 3.77Å; F1924-W1946 AromaticContact CZ-CZ2 3.95Å; F1924-W1946 HydrophobicContact CZ-CZ2 3.95Å; F1924-W1946 HydrophobicContact CZ-CZ3 4.28Å; F1924-I1974 HydrophobicContact CD1-CD1 4.36Å; F1924-I1974 HydrophobicContact CE1-CD1 3.67Å; F1924-I1974 VanDerWaalsContact CE1-CD1 3.49Å; F1924-I1974 HydrophobicContact CZ-CD1 3.89Å; F1924-I1974 HydrophobicContact CZ-CG2 4.4Å; F1924-L1976 HydrophobicContact CE2-CD1 3.96Å; F1924-L1976 HydrophobicContact CZ-CD1 4.43Å; F1924-L1976 HydrophobicContact CZ-CD2 4.43Å; F1924-T2011 CarbonylContact C-O 3.43Å; F1924-T2011 VanDerWaalsContact CA-O 3.3Å; F1924-T2011 WeakPolarHBondContact CA-O 3.39Å; F1924-T2011 WeakPolarHBondContact CB-O 3.3Å; F1924-V2014 HydrophobicContact CB-CG2 3.77Å
1925	R	90.5	Very high	80.8	Confident	85.2 Å²	85.2	51.8 Å²	51.8	32%	0.322	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	145.8	175.7	167.4	-176.9	-68.4	166.4	0.8	110.2	D1927 R1937 L1938 D1939 V2010 T2011	R1925-D1927 WeakPolarHBondContact CD-OD1 3.38Å; R1925-D1927 WeakPolarHBondContact CD-OD2 3.21Å; R1925-D1927 WeakPolarHBondContact CG-OD1 3.37Å; R1925-R1937 HydrophobicContact CG-CG 4.35Å; R1925-L1938 CarbonylContact C-O 3.55Å; R1925-L1938 VanDerWaalsContact CA-O 3.25Å; R1925-L1938 WeakPolarHBondContact CA-O 3.41Å; R1925-D1939 IonicContact CZ-OD1 3.26Å; R1925-D1939 IonicContact NE-OD1 3.09Å; R1925-D1939 PolarHBondContact NE-OD1 2.96Å; R1925-D1939 IonicContact NH2-OD1 3.09Å; R1925-D1939 PolarHBondContact NH2-OD1 3.12Å; R1925-D1939 IonicContact NH2-OD2 2.84Å; R1925-V2010 WeakPolarHBondContact O-CA 3.39Å; R1925-T2011 WeakPolarHBondContact CB-OG1 3.34Å; R1925-T2011 PolarHBondContact N-O 2.91Å; R1925-T2011 PolarHBondContact O-N 3.22Å
1926	V	90.1	Very high	81.2	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	115.4	169.2	-177.2	0	0	0	0	108.9	V1913 V1915 F1924 V1928 L1938 L1976 F1978 I2008 E2009 V2010	V1913-V1926 HydrophobicContact CG1-CG1 4.4Å; V1913-V1926 HydrophobicContact CG1-CG2 4.42Å; V1913-V1926 HydrophobicContact CG2-CG1 4.27Å; V1915-V1926 HydrophobicContact CG2-CG2 4.32Å; F1924-V1926 HydrophobicContact CD2-CG2 4.14Å; F1924-V1926 HydrophobicContact CE2-CG2 4.14Å; V1926-V1928 HydrophobicContact CG1-CG2 4.43Å; V1926-L1938 HydrophobicContact CB-CB 4.36Å; V1926-L1938 PolarHBondContact N-O 3.17Å; V1926-L1938 PolarHBondContact O-N 2.95Å; V1926-L1976 HydrophobicContact CB-CD1 4.3Å; V1926-L1976 HydrophobicContact CG2-CD1 3.71Å; V1926-F1978 HydrophobicContact CB-CZ 4.34Å; V1926-F1978 HydrophobicContact CG1-CE2 4.01Å; V1926-F1978 HydrophobicContact CG1-CZ 3.96Å; V1926-I2008 HydrophobicContact CG1-CG2 4.1Å; V1926-E2009 CarbonylContact C-O 3.5Å; V1926-E2009 WeakPolarHBondContact CA-O 3.42Å; V1926-V2010 HydrophobicContact CG1-CG2 4.22Å; V1926-V2010 HydrophobicContact CG2-CG1 4.28Å; V1926-V2010 HydrophobicContact CG2-CG2 4.12Å
1927	D	89.7	Confident	81.9	Confident	9.2 Å²	9.2	54.2 Å²	54.2	5%	0.049	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	114.9	176	-75.4	-2.5	0	0	0	109.1	R1925 K1929 T1935 R1937 I2008 E2009	R1925-D1927 WeakPolarHBondContact CD-OD1 3.38Å; R1925-D1927 WeakPolarHBondContact CD-OD2 3.21Å; R1925-D1927 WeakPolarHBondContact CG-OD1 3.37Å; D1927-K1929 HydrophobicContact CB-CD 4.41Å; D1927-K1929 IonicContact OD2-NZ 2.67Å; D1927-K1929 PolarHBondContact OD2-NZ 2.85Å; D1927-T1935 HydrophobicContact CB-CG2 3.88Å; D1927-T1935 WeakPolarHBondContact OD2-CG2 3.3Å; D1927-R1937 VanDerWaalsContact CG-NE 3.35Å; D1927-R1937 WeakPolarHBondContact OD1-CA 3.39Å; D1927-R1937 VanDerWaalsContact OD1-CB 3.28Å; D1927-R1937 WeakPolarHBondContact OD1-CB 3.37Å; D1927-R1937 WeakPolarHBondContact OD1-CD 3.32Å; D1927-R1937 VanDerWaalsContact OD1-CG 3.3Å; D1927-R1937 WeakPolarHBondContact OD1-CG 3.38Å; D1927-R1937 IonicContact OD1-CZ 3.51Å; D1927-R1937 IonicContact OD1-NE 2.88Å; D1927-R1937 PolarHBondContact OD1-NE 3.04Å; D1927-R1937 IonicContact OD1-NH2 3.36Å; D1927-R1937 IonicContact OD2-CZ 3.26Å; D1927-R1937 VanDerWaalsContact OD2-CZ 3.31Å; D1927-R1937 IonicContact OD2-NE 3.26Å; D1927-R1937 PolarHBondContact OD2-NE 3.04Å; D1927-R1937 VanDerWaalsContact OD2-NE 3.14Å; D1927-R1937 IonicContact OD2-NH2 2.95Å; D1927-R1937 PolarHBondContact OD2-NH2 2.9Å; D1927-I2008 WeakPolarHBondContact O-CA 3.29Å; D1927-E2009 HydrophobicContact CB-CB 4.4Å; D1927-E2009 PolarHBondContact N-O 3.13Å; D1927-E2009 PolarHBondContact O-N 3.08Å
1928	V	87.2	Confident	82.5	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	105.2	170.5	-175.8	0	0	0	0	107.6	V1926 M1930 T1935 L1936 F1978 M1980 V2005 I2008	V1926-V1928 HydrophobicContact CG1-CG2 4.43Å; V1928-M1930 HydrophobicContact CB-CE 4.12Å; V1928-M1930 HydrophobicContact CG1-CE 3.52Å; V1928-M1930 VanDerWaalsContact CG1-CE 3.48Å; V1928-M1930 HydrophobicContact CG1-CG 4.09Å; V1928-M1930 HydrophobicContact CG1-SD 4.17Å; V1928-T1935 CarbonylContact O-C 3.54Å; V1928-T1935 WeakPolarHBondContact O-CA 3.32Å; V1928-L1936 HydrophobicContact CB-CB 4.29Å; V1928-L1936 PolarHBondContact N-O 3.17Å; V1928-L1936 PolarHBondContact O-N 3.2Å; V1928-F1978 HydrophobicContact CG2-CD2 4.46Å; V1928-F1978 HydrophobicContact CG2-CE1 4.45Å; V1928-F1978 HydrophobicContact CG2-CE2 4.28Å; V1928-F1978 HydrophobicContact CG2-CZ 4.29Å; V1928-M1980 HydrophobicContact CG1-CE 4.18Å; V1928-V2005 HydrophobicContact CG1-CB 4.47Å; V1928-V2005 HydrophobicContact CG1-CG1 3.82Å; V1928-V2005 HydrophobicContact CG1-CG2 3.9Å; V1928-I2008 HydrophobicContact CB-CD1 4.48Å; V1928-I2008 HydrophobicContact CB-CG1 4.33Å; V1928-I2008 HydrophobicContact CG1-CD1 4.12Å; V1928-I2008 HydrophobicContact CG1-CG1 3.98Å; V1928-I2008 HydrophobicContact CG2-CD1 4Å; V1928-I2008 HydrophobicContact CG2-CG1 4.12Å; V1928-I2008 HydrophobicContact CG2-CG2 4.48Å
1929	K	84.6	Confident	83.3	Confident	59 Å²	59	49.7 Å²	49.7	26%	0.257	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	130.1	176.6	-59.9	-161.1	175.4	169.2	0	109	D1927 T1935 V2005 E2006 A2007 E2009	D1927-K1929 HydrophobicContact CB-CD 4.41Å; D1927-K1929 IonicContact OD2-NZ 2.67Å; D1927-K1929 PolarHBondContact OD2-NZ 2.85Å; K1929-T1935 HydrophobicContact CD-CG2 3.88Å; K1929-T1935 WeakPolarHBondContact CD-OG1 3.2Å; K1929-T1935 HydrophobicContact CG-CG2 4.39Å; K1929-V2005 CarbonylContact O-C 3.36Å; K1929-V2005 WeakPolarHBondContact O-CA 3.34Å; K1929-E2006 HydrophobicContact CB-CB 4.32Å; K1929-E2006 PolarHBondContact O-N 3.22Å; K1929-A2007 HydrophobicContact CB-CB 4.28Å; K1929-A2007 HydrophobicContact CD-CB 4.35Å; K1929-A2007 HydrophobicContact CG-CB 3.81Å; K1929-A2007 PolarHBondContact N-O 2.96Å; K1929-E2009 WeakPolarHBondContact CE-OE1 3.4Å; K1929-E2009 WeakPolarHBondContact CE-OE2 3.29Å; K1929-E2009 IonicContact NZ-OE1 3.49Å; K1929-E2009 PolarHBondContact NZ-OE1 3.18Å; K1929-E2009 IonicContact NZ-OE2 2.91Å; K1929-E2009 PolarHBondContact NZ-OE2 2.94Å
1930	M	81.3	Confident	84.1	Confident	1.6 Å²	1.6	41.4 Å²	41.4	1%	0.008	21%	0.206	C	C	.	.			trans	-125.3	30.4	-169.2	-65.1	-173.1	157.3	0	0	112.8	L1907 V1928 A1934 L1936 M1980 L2000 P2001 G2002 H2004 V2005	L1907-M1930 HydrophobicContact CD2-CE 3.91Å; L1907-M1930 HydrophobicContact CG-CE 4.26Å; V1928-M1930 HydrophobicContact CB-CE 4.12Å; V1928-M1930 HydrophobicContact CG1-CE 3.52Å; V1928-M1930 VanDerWaalsContact CG1-CE 3.48Å; V1928-M1930 HydrophobicContact CG1-CG 4.09Å; V1928-M1930 HydrophobicContact CG1-SD 4.17Å; M1930-A1934 HydrophobicContact CB-CB 4.22Å; M1930-A1934 PolarHBondContact N-O 2.99Å; M1930-L1936 HydrophobicContact CE-CB 4.02Å; M1930-L1936 HydrophobicContact CE-CD2 4.02Å; M1930-L1936 HydrophobicContact SD-CB 4.2Å; M1930-M1980 HydrophobicContact CE-CE 3.78Å; M1930-M1980 HydrophobicContact CE-SD 3.76Å; M1930-M1980 VanDerWaalsContact CE-SD 3.59Å; M1930-L2000 HydrophobicContact CE-CD1 4.45Å; M1930-L2000 HydrophobicContact CE-CD2 3.65Å; M1930-L2000 HydrophobicContact SD-CB 4.49Å; M1930-L2000 HydrophobicContact SD-CD2 3.76Å; M1930-P2001 HydrophobicContact CB-CG 4.46Å; M1930-P2001 HydrophobicContact CG-CG 4.46Å; M1930-P2001 HydrophobicContact SD-CG 3.79Å; M1930-G2002 WeakPolarHBondContact CE-O 3.17Å; M1930-G2002 WeakPolarHBondContact O-CA 3.33Å; M1930-H2004 CarbonylContact C-O 3.53Å; M1930-H2004 WeakPolarHBondContact CA-O 3.33Å; M1930-H2004 VanDerWaalsContact CB-O 3.25Å; M1930-H2004 WeakPolarHBondContact CB-O 3.26Å; M1930-H2004 WeakPolarHBondContact CE-O 3.38Å; M1930-H2004 WeakPolarHBondContact CG-O 3.36Å; M1930-V2005 HydrophobicContact CE-CG2 4.21Å; M1930-V2005 HydrophobicContact CG-CG2 4.35Å
1931	G	69	Low	84.6	Confident	7 Å²	7	36.7 Å²	36.7	7%	0.072	18%	0.184	C	C	.	.	S	Bend	trans	127.2	163.3	-171.2	0	0	0	0	0	110.7	R1933 A1934 H2004 E2006	G1931-R1933 PolarHBondContact O-N 3.19Å; G1931-A1934 PolarHBondContact O-N 3.1Å; G1931-H2004 VanDerWaalsContact CA-CE1 3.45Å; G1931-H2004 WeakPolarHBondContact CA-CE1 3.3Å; G1931-E2006 VanDerWaalsContact C-CD 3.46Å; G1931-E2006 WeakPolarHBondContact CA-OE1 3.39Å; G1931-E2006 VanDerWaalsContact CA-OE2 3.27Å; G1931-E2006 WeakPolarHBondContact CA-OE2 3.41Å; G1931-E2006 VanDerWaalsContact N-CD 3.34Å; G1931-E2006 PolarHBondContact N-OE2 2.98Å; G1931-E2006 VanDerWaalsContact N-OE2 3.1Å
1932	P	67.8	Low	84.8	Confident	111.4 Å²	111.4	37.8 Å²	37.8	72%	0.723	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-17.2	-164.2	-7.9	8.4	0	0	0	115.8	K1607 E2006	K1607-P1932 HydrophobicContact CD-CB 4.05Å; K1607-P1932 HydrophobicContact CD-CG 4.06Å; P1932-E2006 VanDerWaalsContact CD-OE1 3.25Å; P1932-E2006 WeakPolarHBondContact CD-OE1 3.15Å; P1932-E2006 WeakPolarHBondContact CG-OE1 3.22Å
1933	R	76.7	Confident	84.5	Confident	135 Å²	135	42.6 Å²	42.6	51%	0.509	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121.2	0.9	179	-68	166.4	73.4	130.4	-5.6	113	I1608 G1931 I1952 D1953	I1608-R1933 PolarHBondContact O-NH1 2.69Å; G1931-R1933 PolarHBondContact O-N 3.19Å; R1933-I1952 CarbonylContact O-C 3.54Å; R1933-I1952 VanDerWaalsContact O-CA 3.31Å; R1933-I1952 WeakPolarHBondContact O-CA 3.35Å; R1933-D1953 VanDerWaalsContact CB-OD1 3.28Å; R1933-D1953 WeakPolarHBondContact CB-OD1 3.35Å; R1933-D1953 IonicContact CZ-OD1 3.12Å; R1933-D1953 IonicContact CZ-OD2 3.21Å; R1933-D1953 VanDerWaalsContact NE-CG 3.29Å; R1933-D1953 IonicContact NE-OD1 2.98Å; R1933-D1953 PolarHBondContact NE-OD1 3Å; R1933-D1953 IonicContact NE-OD2 3.2Å; R1933-D1953 PolarHBondContact NE-OD2 3.28Å; R1933-D1953 VanDerWaalsContact NH2-CG 3.26Å; R1933-D1953 IonicContact NH2-OD1 3.22Å; R1933-D1953 PolarHBondContact NH2-OD1 2.93Å; R1933-D1953 IonicContact NH2-OD2 3.16Å; R1933-D1953 PolarHBondContact NH2-OD2 3.05Å; R1933-D1953 PolarHBondContact O-N 3.24Å
1934	A	81.3	Confident	84	Confident	10 Å²	10	44.8 Å²	44.8	8%	0.083	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	130.4	-168	0	0	0	0	0	111.9	M1930 G1931 I1951 P2001	M1930-A1934 HydrophobicContact CB-CB 4.22Å; M1930-A1934 PolarHBondContact N-O 2.99Å; G1931-A1934 PolarHBondContact O-N 3.1Å; A1934-I1951 CarbonylContact C-O 3.58Å; A1934-I1951 WeakPolarHBondContact CA-O 3.43Å; A1934-P2001 HydrophobicContact CB-CB 4.11Å; A1934-P2001 VanDerWaalsContact CB-O 3.27Å; A1934-P2001 WeakPolarHBondContact CB-O 3.41Å
1935	T	86.7	Confident	83.7	Confident	19.2 Å²	19.2	47.2 Å²	47.2	12%	0.118	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	129.8	177.4	-66.4	0	0	0	0	112.2	D1927 V1928 K1929 R1937 I1951	D1927-T1935 HydrophobicContact CB-CG2 3.88Å; D1927-T1935 WeakPolarHBondContact OD2-CG2 3.3Å; V1928-T1935 CarbonylContact O-C 3.54Å; V1928-T1935 WeakPolarHBondContact O-CA 3.32Å; K1929-T1935 HydrophobicContact CD-CG2 3.88Å; K1929-T1935 WeakPolarHBondContact CD-OG1 3.2Å; K1929-T1935 HydrophobicContact CG-CG2 4.39Å; T1935-R1937 HydrophobicContact CG2-CB 4.47Å; T1935-I1951 PolarHBondContact N-O 3.07Å; T1935-I1951 WeakPolarHBondContact O-CA 3.25Å; T1935-I1951 WeakPolarHBondContact O-CB 3.33Å; T1935-I1951 PolarHBondContact O-N 2.98Å
1936	L	90	Very high	83.6	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	104.7	168.1	-179.3	76.5	0	0	0	108.7	V1928 M1930 L1948 F1978 V1985 F1998 P2001	V1928-L1936 HydrophobicContact CB-CB 4.29Å; V1928-L1936 PolarHBondContact N-O 3.17Å; V1928-L1936 PolarHBondContact O-N 3.2Å; M1930-L1936 HydrophobicContact CE-CB 4.02Å; M1930-L1936 HydrophobicContact CE-CD2 4.02Å; M1930-L1936 HydrophobicContact SD-CB 4.2Å; L1936-L1948 HydrophobicContact CD1-CD1 3.87Å; L1936-L1948 HydrophobicContact CD1-CD2 4.33Å; L1936-L1948 HydrophobicContact CD1-CG 4Å; L1936-L1948 HydrophobicContact CD2-CD1 4.34Å; L1936-L1948 HydrophobicContact CG-CD1 3.92Å; L1936-L1948 HydrophobicContact CG-CG 4.49Å; L1936-F1978 HydrophobicContact CD2-CD1 3.8Å; L1936-F1978 HydrophobicContact CD2-CE1 4.04Å; L1936-V1985 HydrophobicContact CD1-CG1 3.95Å; L1936-V1985 HydrophobicContact CD2-CB 4.17Å; L1936-V1985 HydrophobicContact CD2-CG1 3.76Å; L1936-V1985 HydrophobicContact CD2-CG2 3.84Å; L1936-V1985 HydrophobicContact CG-CG1 4.49Å; L1936-F1998 HydrophobicContact CD1-CD1 3.88Å; L1936-F1998 HydrophobicContact CD1-CE1 3.85Å; L1936-P2001 HydrophobicContact CB-CG 3.93Å
1937	R	92	Very high	83.5	Confident	65.2 Å²	65.2	47.1 Å²	47.1	25%	0.246	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	124.3	-177.7	169.5	165.6	-64.2	153.4	3.1	111.8	R1925 D1927 T1935 D1939 L1948 S1949 I1951	R1925-R1937 HydrophobicContact CG-CG 4.35Å; D1927-R1937 VanDerWaalsContact CG-NE 3.35Å; D1927-R1937 WeakPolarHBondContact OD1-CA 3.39Å; D1927-R1937 VanDerWaalsContact OD1-CB 3.28Å; D1927-R1937 WeakPolarHBondContact OD1-CB 3.37Å; D1927-R1937 WeakPolarHBondContact OD1-CD 3.32Å; D1927-R1937 VanDerWaalsContact OD1-CG 3.3Å; D1927-R1937 WeakPolarHBondContact OD1-CG 3.38Å; D1927-R1937 IonicContact OD1-CZ 3.51Å; D1927-R1937 IonicContact OD1-NE 2.88Å; D1927-R1937 PolarHBondContact OD1-NE 3.04Å; D1927-R1937 IonicContact OD1-NH2 3.36Å; D1927-R1937 IonicContact OD2-CZ 3.26Å; D1927-R1937 VanDerWaalsContact OD2-CZ 3.31Å; D1927-R1937 IonicContact OD2-NE 3.26Å; D1927-R1937 PolarHBondContact OD2-NE 3.04Å; D1927-R1937 VanDerWaalsContact OD2-NE 3.14Å; D1927-R1937 IonicContact OD2-NH2 2.95Å; D1927-R1937 PolarHBondContact OD2-NH2 2.9Å; T1935-R1937 HydrophobicContact CG2-CB 4.47Å; R1937-D1939 VanDerWaalsContact CD-OD2 3.32Å; R1937-D1939 WeakPolarHBondContact CD-OD2 3.41Å; R1937-L1948 CarbonylContact O-C 3.5Å; R1937-L1948 WeakPolarHBondContact O-CA 3.33Å; R1937-S1949 PolarHBondContact N-O 2.98Å; R1937-S1949 PolarHBondContact O-N 2.84Å; R1937-I1951 HydrophobicContact CB-CD1 3.74Å; R1937-I1951 HydrophobicContact CB-CG1 4.42Å; R1937-I1951 HydrophobicContact CG-CD1 4.43Å; R1937-I1951 VanDerWaalsContact NH1-CD1 3.32Å
1938	L	91.5	Very high	83.5	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	108.8	165.2	176.5	66.3	0	0	0	109.6	R1925 V1926 A1940 W1946 K1947 L1948 F1962 L1976 F1978 L1987	R1925-L1938 CarbonylContact C-O 3.55Å; R1925-L1938 VanDerWaalsContact CA-O 3.25Å; R1925-L1938 WeakPolarHBondContact CA-O 3.41Å; V1926-L1938 HydrophobicContact CB-CB 4.36Å; V1926-L1938 PolarHBondContact N-O 3.17Å; V1926-L1938 PolarHBondContact O-N 2.95Å; L1938-A1940 HydrophobicContact CG-CB 4.41Å; L1938-W1946 HydrophobicContact CD1-CB 4.33Å; L1938-W1946 HydrophobicContact CD1-CE3 4.32Å; L1938-W1946 HydrophobicContact CD2-CE3 4.36Å; L1938-W1946 HydrophobicContact CD2-CZ3 4.39Å; L1938-K1947 CarbonylContact C-O 3.6Å; L1938-K1947 WeakPolarHBondContact CA-O 3.33Å; L1938-L1948 HydrophobicContact CB-CD1 4.1Å; L1938-L1948 HydrophobicContact CD1-CB 4.46Å; L1938-L1948 HydrophobicContact CD1-CD1 4.39Å; L1938-F1962 HydrophobicContact CD1-CE2 4.31Å; L1938-F1962 HydrophobicContact CD1-CZ 3.87Å; L1938-L1976 HydrophobicContact CD2-CD1 4.06Å; L1938-L1976 HydrophobicContact CD2-CD2 4.16Å; L1938-L1976 HydrophobicContact CD2-CG 4.5Å; L1938-F1978 HydrophobicContact CB-CZ 4.4Å; L1938-F1978 HydrophobicContact CD2-CZ 4.28Å; L1938-L1987 HydrophobicContact CD1-CD2 3.82Å; L1938-L1987 HydrophobicContact CD2-CD1 4.45Å; L1938-L1987 HydrophobicContact CD2-CD2 3.69Å; L1938-L1987 HydrophobicContact CG-CD2 4.38Å
1939	D	90.6	Very high	83.6	Confident	37 Å²	37	46.8 Å²	46.8	20%	0.198	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	114	166.1	-66.5	-66.6	0	0	0	109.4	R1925 R1937 W1946 K1947	R1925-D1939 IonicContact CZ-OD1 3.26Å; R1925-D1939 IonicContact NE-OD1 3.09Å; R1925-D1939 PolarHBondContact NE-OD1 2.96Å; R1925-D1939 IonicContact NH2-OD1 3.09Å; R1925-D1939 PolarHBondContact NH2-OD1 3.12Å; R1925-D1939 IonicContact NH2-OD2 2.84Å; R1937-D1939 VanDerWaalsContact CD-OD2 3.32Å; R1937-D1939 WeakPolarHBondContact CD-OD2 3.41Å; D1939-W1946 WeakPolarHBondContact O-CA 3.38Å; D1939-K1947 HydrophobicContact CB-CB 4.29Å; D1939-K1947 PolarHBondContact N-O 2.86Å; D1939-K1947 PolarHBondContact O-N 2.94Å
1940	A	88.2	Confident	83.7	Confident	1.6 Å²	1.6	44.4 Å²	44.4	1%	0.013	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	80.2	-172.5	0	0	0	0	0	111.9	N1923 F1924 L1938 L1942 W1946	N1923-A1940 WeakPolarHBondContact CA-O 3.44Å; F1924-A1940 HydrophobicContact CD1-CB 3.84Å; F1924-A1940 HydrophobicContact CD2-CB 3.92Å; F1924-A1940 HydrophobicContact CE1-CB 3.47Å; F1924-A1940 VanDerWaalsContact CE1-CB 3.48Å; F1924-A1940 HydrophobicContact CE2-CB 3.53Å; F1924-A1940 VanDerWaalsContact CE2-CB 3.48Å; F1924-A1940 HydrophobicContact CG-CB 4.07Å; F1924-A1940 HydrophobicContact CZ-CB 3.3Å; F1924-A1940 PolarHBondContact N-O 3.05Å; F1924-A1940 VanDerWaalsContact N-O 3.11Å; F1924-A1940 CarbonylContact O-C 3.34Å; F1924-A1940 WeakPolarHBondContact O-CA 3.33Å; F1924-A1940 WeakPolarHBondContact O-CB 3.34Å; F1924-A1940 PolarHBondContact O-N 2.9Å; L1938-A1940 HydrophobicContact CG-CB 4.41Å; A1940-L1942 PolarHBondContact O-N 3.16Å; A1940-W1946 HydrophobicContact CB-CD2 3.65Å; A1940-W1946 HydrophobicContact CB-CE3 4.08Å; A1940-W1946 HydrophobicContact CB-CG 3.96Å; A1940-W1946 HydrophobicContact CB-CH2 4.46Å; A1940-W1946 HydrophobicContact CB-CZ2 4.11Å; A1940-W1946 HydrophobicContact CB-CZ3 4.42Å
1941	S	86.1	Confident	83.9	Confident	40 Å²	40	45.3 Å²	45.3	28%	0.28	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	130.9	169.6	176.8	0	0	0	0	110.9	R1943 R1944 W1946	S1941-R1943 VanDerWaalsContact C-N 3.3Å; S1941-R1943 PolarHBondContact O-N 3.05Å; S1941-R1943 PolarHBondContact OG-N 3.2Å; S1941-R1944 PolarHBondContact O-N 2.95Å; S1941-R1944 VanDerWaalsContact O-N 3.11Å; S1941-R1944 PolarHBondContact OG-N 2.84Å; S1941-W1946 PolarHBondContact O-NE1 2.89Å
1942	L	80	Confident	84.3	Confident	37.6 Å²	37.6	46.9 Å²	46.9	20%	0.197	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-17.2	175.5	-61.1	-169.6	0	0	0	112.4	L1917 A1921 Q1922 F1924 A1940 R1944 V1968 L1971	L1917-L1942 HydrophobicContact CD1-CD1 3.81Å; L1917-L1942 HydrophobicContact CD1-CD2 3.89Å; L1917-L1942 HydrophobicContact CD1-CG 4.36Å; A1921-L1942 VanDerWaalsContact C-CD1 3.49Å; A1921-L1942 HydrophobicContact CB-CD1 3.92Å; A1921-L1942 VanDerWaalsContact O-CD1 3.28Å; A1921-L1942 WeakPolarHBondContact O-CD1 3.35Å; Q1922-L1942 WeakPolarHBondContact O-CB 3.29Å; Q1922-L1942 WeakPolarHBondContact O-CG 3.5Å; Q1922-L1942 PolarHBondContact O-N 3.06Å; F1924-L1942 HydrophobicContact CD1-CD2 4.23Å; F1924-L1942 HydrophobicContact CE1-CD2 4.11Å; A1940-L1942 PolarHBondContact O-N 3.16Å; L1942-R1944 VanDerWaalsContact C-N 3.26Å; L1942-R1944 PolarHBondContact O-N 2.98Å; L1942-V1968 HydrophobicContact CD2-CB 4.45Å; L1942-V1968 HydrophobicContact CD2-CG1 4.07Å; L1942-V1968 HydrophobicContact CD2-CG2 4.43Å; L1942-L1971 HydrophobicContact CD1-CD1 4.21Å; L1942-L1971 HydrophobicContact CD1-CD2 4.06Å; L1942-L1971 HydrophobicContact CD2-CD1 4Å
1943	R	76.5	Confident	84.5	Confident	200.6 Å²	200.6	45.6 Å²	45.6	76%	0.757	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-12.1	172.5	-59.3	-171.6	-175.6	-156.4	2.1	113.3	S1941	S1941-R1943 VanDerWaalsContact C-N 3.3Å; S1941-R1943 PolarHBondContact O-N 3.05Å; S1941-R1943 PolarHBondContact OG-N 3.2Å
1944	R	75.2	Confident	84.1	Confident	119.6 Å²	119.6	42.3 Å²	42.3	45%	0.451	22%	0.216	S	C	.	.	S	Bend	trans	70.3	161.4	-174.4	-56.9	173.8	172.3	-179.1	-4.3	112.1	S1941 L1942 P1964 V1966	S1941-R1944 PolarHBondContact O-N 2.95Å; S1941-R1944 VanDerWaalsContact O-N 3.11Å; S1941-R1944 PolarHBondContact OG-N 2.84Å; L1942-R1944 VanDerWaalsContact C-N 3.26Å; L1942-R1944 PolarHBondContact O-N 2.98Å; R1944-P1964 PolarHBondContact NH2-O 2.78Å; R1944-P1964 VanDerWaalsContact NH2-O 3.11Å; R1944-V1966 PolarHBondContact NH2-O 2.85Å
1945	P	82.3	Confident	83.7	Confident	51.2 Å²	51.2	47.4 Å²	47.4	33%	0.332	24%	0.242	S	C	.	.			cis	-65.6	170	-10.7	21.7	-22.9	0	0	0	112.4	Q1961 F1962 K1963	P1945-Q1961 HydrophobicContact CB-CB 4.43Å; P1945-Q1961 HydrophobicContact CG-CB 4.43Å; P1945-F1962 WeakPolarHBondContact CB-O 3.41Å; P1945-K1963 HydrophobicContact CB-CG 4.31Å
1946	W	88	Confident	83	Confident	6.2 Å²	6.2	48.9 Å²	48.9	2%	0.023	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	146.9	165.6	-68.7	7.4	0	0	0	108.9	F1924 L1938 D1939 A1940 S1941 Q1961 F1962 P1964 I1974 L1976 V1989 I1994	F1924-W1946 HydrophobicContact CE1-CH2 4.21Å; F1924-W1946 AromaticContact CE1-CZ2 3.92Å; F1924-W1946 HydrophobicContact CE1-CZ2 3.96Å; F1924-W1946 AromaticContact CZ-CH2 3.77Å; F1924-W1946 HydrophobicContact CZ-CH2 3.77Å; F1924-W1946 AromaticContact CZ-CZ2 3.95Å; F1924-W1946 HydrophobicContact CZ-CZ2 3.95Å; F1924-W1946 HydrophobicContact CZ-CZ3 4.28Å; L1938-W1946 HydrophobicContact CD1-CB 4.33Å; L1938-W1946 HydrophobicContact CD1-CE3 4.32Å; L1938-W1946 HydrophobicContact CD2-CE3 4.36Å; L1938-W1946 HydrophobicContact CD2-CZ3 4.39Å; D1939-W1946 WeakPolarHBondContact O-CA 3.38Å; A1940-W1946 HydrophobicContact CB-CD2 3.65Å; A1940-W1946 HydrophobicContact CB-CE3 4.08Å; A1940-W1946 HydrophobicContact CB-CG 3.96Å; A1940-W1946 HydrophobicContact CB-CH2 4.46Å; A1940-W1946 HydrophobicContact CB-CZ2 4.11Å; A1940-W1946 HydrophobicContact CB-CZ3 4.42Å; S1941-W1946 PolarHBondContact O-NE1 2.89Å; W1946-Q1961 CarbonylContact O-C 3.55Å; W1946-Q1961 VanDerWaalsContact O-CA 3.29Å; W1946-Q1961 WeakPolarHBondContact O-CA 3.34Å; W1946-F1962 HydrophobicContact CB-CD2 4.01Å; W1946-F1962 HydrophobicContact CB-CE2 3.63Å; W1946-F1962 HydrophobicContact CB-CZ 4.3Å; W1946-F1962 HydrophobicContact CE3-CE2 4.15Å; W1946-F1962 HydrophobicContact CG-CE2 4.46Å; W1946-F1962 PolarHBondContact N-O 2.97Å; W1946-F1962 PolarHBondContact O-N 2.83Å; W1946-P1964 HydrophobicContact CB-CG 4.48Å; W1946-P1964 HydrophobicContact CD2-CB 4.36Å; W1946-P1964 HydrophobicContact CD2-CG 3.77Å; W1946-P1964 HydrophobicContact CE3-CB 4.44Å; W1946-P1964 HydrophobicContact CE3-CG 4.22Å; W1946-P1964 HydrophobicContact CG-CG 4.03Å; W1946-P1964 HydrophobicContact CH2-CG 4.49Å; W1946-P1964 HydrophobicContact CZ2-CG 4.21Å; W1946-I1974 HydrophobicContact CH2-CD1 4.2Å; W1946-I1974 HydrophobicContact CH2-CG2 4.3Å; W1946-I1974 HydrophobicContact CZ2-CD1 4.3Å; W1946-L1976 HydrophobicContact CH2-CD2 4.25Å; W1946-L1976 HydrophobicContact CZ3-CD2 3.77Å; W1946-V1989 HydrophobicContact CH2-CG2 4.35Å; W1946-V1989 HydrophobicContact CZ3-CG2 3.93Å; W1946-I1994 HydrophobicContact CE3-CD1 4.01Å; W1946-I1994 HydrophobicContact CZ3-CD1 4.04Å
1947	K	88.4	Confident	81.9	Confident	77.2 Å²	77.2	54.1 Å²	54.1	34%	0.336	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	115.3	-175.3	-177.3	-158.3	-179.5	-161.4	0	109.2	L1938 D1939 S1949 V1959 T1960 Q1961	L1938-K1947 CarbonylContact C-O 3.6Å; L1938-K1947 WeakPolarHBondContact CA-O 3.33Å; D1939-K1947 HydrophobicContact CB-CB 4.29Å; D1939-K1947 PolarHBondContact N-O 2.86Å; D1939-K1947 PolarHBondContact O-N 2.94Å; K1947-S1949 WeakPolarHBondContact CD-OG 3.44Å; K1947-S1949 VanDerWaalsContact CE-OG 3.27Å; K1947-S1949 WeakPolarHBondContact CE-OG 3.25Å; K1947-S1949 PolarHBondContact NZ-OG 3.13Å; K1947-V1959 HydrophobicContact CD-CG1 4.14Å; K1947-V1959 VanDerWaalsContact CE-CG1 3.43Å; K1947-V1959 VanDerWaalsContact CE-CG2 3.48Å; K1947-V1959 HydrophobicContact CG-CG1 3.59Å; K1947-T1960 WeakPolarHBondContact CA-O 3.19Å; K1947-Q1961 HydrophobicContact CB-CG 4.38Å; K1947-Q1961 HydrophobicContact CG-CG 4.34Å
1948	L	89.8	Confident	81	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	126.6	168.7	-172	69.5	0	0	0	108.3	L1936 R1937 L1938 V1959 T1960 F1962 F1978 V1985 F1998	L1936-L1948 HydrophobicContact CD1-CD1 3.87Å; L1936-L1948 HydrophobicContact CD1-CD2 4.33Å; L1936-L1948 HydrophobicContact CD1-CG 4Å; L1936-L1948 HydrophobicContact CD2-CD1 4.34Å; L1936-L1948 HydrophobicContact CG-CD1 3.92Å; L1936-L1948 HydrophobicContact CG-CG 4.49Å; R1937-L1948 CarbonylContact O-C 3.5Å; R1937-L1948 WeakPolarHBondContact O-CA 3.33Å; L1938-L1948 HydrophobicContact CB-CD1 4.1Å; L1938-L1948 HydrophobicContact CD1-CB 4.46Å; L1938-L1948 HydrophobicContact CD1-CD1 4.39Å; L1948-V1959 CarbonylContact O-C 3.6Å; L1948-V1959 WeakPolarHBondContact O-CA 3.36Å; L1948-T1960 HydrophobicContact CB-CG2 3.86Å; L1948-T1960 HydrophobicContact CD2-CG2 4.38Å; L1948-T1960 PolarHBondContact N-O 3.12Å; L1948-T1960 PolarHBondContact O-N 2.89Å; L1948-F1962 HydrophobicContact CB-CE1 3.72Å; L1948-F1962 HydrophobicContact CB-CZ 4.09Å; L1948-F1978 HydrophobicContact CD1-CE1 4.23Å; L1948-V1985 HydrophobicContact CD2-CG1 4.4Å; L1948-F1998 HydrophobicContact CD2-CB 4.13Å; L1948-F1998 HydrophobicContact CD2-CD1 3.78Å; L1948-F1998 HydrophobicContact CD2-CD2 4.49Å; L1948-F1998 HydrophobicContact CD2-CE1 4.33Å; L1948-F1998 HydrophobicContact CD2-CG 3.97Å; L1948-F1998 HydrophobicContact CG-CD1 4.14Å; L1948-F1998 HydrophobicContact CG-CE1 4.19Å; L1948-F1998 HydrophobicContact CG-CG 4.45Å
1949	S	88.8	Confident	80.4	Confident	2.4 Å²	2.4	58.9 Å²	58.9	2%	0.017	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	132.6	-174.1	-43.9	0	0	0	0	110.5	R1937 K1947 I1951 K1958	R1937-S1949 PolarHBondContact N-O 2.98Å; R1937-S1949 PolarHBondContact O-N 2.84Å; K1947-S1949 WeakPolarHBondContact CD-OG 3.44Å; K1947-S1949 VanDerWaalsContact CE-OG 3.27Å; K1947-S1949 WeakPolarHBondContact CE-OG 3.25Å; K1947-S1949 PolarHBondContact NZ-OG 3.13Å; S1949-I1951 PolarHBondContact O-N 2.72Å; S1949-K1958 CarbonylContact C-O 3.47Å; S1949-K1958 VanDerWaalsContact CA-O 3.3Å; S1949-K1958 WeakPolarHBondContact CA-O 3.39Å
1950	Q	87.6	Confident	79.9	Confident	9.2 Å²	9.2	59 Å²	59	4%	0.043	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	117.6	163.7	-171	-168.7	-28.2	0	0	106.9	I1952 G1956 E1957 K1958 F1998 P2001	Q1950-I1952 HydrophobicContact CG-CG1 4.41Å; Q1950-I1952 VanDerWaalsContact NE2-CD1 3.3Å; Q1950-G1956 CarbonylContact O-C 3.51Å; Q1950-G1956 VanDerWaalsContact O-C 3.29Å; Q1950-G1956 WeakPolarHBondContact O-CA 3.37Å; Q1950-E1957 PolarHBondContact NE2-OE2 3.15Å; Q1950-E1957 PolarHBondContact O-N 3.13Å; Q1950-E1957 VanDerWaalsContact O-N 3.12Å; Q1950-K1958 HydrophobicContact CB-CB 3.99Å; Q1950-K1958 PolarHBondContact N-O 3Å; Q1950-K1958 VanDerWaalsContact OE1-CD 3.26Å; Q1950-F1998 HydrophobicContact CB-CE1 3.97Å; Q1950-F1998 HydrophobicContact CB-CZ 4.06Å; Q1950-P2001 HydrophobicContact CG-CB 3.66Å; Q1950-P2001 HydrophobicContact CG-CG 4.27Å
1951	I	84.5	Confident	79.6	Confident	20.6 Å²	20.6	65 Å²	65	11%	0.106	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	121.6	174	-56.4	176.4	0	0	0	107.5	A1934 T1935 R1937 S1949 N1955	A1934-I1951 CarbonylContact C-O 3.58Å; A1934-I1951 WeakPolarHBondContact CA-O 3.43Å; T1935-I1951 PolarHBondContact N-O 3.07Å; T1935-I1951 WeakPolarHBondContact O-CA 3.25Å; T1935-I1951 WeakPolarHBondContact O-CB 3.33Å; T1935-I1951 PolarHBondContact O-N 2.98Å; R1937-I1951 HydrophobicContact CB-CD1 3.74Å; R1937-I1951 HydrophobicContact CB-CG1 4.42Å; R1937-I1951 HydrophobicContact CG-CD1 4.43Å; R1937-I1951 VanDerWaalsContact NH1-CD1 3.32Å; S1949-I1951 PolarHBondContact O-N 2.72Å; I1951-N1955 CarbonylContact C-O 3.23Å; I1951-N1955 VanDerWaalsContact CA-O 3.3Å; I1951-N1955 WeakPolarHBondContact CA-O 3.38Å
1952	I	78	Confident	79.2	Confident	41.2 Å²	41.2	64.1 Å²	64.1	21%	0.211	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	133.4	169.5	-65.5	-171.4	0	0	0	106.9	R1933 Q1950 G1954 N1955 E1957 P2001	R1933-I1952 CarbonylContact O-C 3.54Å; R1933-I1952 VanDerWaalsContact O-CA 3.31Å; R1933-I1952 WeakPolarHBondContact O-CA 3.35Å; Q1950-I1952 HydrophobicContact CG-CG1 4.41Å; Q1950-I1952 VanDerWaalsContact NE2-CD1 3.3Å; I1952-G1954 PolarHBondContact O-N 3.11Å; I1952-G1954 VanDerWaalsContact O-N 3.12Å; I1952-N1955 PolarHBondContact N-O 2.93Å; I1952-N1955 WeakPolarHBondContact O-CA 3.33Å; I1952-N1955 WeakPolarHBondContact O-CB 3.47Å; I1952-N1955 PolarHBondContact O-N 3.11Å; I1952-E1957 HydrophobicContact CB-CG 4.29Å; I1952-E1957 VanDerWaalsContact CD1-OE2 3.28Å; I1952-E1957 WeakPolarHBondContact CD1-OE2 3.23Å; I1952-E1957 WeakPolarHBondContact CG1-OE2 3.31Å; I1952-P2001 HydrophobicContact CD1-CB 4.31Å; I1952-P2001 HydrophobicContact CG1-CB 4Å
1953	D	72.4	Confident	78.8	Confident	82.8 Å²	82.8	70.2 Å²	70.2	44%	0.443	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.6	26.1	179.3	-60.3	-2.5	0	0	0	113.8	R1933 N1955	R1933-D1953 VanDerWaalsContact CB-OD1 3.28Å; R1933-D1953 WeakPolarHBondContact CB-OD1 3.35Å; R1933-D1953 IonicContact CZ-OD1 3.12Å; R1933-D1953 IonicContact CZ-OD2 3.21Å; R1933-D1953 VanDerWaalsContact NE-CG 3.29Å; R1933-D1953 IonicContact NE-OD1 2.98Å; R1933-D1953 PolarHBondContact NE-OD1 3Å; R1933-D1953 IonicContact NE-OD2 3.2Å; R1933-D1953 PolarHBondContact NE-OD2 3.28Å; R1933-D1953 VanDerWaalsContact NH2-CG 3.26Å; R1933-D1953 IonicContact NH2-OD1 3.22Å; R1933-D1953 PolarHBondContact NH2-OD1 2.93Å; R1933-D1953 IonicContact NH2-OD2 3.16Å; R1933-D1953 PolarHBondContact NH2-OD2 3.05Å; R1933-D1953 PolarHBondContact O-N 3.24Å; D1953-N1955 VanDerWaalsContact C-N 3.29Å; D1953-N1955 PolarHBondContact O-N 3.26Å; D1953-N1955 VanDerWaalsContact O-N 3.07Å
1954	G	68.1	Low	78.2	Confident	65.8 Å²	65.8	61 Å²	61	68%	0.678	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.3	-18.4	-171.3	0	0	0	0	0	114.4	I1952	I1952-G1954 PolarHBondContact O-N 3.11Å; I1952-G1954 VanDerWaalsContact O-N 3.12Å
1955	N	72.2	Confident	77.6	Confident	119 Å²	119	62.5 Å²	62.5	64%	0.636	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.1	136.3	177.9	-72.9	-35.2	0	0	0	112	I1951 I1952 D1953 E1957	I1951-N1955 CarbonylContact C-O 3.23Å; I1951-N1955 VanDerWaalsContact CA-O 3.3Å; I1951-N1955 WeakPolarHBondContact CA-O 3.38Å; I1952-N1955 PolarHBondContact N-O 2.93Å; I1952-N1955 WeakPolarHBondContact O-CA 3.33Å; I1952-N1955 WeakPolarHBondContact O-CB 3.47Å; I1952-N1955 PolarHBondContact O-N 3.11Å; D1953-N1955 VanDerWaalsContact C-N 3.29Å; D1953-N1955 PolarHBondContact O-N 3.26Å; D1953-N1955 VanDerWaalsContact O-N 3.07Å; N1955-E1957 PolarHBondContact O-N 2.91Å; N1955-E1957 VanDerWaalsContact O-N 3.13Å
1956	G	72	Confident	76.4	Confident	49.8 Å²	49.8	61.5 Å²	61.5	51%	0.513	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	72.1	-179.9	0	0	0	0	0	113.2	Q1950 K1958	Q1950-G1956 CarbonylContact O-C 3.51Å; Q1950-G1956 VanDerWaalsContact O-C 3.29Å; Q1950-G1956 WeakPolarHBondContact O-CA 3.37Å; G1956-K1958 VanDerWaalsContact C-N 3.31Å; G1956-K1958 PolarHBondContact O-N 3.14Å; G1956-K1958 VanDerWaalsContact O-N 3.13Å
1957	E	67.8	Low	74.9	Confident	109.8 Å²	109.8	71.4 Å²	71.4	51%	0.513	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.1	-44.9	-174.1	-68.7	-167	158.7	0	0	114.9	Q1950 I1952 N1955	Q1950-E1957 PolarHBondContact NE2-OE2 3.15Å; Q1950-E1957 PolarHBondContact O-N 3.13Å; Q1950-E1957 VanDerWaalsContact O-N 3.12Å; I1952-E1957 HydrophobicContact CB-CG 4.29Å; I1952-E1957 VanDerWaalsContact CD1-OE2 3.28Å; I1952-E1957 WeakPolarHBondContact CD1-OE2 3.23Å; I1952-E1957 WeakPolarHBondContact CG1-OE2 3.31Å; N1955-E1957 PolarHBondContact O-N 2.91Å; N1955-E1957 VanDerWaalsContact O-N 3.13Å
1958	K	73.5	Confident	73	Confident	97.4 Å²	97.4	70.8 Å²	70.8	42%	0.423	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	140.9	-176.1	-62.6	-173.8	-172.1	130.1	0	110.4	S1949 Q1950 G1956 F1998 P1999	S1949-K1958 CarbonylContact C-O 3.47Å; S1949-K1958 VanDerWaalsContact CA-O 3.3Å; S1949-K1958 WeakPolarHBondContact CA-O 3.39Å; Q1950-K1958 HydrophobicContact CB-CB 3.99Å; Q1950-K1958 PolarHBondContact N-O 3Å; Q1950-K1958 VanDerWaalsContact OE1-CD 3.26Å; G1956-K1958 VanDerWaalsContact C-N 3.31Å; G1956-K1958 PolarHBondContact O-N 3.14Å; G1956-K1958 VanDerWaalsContact O-N 3.13Å; K1958-F1998 HydrophobicContact CB-CE1 3.67Å; K1958-F1998 HydrophobicContact CB-CE2 4.14Å; K1958-F1998 HydrophobicContact CB-CZ 3.85Å; K1958-P1999 HydrophobicContact CD-CG 4.12Å
1959	V	78	Confident	71	Confident	67.6 Å²	67.6	76.8 Å²	76.8	41%	0.41	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	133.3	179.9	174	0	0	0	0	109.2	K1947 L1948 Q1961	K1947-V1959 HydrophobicContact CD-CG1 4.14Å; K1947-V1959 VanDerWaalsContact CE-CG1 3.43Å; K1947-V1959 VanDerWaalsContact CE-CG2 3.48Å; K1947-V1959 HydrophobicContact CG-CG1 3.59Å; L1948-V1959 CarbonylContact O-C 3.6Å; L1948-V1959 WeakPolarHBondContact O-CA 3.36Å; V1959-Q1961 HydrophobicContact CG1-CG 4.41Å
1960	T	79.8	Confident	69.2	Low	38.4 Å²	38.4	81.7 Å²	81.7	24%	0.236	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	129.6	164.6	-103.6	0	0	0	0	109.6	K1947 L1948 F1962 F1998	K1947-T1960 WeakPolarHBondContact CA-O 3.19Å; L1948-T1960 HydrophobicContact CB-CG2 3.86Å; L1948-T1960 HydrophobicContact CD2-CG2 4.38Å; L1948-T1960 PolarHBondContact N-O 3.12Å; L1948-T1960 PolarHBondContact O-N 2.89Å; T1960-F1962 HydrophobicContact CG2-CD1 4.22Å; T1960-F1962 HydrophobicContact CG2-CE1 4.15Å; T1960-F1998 HydrophobicContact CG2-CD2 3.62Å; T1960-F1998 VanDerWaalsContact CG2-CD2 3.46Å; T1960-F1998 HydrophobicContact CG2-CE2 3.6Å; T1960-F1998 HydrophobicContact CG2-CG 4.25Å; T1960-F1998 HydrophobicContact CG2-CZ 4.19Å; T1960-F1998 WeakPolarHBondContact OG1-CD2 3.36Å; T1960-F1998 VanDerWaalsContact OG1-CE2 3.31Å; T1960-F1998 WeakPolarHBondContact OG1-CE2 3.38Å
1961	Q	81.6	Confident	67.7	Low	127.6 Å²	127.6	83 Å²	83	60%	0.596	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.6	142.9	171.5	-64.1	-172.7	15.9	0	0	110.5	P1945 W1946 K1947 V1959	P1945-Q1961 HydrophobicContact CB-CB 4.43Å; P1945-Q1961 HydrophobicContact CG-CB 4.43Å; W1946-Q1961 CarbonylContact O-C 3.55Å; W1946-Q1961 VanDerWaalsContact O-CA 3.29Å; W1946-Q1961 WeakPolarHBondContact O-CA 3.34Å; K1947-Q1961 HydrophobicContact CB-CG 4.38Å; K1947-Q1961 HydrophobicContact CG-CG 4.34Å; V1959-Q1961 HydrophobicContact CG1-CG 4.41Å
1962	F	78	Confident	66.7	Low	21.4 Å²	21.4	90.6 Å²	90.6	9%	0.094	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	148.7	174	42.6	-95.1	0	0	0	111.2	L1938 P1945 W1946 L1948 T1960 P1964 L1987 I1994	L1938-F1962 HydrophobicContact CD1-CE2 4.31Å; L1938-F1962 HydrophobicContact CD1-CZ 3.87Å; P1945-F1962 WeakPolarHBondContact CB-O 3.41Å; W1946-F1962 HydrophobicContact CB-CD2 4.01Å; W1946-F1962 HydrophobicContact CB-CE2 3.63Å; W1946-F1962 HydrophobicContact CB-CZ 4.3Å; W1946-F1962 HydrophobicContact CE3-CE2 4.15Å; W1946-F1962 HydrophobicContact CG-CE2 4.46Å; W1946-F1962 PolarHBondContact N-O 2.97Å; W1946-F1962 PolarHBondContact O-N 2.83Å; L1948-F1962 HydrophobicContact CB-CE1 3.72Å; L1948-F1962 HydrophobicContact CB-CZ 4.09Å; T1960-F1962 HydrophobicContact CG2-CD1 4.22Å; T1960-F1962 HydrophobicContact CG2-CE1 4.15Å; F1962-P1964 VanDerWaalsContact O-CD 3.28Å; F1962-P1964 WeakPolarHBondContact O-CD 3.32Å; F1962-L1987 HydrophobicContact CE2-CD2 4.03Å; F1962-L1987 HydrophobicContact CZ-CD2 3.71Å; F1962-I1994 WeakPolarHBondContact CB-O 3.33Å; F1962-I1994 HydrophobicContact CD2-CB 4.42Å; F1962-I1994 HydrophobicContact CD2-CD1 3.99Å; F1962-I1994 HydrophobicContact CD2-CG1 4.22Å; F1962-I1994 HydrophobicContact CE2-CD1 3.61Å; F1962-I1994 VanDerWaalsContact CE2-CD1 3.48Å; F1962-I1994 HydrophobicContact CE2-CG1 4.08Å; F1962-I1994 WeakPolarHBondContact CG-O 3.36Å; F1962-I1994 HydrophobicContact CZ-CD1 4.4Å
1963	K	71.5	Confident	66.4	Low	166 Å²	166	94.7 Å²	94.7	72%	0.722	49%	0.489	S	S	*	.			trans	-97.1	100.6	172.8	-81.8	177	-178.5	176.5	0	107.6	P1945 N1965	P1945-K1963 HydrophobicContact CB-CG 4.31Å; K1963-N1965 PolarHBondContact O-N 2.89Å; K1963-N1965 VanDerWaalsContact O-N 3.13Å
1964	P	65.4	Low	66.7	Low	8.6 Å²	8.6	91 Å²	91	6%	0.056	47%	0.469	C	S	.	.			trans	-63.5	121.7	-179.5	26.2	-34.5	0	0	0	109.8	R1944 W1946 F1962 V1966 I1994	R1944-P1964 PolarHBondContact NH2-O 2.78Å; R1944-P1964 VanDerWaalsContact NH2-O 3.11Å; W1946-P1964 HydrophobicContact CB-CG 4.48Å; W1946-P1964 HydrophobicContact CD2-CB 4.36Å; W1946-P1964 HydrophobicContact CD2-CG 3.77Å; W1946-P1964 HydrophobicContact CE3-CB 4.44Å; W1946-P1964 HydrophobicContact CE3-CG 4.22Å; W1946-P1964 HydrophobicContact CG-CG 4.03Å; W1946-P1964 HydrophobicContact CH2-CG 4.49Å; W1946-P1964 HydrophobicContact CZ2-CG 4.21Å; F1962-P1964 VanDerWaalsContact O-CD 3.28Å; F1962-P1964 WeakPolarHBondContact O-CD 3.32Å; P1964-V1966 HydrophobicContact CB-CG2 4.31Å; P1964-V1966 PolarHBondContact O-N 2.95Å; P1964-I1994 HydrophobicContact CB-CB 4.45Å; P1964-I1994 HydrophobicContact CB-CD1 3.98Å; P1964-I1994 HydrophobicContact CB-CG2 4.32Å
1965	N	61.8	Low	67.5	Low	150.8 Å²	150.8	93.4 Å²	93.4	81%	0.806	46%	0.457	S	S	*	.			trans	-78.1	44.5	-179.3	-141.8	1.4	0	0	0	112.4	K1963	K1963-N1965 PolarHBondContact O-N 2.89Å; K1963-N1965 VanDerWaalsContact O-N 3.13Å
1966	V	57.7	Low	68.2	Low	29.6 Å²	29.6	87.7 Å²	87.7	18%	0.179	43%	0.427	C	S	.	.			trans	-107.4	119.6	178.9	-178.7	0	0	0	0	107.3	R1944 P1964 V1968 N1970 L1971 V1989 K1990	R1944-V1966 PolarHBondContact NH2-O 2.85Å; P1964-V1966 HydrophobicContact CB-CG2 4.31Å; P1964-V1966 PolarHBondContact O-N 2.95Å; V1966-V1968 HydrophobicContact CG1-CG2 4.35Å; V1966-V1968 WeakPolarHBondContact O-CG2 3.25Å; V1966-V1968 PolarHBondContact O-N 2.99Å; V1966-V1968 VanDerWaalsContact O-N 3.12Å; V1966-N1970 HydrophobicContact CG1-CB 4.26Å; V1966-L1971 HydrophobicContact CB-CD2 4.19Å; V1966-L1971 HydrophobicContact CG1-CD2 3.64Å; V1966-L1971 HydrophobicContact CG1-CG 4.47Å; V1966-V1989 HydrophobicContact CB-CG1 4.37Å; V1966-V1989 HydrophobicContact CG1-CG1 4.21Å; V1966-V1989 HydrophobicContact CG2-CB 4.39Å; V1966-V1989 HydrophobicContact CG2-CG1 4.01Å; V1966-K1990 HydrophobicContact CG1-CD 4.1Å
1967	R	55.8	Low	69	Low	214.4 Å²	214.4	85.9 Å²	85.9	81%	0.809	41%	0.406	S	S	*	.			trans	-61.8	120.7	170.2	-70.8	-176	177.8	178.4	-0.7	108.4	T1969 N1970	R1967-T1969 VanDerWaalsContact C-N 3.28Å; R1967-T1969 HydrophobicContact CB-CG2 4.03Å; R1967-T1969 PolarHBondContact O-N 3.02Å; R1967-T1969 VanDerWaalsContact O-N 3.15Å; R1967-T1969 PolarHBondContact O-OG1 2.98Å; R1967-N1970 VanDerWaalsContact O-CB 3.24Å; R1967-N1970 WeakPolarHBondContact O-CB 3.01Å; R1967-N1970 PolarHBondContact O-N 2.85Å
1968	V	49.6	Very low	70	Confident	65.2 Å²	65.2	80.6 Å²	80.6	40%	0.395	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-71.7	2.1	-172.8	-175.7	0	0	0	0	112	L1942 V1966 N1970 L1971 I1974	L1942-V1968 HydrophobicContact CD2-CB 4.45Å; L1942-V1968 HydrophobicContact CD2-CG1 4.07Å; L1942-V1968 HydrophobicContact CD2-CG2 4.43Å; V1966-V1968 HydrophobicContact CG1-CG2 4.35Å; V1966-V1968 WeakPolarHBondContact O-CG2 3.25Å; V1966-V1968 PolarHBondContact O-N 2.99Å; V1966-V1968 VanDerWaalsContact O-N 3.12Å; V1968-N1970 VanDerWaalsContact C-N 3.25Å; V1968-N1970 PolarHBondContact O-N 3.04Å; V1968-N1970 VanDerWaalsContact O-N 3.1Å; V1968-L1971 HydrophobicContact CB-CD1 4.32Å; V1968-L1971 HydrophobicContact CG1-CD1 4.03Å; V1968-L1971 HydrophobicContact CG1-CD2 4.4Å; V1968-L1971 HydrophobicContact CG2-CD1 4.38Å; V1968-L1971 WeakPolarHBondContact O-CB 3.08Å; V1968-L1971 VanDerWaalsContact O-CG 3.32Å; V1968-L1971 WeakPolarHBondContact O-CG 3.31Å; V1968-L1971 PolarHBondContact O-N 2.75Å; V1968-L1971 VanDerWaalsContact O-N 3.14Å; V1968-I1974 HydrophobicContact CG1-CD1 3.81Å; V1968-I1974 HydrophobicContact CG1-CG1 4.25Å
1969	T	47	Very low	70.7	Confident	125 Å²	125	78.2 Å²	78.2	77%	0.767	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-65.2	-8.1	-177.8	47.4	0	0	0	0	114.6	R1967	R1967-T1969 VanDerWaalsContact C-N 3.28Å; R1967-T1969 HydrophobicContact CB-CG2 4.03Å; R1967-T1969 PolarHBondContact O-N 3.02Å; R1967-T1969 VanDerWaalsContact O-N 3.15Å; R1967-T1969 PolarHBondContact O-OG1 2.98Å
1970	N	50.9	Low	71	Confident	105.4 Å²	105.4	75.1 Å²	75.1	56%	0.564	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-122.2	43.3	179.6	-112.5	-48.8	0	0	0	112.4	V1966 R1967 V1968 R1972 K1973 K1990	V1966-N1970 HydrophobicContact CG1-CB 4.26Å; R1967-N1970 VanDerWaalsContact O-CB 3.24Å; R1967-N1970 WeakPolarHBondContact O-CB 3.01Å; R1967-N1970 PolarHBondContact O-N 2.85Å; V1968-N1970 VanDerWaalsContact C-N 3.25Å; V1968-N1970 PolarHBondContact O-N 3.04Å; V1968-N1970 VanDerWaalsContact O-N 3.1Å; N1970-R1972 VanDerWaalsContact C-N 3.33Å; N1970-R1972 PolarHBondContact O-N 2.95Å; N1970-K1973 PolarHBondContact O-N 3.33Å; N1970-K1990 PolarHBondContact O-NZ 2.94Å; N1970-K1990 PolarHBondContact OD1-NZ 2.93Å
1971	L	55.9	Low	70.7	Confident	36.4 Å²	36.4	76.9 Å²	76.9	19%	0.191	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-4.4	-176	-65.5	176.3	0	0	0	115.1	L1917 L1942 V1966 V1968 K1973 I1974	L1917-L1971 HydrophobicContact CB-CD2 4.48Å; L1917-L1971 HydrophobicContact CD1-CB 4.34Å; L1917-L1971 HydrophobicContact CD1-CD2 4.34Å; L1917-L1971 WeakPolarHBondContact CD1-O 3.34Å; L1917-L1971 PolarHBondContact N-O 2.78Å; L1917-L1971 VanDerWaalsContact N-O 3.17Å; L1942-L1971 HydrophobicContact CD1-CD1 4.21Å; L1942-L1971 HydrophobicContact CD1-CD2 4.06Å; L1942-L1971 HydrophobicContact CD2-CD1 4Å; V1966-L1971 HydrophobicContact CB-CD2 4.19Å; V1966-L1971 HydrophobicContact CG1-CD2 3.64Å; V1966-L1971 HydrophobicContact CG1-CG 4.47Å; V1968-L1971 HydrophobicContact CB-CD1 4.32Å; V1968-L1971 HydrophobicContact CG1-CD1 4.03Å; V1968-L1971 HydrophobicContact CG1-CD2 4.4Å; V1968-L1971 HydrophobicContact CG2-CD1 4.38Å; V1968-L1971 WeakPolarHBondContact O-CB 3.08Å; V1968-L1971 VanDerWaalsContact O-CG 3.32Å; V1968-L1971 WeakPolarHBondContact O-CG 3.31Å; V1968-L1971 PolarHBondContact O-N 2.75Å; V1968-L1971 VanDerWaalsContact O-N 3.14Å; L1971-K1973 PolarHBondContact O-N 2.95Å; L1971-K1973 VanDerWaalsContact O-N 3.12Å; L1971-I1974 HydrophobicContact CB-CD1 4.22Å; L1971-I1974 HydrophobicContact CB-CG1 4.28Å; L1971-I1974 HydrophobicContact CD1-CD1 4.49Å; L1971-I1974 HydrophobicContact CD2-CD1 3.86Å; L1971-I1974 HydrophobicContact CD2-CG1 3.99Å; L1971-I1974 HydrophobicContact CG-CD1 4.38Å; L1971-I1974 WeakPolarHBondContact O-CG1 3.44Å
1972	R	64.6	Low	70.1	Confident	180.8 Å²	180.8	77.9 Å²	77.9	68%	0.682	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-25	179.6	-70.6	-167.9	-176.8	-168.8	5.2	114	F1870 A1916 L1917 N1970	F1870-R1972 HydrophobicContact CE2-CB 4.07Å; F1870-R1972 WeakPolarHBondContact CE2-O 3.45Å; F1870-R1972 WeakPolarHBondContact CZ-O 3.4Å; A1916-R1972 CarbonylContact C-O 3.5Å; A1916-R1972 VanDerWaalsContact CA-O 3.27Å; A1916-R1972 WeakPolarHBondContact CA-O 3.36Å; A1916-R1972 WeakPolarHBondContact CB-O 3.43Å; L1917-R1972 PolarHBondContact N-O 2.91Å; L1917-R1972 VanDerWaalsContact N-O 3.14Å; N1970-R1972 VanDerWaalsContact C-N 3.33Å; N1970-R1972 PolarHBondContact O-N 2.95Å
1973	K	70.2	Confident	69.8	Low	127.4 Å²	127.4	79.2 Å²	79.2	55%	0.554	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.1	119.7	171.8	-66.2	-173	-179.2	177.6	0	111.1	Q1867 S1869 F1870 V1915 A1916 N1970 L1971 K1990	Q1867-K1973 VanDerWaalsContact OE1-NZ 3.16Å; S1869-K1973 WeakPolarHBondContact O-CE 3.35Å; S1869-K1973 PolarHBondContact O-NZ 2.85Å; S1869-K1973 PolarHBondContact OG-NZ 2.7Å; F1870-K1973 HydrophobicContact CE1-CD 4.28Å; F1870-K1973 HydrophobicContact CE2-CD 4.28Å; F1870-K1973 VanDerWaalsContact CE2-CE 3.49Å; F1870-K1973 HydrophobicContact CZ-CD 4.06Å; F1870-K1973 HydrophobicContact CZ-CG 4.44Å; V1915-K1973 CarbonylContact O-C 3.56Å; V1915-K1973 WeakPolarHBondContact O-CA 3.39Å; A1916-K1973 HydrophobicContact CB-CG 4.31Å; N1970-K1973 PolarHBondContact O-N 3.33Å; L1971-K1973 PolarHBondContact O-N 2.95Å; L1971-K1973 VanDerWaalsContact O-N 3.12Å; K1973-K1990 WeakPolarHBondContact O-CE 3.25Å
1974	I	80.2	Confident	70.4	Confident	4 Å²	4	73.1 Å²	73.1	2%	0.021	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	111.6	178.3	-54.7	176.5	0	0	0	108.4	N1914 V1915 L1917 F1924 W1946 V1968 L1971 L1976 V1989	N1914-I1974 CarbonylContact C-O 3.55Å; N1914-I1974 WeakPolarHBondContact CA-O 3.37Å; V1915-I1974 HydrophobicContact CB-CB 4.47Å; V1915-I1974 PolarHBondContact N-O 3.13Å; V1915-I1974 PolarHBondContact O-N 3.06Å; L1917-I1974 HydrophobicContact CD1-CD1 3.66Å; L1917-I1974 HydrophobicContact CG-CD1 4.19Å; F1924-I1974 HydrophobicContact CD1-CD1 4.36Å; F1924-I1974 HydrophobicContact CE1-CD1 3.67Å; F1924-I1974 VanDerWaalsContact CE1-CD1 3.49Å; F1924-I1974 HydrophobicContact CZ-CD1 3.89Å; F1924-I1974 HydrophobicContact CZ-CG2 4.4Å; W1946-I1974 HydrophobicContact CH2-CD1 4.2Å; W1946-I1974 HydrophobicContact CH2-CG2 4.3Å; W1946-I1974 HydrophobicContact CZ2-CD1 4.3Å; V1968-I1974 HydrophobicContact CG1-CD1 3.81Å; V1968-I1974 HydrophobicContact CG1-CG1 4.25Å; L1971-I1974 HydrophobicContact CB-CD1 4.22Å; L1971-I1974 HydrophobicContact CB-CG1 4.28Å; L1971-I1974 HydrophobicContact CD1-CD1 4.49Å; L1971-I1974 HydrophobicContact CD2-CD1 3.86Å; L1971-I1974 HydrophobicContact CD2-CG1 3.99Å; L1971-I1974 HydrophobicContact CG-CD1 4.38Å; L1971-I1974 WeakPolarHBondContact O-CG1 3.44Å; I1974-L1976 HydrophobicContact CG2-CD2 3.88Å; I1974-L1976 HydrophobicContact CG2-CG 4.21Å; I1974-L1976 PolarHBondContact O-N 3.13Å; I1974-V1989 HydrophobicContact CG2-CG1 4.26Å; I1974-V1989 HydrophobicContact CG2-CG2 4.41Å
1975	R	83.6	Confident	71.4	Confident	115.8 Å²	115.8	72.7 Å²	72.7	44%	0.437	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	105.6	169	-177.5	173.9	-178.3	160.7	13	109.1	T1912 N1914 T1977 V1989 K1990 D2020	T1912-R1975 HydrophobicContact CG2-CG 3.7Å; T1912-R1975 VanDerWaalsContact CG2-NE 3.27Å; T1912-R1975 PolarHBondContact OG1-NH2 2.97Å; T1912-R1975 VanDerWaalsContact OG1-NH2 3.12Å; N1914-R1975 WeakPolarHBondContact OD1-CB 3.37Å; N1914-R1975 VanDerWaalsContact OD1-CG 3.23Å; N1914-R1975 WeakPolarHBondContact OD1-CG 3.34Å; R1975-T1977 PolarHBondContact NE-OG1 3Å; R1975-V1989 CarbonylContact O-C 3.54Å; R1975-V1989 WeakPolarHBondContact O-CA 3.45Å; R1975-K1990 PolarHBondContact O-N 2.95Å; R1975-K1990 VanDerWaalsContact O-N 3.14Å; R1975-D2020 IonicContact NH2-OD2 2.77Å
1976	L	88	Confident	72.6	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	141.2	165.6	-52.9	168.2	0	0	0	108	T1912 V1913 V1915 F1924 V1926 L1938 W1946 I1974 F1978 L1987 S1988 V1989	T1912-L1976 CarbonylContact C-O 3.53Å; T1912-L1976 VanDerWaalsContact CA-O 3.28Å; T1912-L1976 WeakPolarHBondContact CA-O 3.26Å; T1912-L1976 WeakPolarHBondContact CG2-O 3.32Å; V1913-L1976 HydrophobicContact CB-CB 4.34Å; V1913-L1976 HydrophobicContact CB-CD1 4.4Å; V1913-L1976 PolarHBondContact N-O 2.96Å; V1913-L1976 VanDerWaalsContact O-CB 3.31Å; V1913-L1976 WeakPolarHBondContact O-CB 3.32Å; V1913-L1976 PolarHBondContact O-N 3.1Å; V1915-L1976 HydrophobicContact CG2-CD1 3.78Å; V1915-L1976 HydrophobicContact CG2-CG 4.44Å; F1924-L1976 HydrophobicContact CE2-CD1 3.96Å; F1924-L1976 HydrophobicContact CZ-CD1 4.43Å; F1924-L1976 HydrophobicContact CZ-CD2 4.43Å; V1926-L1976 HydrophobicContact CB-CD1 4.3Å; V1926-L1976 HydrophobicContact CG2-CD1 3.71Å; L1938-L1976 HydrophobicContact CD2-CD1 4.06Å; L1938-L1976 HydrophobicContact CD2-CD2 4.16Å; L1938-L1976 HydrophobicContact CD2-CG 4.5Å; W1946-L1976 HydrophobicContact CH2-CD2 4.25Å; W1946-L1976 HydrophobicContact CZ3-CD2 3.77Å; I1974-L1976 HydrophobicContact CG2-CD2 3.88Å; I1974-L1976 HydrophobicContact CG2-CG 4.21Å; I1974-L1976 PolarHBondContact O-N 3.13Å; L1976-F1978 HydrophobicContact CB-CE2 4.37Å; L1976-F1978 HydrophobicContact CD1-CE2 4.05Å; L1976-F1978 HydrophobicContact CD1-CZ 4.27Å; L1976-L1987 HydrophobicContact CB-CD1 4.16Å; L1976-L1987 HydrophobicContact CD2-CD1 4.24Å; L1976-L1987 HydrophobicContact CD2-CD2 4.48Å; L1976-S1988 CarbonylContact C-O 3.33Å; L1976-S1988 WeakPolarHBondContact CA-O 3.33Å; L1976-V1989 HydrophobicContact CD2-CG2 3.76Å
1977	T	88.5	Confident	74	Confident	11.6 Å²	11.6	66.3 Å²	66.3	7%	0.071	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	116.4	167	-57	0	0	0	0	109.5	K1910 T1911 T1912 R1975 L1987 S1988	K1910-T1977 HydrophobicContact CB-CG2 4.07Å; K1910-T1977 HydrophobicContact CD-CG2 4.27Å; K1910-T1977 HydrophobicContact CG-CG2 4.14Å; K1910-T1977 VanDerWaalsContact CG-CG2 3.47Å; T1911-T1977 CarbonylContact O-C 3.54Å; T1911-T1977 WeakPolarHBondContact O-CA 3.38Å; T1912-T1977 PolarHBondContact OG1-OG1 3.02Å; R1975-T1977 PolarHBondContact NE-OG1 3Å; T1977-L1987 WeakPolarHBondContact O-CA 3.22Å; T1977-S1988 WeakPolarHBondContact CB-OG 3.32Å; T1977-S1988 PolarHBondContact N-O 2.96Å; T1977-S1988 PolarHBondContact O-N 2.94Å; T1977-S1988 PolarHBondContact O-OG 3.14Å
1978	F	88.6	Confident	75.4	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	102.9	171	-58.5	-97.9	0	0	0	107.4	K1910 T1911 V1913 V1926 V1928 L1936 L1938 L1948 L1976 M1980 V1985 L1987	K1910-F1978 CarbonylContact C-O 3.54Å; K1910-F1978 VanDerWaalsContact CA-O 3.27Å; K1910-F1978 WeakPolarHBondContact CA-O 3.32Å; T1911-F1978 HydrophobicContact CG2-CD2 4.47Å; T1911-F1978 PolarHBondContact N-O 3.01Å; T1911-F1978 PolarHBondContact O-N 3.15Å; V1913-F1978 HydrophobicContact CB-CE2 4.47Å; V1913-F1978 HydrophobicContact CG2-CD2 4.31Å; V1913-F1978 HydrophobicContact CG2-CE2 4Å; V1926-F1978 HydrophobicContact CB-CZ 4.34Å; V1926-F1978 HydrophobicContact CG1-CE2 4.01Å; V1926-F1978 HydrophobicContact CG1-CZ 3.96Å; V1928-F1978 HydrophobicContact CG2-CD2 4.46Å; V1928-F1978 HydrophobicContact CG2-CE1 4.45Å; V1928-F1978 HydrophobicContact CG2-CE2 4.28Å; V1928-F1978 HydrophobicContact CG2-CZ 4.29Å; L1936-F1978 HydrophobicContact CD2-CD1 3.8Å; L1936-F1978 HydrophobicContact CD2-CE1 4.04Å; L1938-F1978 HydrophobicContact CB-CZ 4.4Å; L1938-F1978 HydrophobicContact CD2-CZ 4.28Å; L1948-F1978 HydrophobicContact CD1-CE1 4.23Å; L1976-F1978 HydrophobicContact CB-CE2 4.37Å; L1976-F1978 HydrophobicContact CD1-CE2 4.05Å; L1976-F1978 HydrophobicContact CD1-CZ 4.27Å; F1978-M1980 HydrophobicContact CB-CE 3.82Å; F1978-V1985 HydrophobicContact CB-CG2 3.91Å; F1978-V1985 HydrophobicContact CD1-CG2 4.02Å; F1978-V1985 HydrophobicContact CG-CG2 4.46Å; F1978-L1987 HydrophobicContact CD1-CD1 3.97Å; F1978-L1987 HydrophobicContact CD2-CD1 4.28Å; F1978-L1987 HydrophobicContact CE1-CD1 3.91Å; F1978-L1987 HydrophobicContact CE2-CD1 4.2Å; F1978-L1987 HydrophobicContact CG-CD1 4.17Å; F1978-L1987 HydrophobicContact CZ-CD1 4.02Å
1979	T	87.1	Confident	76.9	Confident	45.2 Å²	45.2	53.5 Å²	53.5	28%	0.277	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	124.3	169.7	-56.8	0	0	0	0	107.5	K1910 V1985 Q1986	K1910-T1979 HydrophobicContact CG-CG2 4.19Å; T1979-V1985 CarbonylContact O-C 3.48Å; T1979-V1985 VanDerWaalsContact O-CA 3.26Å; T1979-V1985 WeakPolarHBondContact O-CA 3.31Å; T1979-Q1986 PolarHBondContact N-O 3.05Å; T1979-Q1986 PolarHBondContact O-N 3.26Å
1980	M	84.3	Confident	78.1	Confident	4 Å²	4	53.1 Å²	53.1	2%	0.02	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	115.5	-176.9	-47.1	-177.6	-165.1	0	0	108.4	L1907 P1908 K1909 T1911 V1928 M1930 F1978 V1984 V1985 L2000 V2005	L1907-M1980 HydrophobicContact CD1-SD 4.15Å; L1907-M1980 HydrophobicContact CD2-CB 3.87Å; L1907-M1980 VanDerWaalsContact CD2-CB 3.48Å; L1907-M1980 HydrophobicContact CD2-CG 4.12Å; L1907-M1980 HydrophobicContact CD2-SD 3.86Å; L1907-M1980 VanDerWaalsContact CD2-SD 3.54Å; L1907-M1980 HydrophobicContact CG-CB 4.13Å; P1908-M1980 HydrophobicContact CG-SD 4.28Å; P1908-M1980 WeakPolarHBondContact O-CB 3.31Å; K1909-M1980 CarbonylContact C-O 3.44Å; K1909-M1980 WeakPolarHBondContact CA-O 3.4Å; K1909-M1980 PolarHBondContact O-N 3.06Å; K1909-M1980 VanDerWaalsContact O-O 3.14Å; T1911-M1980 WeakPolarHBondContact OG1-CE 3.19Å; V1928-M1980 HydrophobicContact CG1-CE 4.18Å; M1930-M1980 HydrophobicContact CE-CE 3.78Å; M1930-M1980 HydrophobicContact CE-SD 3.76Å; M1930-M1980 VanDerWaalsContact CE-SD 3.59Å; F1978-M1980 HydrophobicContact CB-CE 3.82Å; M1980-V1984 WeakPolarHBondContact CA-O 3.26Å; M1980-V1985 HydrophobicContact CG-CG2 4.22Å; M1980-L2000 HydrophobicContact CB-CD1 4.23Å; M1980-L2000 HydrophobicContact CB-CD2 4.27Å; M1980-L2000 HydrophobicContact CG-CD2 4.15Å; M1980-L2000 HydrophobicContact SD-CD2 4.19Å; M1980-V2005 HydrophobicContact CE-CG2 4.25Å; M1980-V2005 HydrophobicContact SD-CG2 4.16Å
1981	D	73.5	Confident	79	Confident	76.4 Å²	76.4	51.1 Å²	51.1	41%	0.409	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	136.8	-169.9	178.1	42.7	0	0	0	109.8	G1983 V1984 K1997	D1981-G1983 VanDerWaalsContact C-N 3.3Å; D1981-G1983 PolarHBondContact O-N 3.01Å; D1981-G1983 VanDerWaalsContact O-N 3.12Å; D1981-V1984 PolarHBondContact N-O 2.85Å; D1981-V1984 WeakPolarHBondContact O-CG2 3.38Å; D1981-V1984 PolarHBondContact O-N 3.01Å; D1981-V1984 VanDerWaalsContact O-O 3.08Å; D1981-K1997 IonicContact OD2-NZ 2.68Å; D1981-K1997 PolarHBondContact OD2-NZ 3.46Å; D1981-K1997 VanDerWaalsContact OD2-NZ 3.08Å
1982	N	69.5	Low	79.9	Confident	148.8 Å²	148.8	58.7 Å²	58.7	80%	0.796	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	42.4	49.4	176.2	-68.8	-49.9	0	0	0	114.8	V1984	N1982-V1984 VanDerWaalsContact C-N 3.29Å; N1982-V1984 PolarHBondContact O-N 3.06Å
1983	G	72.5	Confident	80.7	Confident	47 Å²	47	54.4 Å²	54.4	49%	0.485	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.9	1.5	177.5	0	0	0	0	0	116	D1981 L2000	D1981-G1983 VanDerWaalsContact C-N 3.3Å; D1981-G1983 PolarHBondContact O-N 3.01Å; D1981-G1983 VanDerWaalsContact O-N 3.12Å; G1983-L2000 WeakPolarHBondContact O-CB 3.45Å; G1983-L2000 PolarHBondContact O-N 3.21Å
1984	V	83.1	Confident	81	Confident	39.4 Å²	39.4	49.8 Å²	49.8	24%	0.239	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	148.3	178.9	-66.5	0	0	0	0	113.2	M1980 D1981 N1982 K1997 F1998	M1980-V1984 WeakPolarHBondContact CA-O 3.26Å; D1981-V1984 PolarHBondContact N-O 2.85Å; D1981-V1984 WeakPolarHBondContact O-CG2 3.38Å; D1981-V1984 PolarHBondContact O-N 3.01Å; D1981-V1984 VanDerWaalsContact O-O 3.08Å; N1982-V1984 VanDerWaalsContact C-N 3.29Å; N1982-V1984 PolarHBondContact O-N 3.06Å; V1984-K1997 HydrophobicContact CB-CB 4.33Å; V1984-K1997 HydrophobicContact CG1-CB 4.49Å; V1984-K1997 HydrophobicContact CG2-CB 4.28Å; V1984-K1997 HydrophobicContact CG2-CD 4.06Å; V1984-K1997 HydrophobicContact CG2-CG 4.26Å; V1984-F1998 CarbonylContact C-O 3.51Å; V1984-F1998 VanDerWaalsContact CA-O 3.26Å; V1984-F1998 WeakPolarHBondContact CA-O 3.24Å; V1984-F1998 VanDerWaalsContact CB-O 3.32Å; V1984-F1998 WeakPolarHBondContact CB-O 3.32Å
1985	V	86	Confident	80.9	Confident	0.2 Å²	0.2	50.1 Å²	50.1	0%	0.001	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	143.3	169.2	64.1	0	0	0	0	111.1	L1936 L1948 F1978 T1979 M1980 K1997 F1998 L2000	L1936-V1985 HydrophobicContact CD1-CG1 3.95Å; L1936-V1985 HydrophobicContact CD2-CB 4.17Å; L1936-V1985 HydrophobicContact CD2-CG1 3.76Å; L1936-V1985 HydrophobicContact CD2-CG2 3.84Å; L1936-V1985 HydrophobicContact CG-CG1 4.49Å; L1948-V1985 HydrophobicContact CD2-CG1 4.4Å; F1978-V1985 HydrophobicContact CB-CG2 3.91Å; F1978-V1985 HydrophobicContact CD1-CG2 4.02Å; F1978-V1985 HydrophobicContact CG-CG2 4.46Å; T1979-V1985 CarbonylContact O-C 3.48Å; T1979-V1985 VanDerWaalsContact O-CA 3.26Å; T1979-V1985 WeakPolarHBondContact O-CA 3.31Å; M1980-V1985 HydrophobicContact CG-CG2 4.22Å; V1985-K1997 WeakPolarHBondContact O-CA 3.15Å; V1985-F1998 HydrophobicContact CG1-CB 4.04Å; V1985-F1998 HydrophobicContact CG1-CD1 4.1Å; V1985-F1998 WeakPolarHBondContact CG1-O 3.37Å; V1985-F1998 PolarHBondContact N-O 2.87Å; V1985-F1998 PolarHBondContact O-N 3.03Å; V1985-L2000 HydrophobicContact CB-CD2 3.74Å; V1985-L2000 HydrophobicContact CB-CG 4.36Å; V1985-L2000 HydrophobicContact CG1-CD2 4.29Å
1986	Q	87.2	Confident	80.7	Confident	44.6 Å²	44.6	52.9 Å²	52.9	21%	0.208	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	122.9	165.5	-171.4	161.1	31.4	0	0	110.1	T1979 N1993 S1995 K1997	T1979-Q1986 PolarHBondContact N-O 3.05Å; T1979-Q1986 PolarHBondContact O-N 3.26Å; Q1986-N1993 VanDerWaalsContact CD-ND2 3.35Å; Q1986-N1993 HydrophobicContact CG-CB 4.28Å; Q1986-N1993 PolarHBondContact NE2-ND2 3Å; Q1986-N1993 PolarHBondContact OE1-ND2 3.06Å; Q1986-S1995 PolarHBondContact NE2-O 2.97Å; Q1986-S1995 VanDerWaalsContact NE2-O 3.09Å; Q1986-K1997 HydrophobicContact CB-CG 4.4Å
1987	L	88	Confident	80.3	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	127.7	177.1	179.8	66.4	0	0	0	110.4	L1938 F1962 L1976 T1977 F1978 I1994 S1995	L1938-L1987 HydrophobicContact CD1-CD2 3.82Å; L1938-L1987 HydrophobicContact CD2-CD1 4.45Å; L1938-L1987 HydrophobicContact CD2-CD2 3.69Å; L1938-L1987 HydrophobicContact CG-CD2 4.38Å; F1962-L1987 HydrophobicContact CE2-CD2 4.03Å; F1962-L1987 HydrophobicContact CZ-CD2 3.71Å; L1976-L1987 HydrophobicContact CB-CD1 4.16Å; L1976-L1987 HydrophobicContact CD2-CD1 4.24Å; L1976-L1987 HydrophobicContact CD2-CD2 4.48Å; T1977-L1987 WeakPolarHBondContact O-CA 3.22Å; F1978-L1987 HydrophobicContact CD1-CD1 3.97Å; F1978-L1987 HydrophobicContact CD2-CD1 4.28Å; F1978-L1987 HydrophobicContact CE1-CD1 3.91Å; F1978-L1987 HydrophobicContact CE2-CD1 4.2Å; F1978-L1987 HydrophobicContact CG-CD1 4.17Å; F1978-L1987 HydrophobicContact CZ-CD1 4.02Å; L1987-I1994 HydrophobicContact CB-CG1 4.45Å; L1987-I1994 HydrophobicContact CD2-CD1 3.95Å; L1987-I1994 HydrophobicContact CD2-CG1 4.17Å; L1987-I1994 HydrophobicContact CG-CD1 4.26Å; L1987-I1994 HydrophobicContact CG-CG1 4.08Å; L1987-I1994 WeakPolarHBondContact O-CG1 3.32Å; L1987-I1994 PolarHBondContact O-N 2.93Å; L1987-S1995 PolarHBondContact N-OG 2.94Å; L1987-S1995 PolarHBondContact O-N 3.01Å
1988	S	85.4	Confident	79.8	Confident	7.2 Å²	7.2	59.4 Å²	59.4	5%	0.05	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	152.6	168.7	67.4	0	0	0	0	111.9	L1976 T1977 R1992 N1993	L1976-S1988 CarbonylContact C-O 3.33Å; L1976-S1988 WeakPolarHBondContact CA-O 3.33Å; T1977-S1988 WeakPolarHBondContact CB-OG 3.32Å; T1977-S1988 PolarHBondContact N-O 2.96Å; T1977-S1988 PolarHBondContact O-N 2.94Å; T1977-S1988 PolarHBondContact O-OG 3.14Å; S1988-R1992 CarbonylContact C-O 3.56Å; S1988-R1992 WeakPolarHBondContact CA-O 3.35Å; S1988-R1992 VanDerWaalsContact CB-O 3.26Å; S1988-R1992 WeakPolarHBondContact CB-O 3.34Å; S1988-N1993 WeakPolarHBondContact CB-OD1 3.42Å
1989	V	81.6	Confident	79.3	Confident	4.4 Å²	4.4	61.7 Å²	61.7	3%	0.027	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	125.3	172	172.8	0	0	0	0	109.1	W1946 V1966 I1974 R1975 L1976 G1991 R1992 I1994	W1946-V1989 HydrophobicContact CH2-CG2 4.35Å; W1946-V1989 HydrophobicContact CZ3-CG2 3.93Å; V1966-V1989 HydrophobicContact CB-CG1 4.37Å; V1966-V1989 HydrophobicContact CG1-CG1 4.21Å; V1966-V1989 HydrophobicContact CG2-CB 4.39Å; V1966-V1989 HydrophobicContact CG2-CG1 4.01Å; I1974-V1989 HydrophobicContact CG2-CG1 4.26Å; I1974-V1989 HydrophobicContact CG2-CG2 4.41Å; R1975-V1989 CarbonylContact O-C 3.54Å; R1975-V1989 WeakPolarHBondContact O-CA 3.45Å; L1976-V1989 HydrophobicContact CD2-CG2 3.76Å; V1989-G1991 PolarHBondContact O-N 3.04Å; V1989-G1991 VanDerWaalsContact O-N 3.14Å; V1989-R1992 PolarHBondContact N-O 3.06Å; V1989-R1992 PolarHBondContact O-N 3.02Å; V1989-R1992 VanDerWaalsContact O-N 3.09Å; V1989-I1994 HydrophobicContact CB-CD1 4.25Å; V1989-I1994 HydrophobicContact CB-CG2 4.41Å; V1989-I1994 HydrophobicContact CG2-CD1 3.42Å; V1989-I1994 VanDerWaalsContact CG2-CD1 3.45Å; V1989-I1994 HydrophobicContact CG2-CG1 4.15Å; V1989-I1994 HydrophobicContact CG2-CG2 4.49Å
1990	K	71.3	Confident	79	Confident	116 Å²	116	60.6 Å²	60.6	50%	0.504	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.6	36.7	-173.7	-58	-176.3	-179.3	-175.7	0	112.7	V1966 N1970 K1973 R1975 R1992	V1966-K1990 HydrophobicContact CG1-CD 4.1Å; N1970-K1990 PolarHBondContact O-NZ 2.94Å; N1970-K1990 PolarHBondContact OD1-NZ 2.93Å; K1973-K1990 WeakPolarHBondContact O-CE 3.25Å; R1975-K1990 PolarHBondContact O-N 2.95Å; R1975-K1990 VanDerWaalsContact O-N 3.14Å; K1990-R1992 VanDerWaalsContact C-N 3.32Å; K1990-R1992 PolarHBondContact O-N 3.06Å
1991	G	69.8	Low	78.6	Confident	63.8 Å²	63.8	61.6 Å²	61.6	66%	0.658	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.2	-5.5	-180	0	0	0	0	0	116.1	V1989	V1989-G1991 PolarHBondContact O-N 3.04Å; V1989-G1991 VanDerWaalsContact O-N 3.14Å
1992	R	75	Confident	78.6	Confident	195.4 Å²	195.4	58.9 Å²	58.9	74%	0.737	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.3	124.1	172.7	-67.5	-175.6	176.7	-174	-3.2	110.2	S1988 V1989 K1990 I1994	S1988-R1992 CarbonylContact C-O 3.56Å; S1988-R1992 WeakPolarHBondContact CA-O 3.35Å; S1988-R1992 VanDerWaalsContact CB-O 3.26Å; S1988-R1992 WeakPolarHBondContact CB-O 3.34Å; V1989-R1992 PolarHBondContact N-O 3.06Å; V1989-R1992 PolarHBondContact O-N 3.02Å; V1989-R1992 VanDerWaalsContact O-N 3.09Å; K1990-R1992 VanDerWaalsContact C-N 3.32Å; K1990-R1992 PolarHBondContact O-N 3.06Å; R1992-I1994 PolarHBondContact O-N 3.12Å
1993	N	80.4	Confident	78.5	Confident	92.2 Å²	92.2	56.8 Å²	56.8	49%	0.493	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	130.2	172.8	-70	-20.9	0	0	0	110.2	Q1986 S1988	Q1986-N1993 VanDerWaalsContact CD-ND2 3.35Å; Q1986-N1993 HydrophobicContact CG-CB 4.28Å; Q1986-N1993 PolarHBondContact NE2-ND2 3Å; Q1986-N1993 PolarHBondContact OE1-ND2 3.06Å; S1988-N1993 WeakPolarHBondContact CB-OD1 3.42Å
1994	I	77.9	Confident	78.3	Confident	30.6 Å²	30.6	56.5 Å²	56.5	16%	0.157	29%	0.29	C	S	.	.			trans	-121.1	-15.5	179.5	61.6	164	0	0	0	113.8	W1946 F1962 P1964 L1987 V1989 R1992	W1946-I1994 HydrophobicContact CE3-CD1 4.01Å; W1946-I1994 HydrophobicContact CZ3-CD1 4.04Å; F1962-I1994 WeakPolarHBondContact CB-O 3.33Å; F1962-I1994 HydrophobicContact CD2-CB 4.42Å; F1962-I1994 HydrophobicContact CD2-CD1 3.99Å; F1962-I1994 HydrophobicContact CD2-CG1 4.22Å; F1962-I1994 HydrophobicContact CE2-CD1 3.61Å; F1962-I1994 VanDerWaalsContact CE2-CD1 3.48Å; F1962-I1994 HydrophobicContact CE2-CG1 4.08Å; F1962-I1994 WeakPolarHBondContact CG-O 3.36Å; F1962-I1994 HydrophobicContact CZ-CD1 4.4Å; P1964-I1994 HydrophobicContact CB-CB 4.45Å; P1964-I1994 HydrophobicContact CB-CD1 3.98Å; P1964-I1994 HydrophobicContact CB-CG2 4.32Å; L1987-I1994 HydrophobicContact CB-CG1 4.45Å; L1987-I1994 HydrophobicContact CD2-CD1 3.95Å; L1987-I1994 HydrophobicContact CD2-CG1 4.17Å; L1987-I1994 HydrophobicContact CG-CD1 4.26Å; L1987-I1994 HydrophobicContact CG-CG1 4.08Å; L1987-I1994 WeakPolarHBondContact O-CG1 3.32Å; L1987-I1994 PolarHBondContact O-N 2.93Å; V1989-I1994 HydrophobicContact CB-CD1 4.25Å; V1989-I1994 HydrophobicContact CB-CG2 4.41Å; V1989-I1994 HydrophobicContact CG2-CD1 3.42Å; V1989-I1994 VanDerWaalsContact CG2-CD1 3.45Å; V1989-I1994 HydrophobicContact CG2-CG1 4.15Å; V1989-I1994 HydrophobicContact CG2-CG2 4.49Å; R1992-I1994 PolarHBondContact O-N 3.12Å
1995	S	78.5	Confident	77.6	Confident	9.2 Å²	9.2	55.7 Å²	55.7	6%	0.064	29%	0.285	C	S	.	.	S	Bend	trans	-103.7	156.6	167.5	78.9	0	0	0	0	111.2	Q1986 L1987	Q1986-S1995 PolarHBondContact NE2-O 2.97Å; Q1986-S1995 VanDerWaalsContact NE2-O 3.09Å; L1987-S1995 PolarHBondContact N-OG 2.94Å; L1987-S1995 PolarHBondContact O-N 3.01Å
1996	K	78.6	Confident	76.7	Confident	174 Å²	174	60 Å²	60	76%	0.757	31%	0.305	S	S	*	.			trans	-62.5	163.5	154.8	-65.1	-174.1	177.5	-175.7	0	109.2	F1998	K1996-F1998 PolarHBondContact O-N 3.12Å
1997	K	79.4	Confident	76	Confident	136.8 Å²	136.8	59.4 Å²	59.4	60%	0.595	31%	0.308	S	S	*	.			trans	-58	132.1	164.4	-75.4	-179.1	165.4	-161.7	0	108.3	D1981 V1984 V1985 Q1986	D1981-K1997 IonicContact OD2-NZ 2.68Å; D1981-K1997 PolarHBondContact OD2-NZ 3.46Å; D1981-K1997 VanDerWaalsContact OD2-NZ 3.08Å; V1984-K1997 HydrophobicContact CB-CB 4.33Å; V1984-K1997 HydrophobicContact CG1-CB 4.49Å; V1984-K1997 HydrophobicContact CG2-CB 4.28Å; V1984-K1997 HydrophobicContact CG2-CD 4.06Å; V1984-K1997 HydrophobicContact CG2-CG 4.26Å; V1985-K1997 WeakPolarHBondContact O-CA 3.15Å; Q1986-K1997 HydrophobicContact CB-CG 4.4Å
1998	F	78.2	Confident	75.5	Confident	13.2 Å²	13.2	60.3 Å²	60.3	6%	0.058	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	142.9	-172.1	-167.8	-104	0	0	0	109	L1936 L1948 Q1950 K1958 T1960 V1984 V1985 K1996	L1936-F1998 HydrophobicContact CD1-CD1 3.88Å; L1936-F1998 HydrophobicContact CD1-CE1 3.85Å; L1948-F1998 HydrophobicContact CD2-CB 4.13Å; L1948-F1998 HydrophobicContact CD2-CD1 3.78Å; L1948-F1998 HydrophobicContact CD2-CD2 4.49Å; L1948-F1998 HydrophobicContact CD2-CE1 4.33Å; L1948-F1998 HydrophobicContact CD2-CG 3.97Å; L1948-F1998 HydrophobicContact CG-CD1 4.14Å; L1948-F1998 HydrophobicContact CG-CE1 4.19Å; L1948-F1998 HydrophobicContact CG-CG 4.45Å; Q1950-F1998 HydrophobicContact CB-CE1 3.97Å; Q1950-F1998 HydrophobicContact CB-CZ 4.06Å; K1958-F1998 HydrophobicContact CB-CE1 3.67Å; K1958-F1998 HydrophobicContact CB-CE2 4.14Å; K1958-F1998 HydrophobicContact CB-CZ 3.85Å; T1960-F1998 HydrophobicContact CG2-CD2 3.62Å; T1960-F1998 VanDerWaalsContact CG2-CD2 3.46Å; T1960-F1998 HydrophobicContact CG2-CE2 3.6Å; T1960-F1998 HydrophobicContact CG2-CG 4.25Å; T1960-F1998 HydrophobicContact CG2-CZ 4.19Å; T1960-F1998 WeakPolarHBondContact OG1-CD2 3.36Å; T1960-F1998 VanDerWaalsContact OG1-CE2 3.31Å; T1960-F1998 WeakPolarHBondContact OG1-CE2 3.38Å; V1984-F1998 CarbonylContact C-O 3.51Å; V1984-F1998 VanDerWaalsContact CA-O 3.26Å; V1984-F1998 WeakPolarHBondContact CA-O 3.24Å; V1984-F1998 VanDerWaalsContact CB-O 3.32Å; V1984-F1998 WeakPolarHBondContact CB-O 3.32Å; V1985-F1998 HydrophobicContact CG1-CB 4.04Å; V1985-F1998 HydrophobicContact CG1-CD1 4.1Å; V1985-F1998 WeakPolarHBondContact CG1-O 3.37Å; V1985-F1998 PolarHBondContact N-O 2.87Å; V1985-F1998 PolarHBondContact O-N 3.03Å; K1996-F1998 PolarHBondContact O-N 3.12Å
1999	P	79	Confident	75.1	Confident	48 Å²	48	63.2 Å²	63.2	31%	0.312	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	146.3	-178.9	-24.3	35.8	0	0	0	113.2	K1958	K1958-P1999 HydrophobicContact CD-CG 4.12Å
2000	L	80.4	Confident	75.1	Confident	22 Å²	22	63.5 Å²	63.5	12%	0.115	33%	0.327	C	S	.	.			trans	-80.6	132.2	170	-73	165.9	0	0	0	110.4	L1907 M1930 M1980 G1983 V1985 G2002	L1907-L2000 HydrophobicContact CD1-CD1 3.75Å; L1907-L2000 HydrophobicContact CD2-CD1 3.87Å; L1907-L2000 VanDerWaalsContact CD2-CD1 3.49Å; L1907-L2000 HydrophobicContact CD2-CD2 4.24Å; L1907-L2000 HydrophobicContact CG-CD1 4.4Å; M1930-L2000 HydrophobicContact CE-CD1 4.45Å; M1930-L2000 HydrophobicContact CE-CD2 3.65Å; M1930-L2000 HydrophobicContact SD-CB 4.49Å; M1930-L2000 HydrophobicContact SD-CD2 3.76Å; M1980-L2000 HydrophobicContact CB-CD1 4.23Å; M1980-L2000 HydrophobicContact CB-CD2 4.27Å; M1980-L2000 HydrophobicContact CG-CD2 4.15Å; M1980-L2000 HydrophobicContact SD-CD2 4.19Å; G1983-L2000 WeakPolarHBondContact O-CB 3.45Å; G1983-L2000 PolarHBondContact O-N 3.21Å; V1985-L2000 HydrophobicContact CB-CD2 3.74Å; V1985-L2000 HydrophobicContact CB-CG 4.36Å; V1985-L2000 HydrophobicContact CG1-CD2 4.29Å; L2000-G2002 VanDerWaalsContact C-N 3.33Å; L2000-G2002 PolarHBondContact O-N 3.07Å
2001	P	75.5	Confident	75.6	Confident	24.6 Å²	24.6	60.7 Å²	60.7	16%	0.16	32%	0.32	C	S	.	.	S	Bend	trans	-72.2	2.8	172.2	24.6	-29.6	0	0	0	113.6	M1930 A1934 L1936 Q1950 I1952	M1930-P2001 HydrophobicContact CB-CG 4.46Å; M1930-P2001 HydrophobicContact CG-CG 4.46Å; M1930-P2001 HydrophobicContact SD-CG 3.79Å; A1934-P2001 HydrophobicContact CB-CB 4.11Å; A1934-P2001 VanDerWaalsContact CB-O 3.27Å; A1934-P2001 WeakPolarHBondContact CB-O 3.41Å; L1936-P2001 HydrophobicContact CB-CG 3.93Å; Q1950-P2001 HydrophobicContact CG-CB 3.66Å; Q1950-P2001 HydrophobicContact CG-CG 4.27Å; I1952-P2001 HydrophobicContact CD1-CB 4.31Å; I1952-P2001 HydrophobicContact CG1-CB 4Å
2002	G	72.5	Confident	76.2	Confident	20.2 Å²	20.2	59.6 Å²	59.6	21%	0.208	31%	0.309	C	S	.	.	S	Bend	trans	-169.5	167.5	-177.9	0	0	0	0	0	112.9	M1930 L2000	M1930-G2002 WeakPolarHBondContact CE-O 3.17Å; M1930-G2002 WeakPolarHBondContact O-CA 3.33Å; L2000-G2002 VanDerWaalsContact C-N 3.33Å; L2000-G2002 PolarHBondContact O-N 3.07Å
2003	N	68	Low	76.5	Confident	103.8 Å²	103.8	52.5 Å²	52.5	56%	0.555	29%	0.285	S	S	*	.	S	Bend	trans	-106.8	2.2	-168	67.1	-9.2	0	0	0	115	D1506 D1507 L1907	D1506-N2003 PolarHBondContact OD1-ND2 2.89Å; D1507-N2003 PolarHBondContact OD1-ND2 3.03Å; L1907-N2003 WeakPolarHBondContact CB-O 3.41Å; L1907-N2003 WeakPolarHBondContact CD1-O 3.3Å; L1907-N2003 VanDerWaalsContact CG-O 3.27Å; L1907-N2003 WeakPolarHBondContact CG-O 3.31Å
2004	H	68.4	Low	76.2	Confident	40.6 Å²	40.6	48.8 Å²	48.8	19%	0.188	27%	0.266	C	S	.	.	S	Bend	trans	-150.1	179.6	175.9	61.3	-77.4	0	0	0	110.3	V1905 M1930 G1931 E2006	V1905-H2004 HydrophobicContact CB-CB 4.27Å; V1905-H2004 HydrophobicContact CG1-CB 3.87Å; V1905-H2004 WeakPolarHBondContact O-CB 3.3Å; M1930-H2004 CarbonylContact C-O 3.53Å; M1930-H2004 WeakPolarHBondContact CA-O 3.33Å; M1930-H2004 VanDerWaalsContact CB-O 3.25Å; M1930-H2004 WeakPolarHBondContact CB-O 3.26Å; M1930-H2004 WeakPolarHBondContact CE-O 3.38Å; M1930-H2004 WeakPolarHBondContact CG-O 3.36Å; G1931-H2004 VanDerWaalsContact CA-CE1 3.45Å; G1931-H2004 WeakPolarHBondContact CA-CE1 3.3Å; H2004-E2006 VanDerWaalsContact NE2-CG 3.33Å; H2004-E2006 WeakPolarHBondContact NE2-CG 3.39Å; H2004-E2006 IonicContact NE2-OE1 3.37Å
2005	V	69	Low	75.6	Confident	22.4 Å²	22.4	53.7 Å²	53.7	14%	0.136	28%	0.283	C	S	.	.			trans	-119.2	119.7	170.6	176.7	0	0	0	0	109.5	P1908 V1928 K1929 M1930 M1980 I2008	P1908-V2005 HydrophobicContact CG-CB 4.3Å; P1908-V2005 HydrophobicContact CG-CG2 3.89Å; V1928-V2005 HydrophobicContact CG1-CB 4.47Å; V1928-V2005 HydrophobicContact CG1-CG1 3.82Å; V1928-V2005 HydrophobicContact CG1-CG2 3.9Å; K1929-V2005 CarbonylContact O-C 3.36Å; K1929-V2005 WeakPolarHBondContact O-CA 3.34Å; M1930-V2005 HydrophobicContact CE-CG2 4.21Å; M1930-V2005 HydrophobicContact CG-CG2 4.35Å; M1980-V2005 HydrophobicContact CE-CG2 4.25Å; M1980-V2005 HydrophobicContact SD-CG2 4.16Å; V2005-I2008 HydrophobicContact CG1-CD1 4.22Å; V2005-I2008 HydrophobicContact CG1-CG1 3.97Å
2006	E	67.1	Low	74.7	Confident	91.6 Å²	91.6	54.5 Å²	54.5	43%	0.428	29%	0.293	S	S	.	.			trans	-86.8	-44.1	177.1	-67.7	-178.7	138.6	0	0	112	P1897 K1929 G1931 P1932 H2004	P1897-E2006 VanDerWaalsContact CD-O 3.31Å; P1897-E2006 WeakPolarHBondContact CD-O 3.27Å; K1929-E2006 HydrophobicContact CB-CB 4.32Å; K1929-E2006 PolarHBondContact O-N 3.22Å; G1931-E2006 VanDerWaalsContact C-CD 3.46Å; G1931-E2006 WeakPolarHBondContact CA-OE1 3.39Å; G1931-E2006 VanDerWaalsContact CA-OE2 3.27Å; G1931-E2006 WeakPolarHBondContact CA-OE2 3.41Å; G1931-E2006 VanDerWaalsContact N-CD 3.34Å; G1931-E2006 PolarHBondContact N-OE2 2.98Å; G1931-E2006 VanDerWaalsContact N-OE2 3.1Å; P1932-E2006 VanDerWaalsContact CD-OE1 3.25Å; P1932-E2006 WeakPolarHBondContact CD-OE1 3.15Å; P1932-E2006 WeakPolarHBondContact CG-OE1 3.22Å; H2004-E2006 VanDerWaalsContact NE2-CG 3.33Å; H2004-E2006 WeakPolarHBondContact NE2-CG 3.39Å; H2004-E2006 IonicContact NE2-OE1 3.37Å
2007	A	72	Confident	74.5	Confident	32.2 Å²	32.2	50.2 Å²	50.2	27%	0.266	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	157	-174.1	0	0	0	0	0	111.6	Y1895 L1896 K1929	Y1895-A2007 WeakPolarHBondContact O-CA 3.36Å; Y1895-A2007 WeakPolarHBondContact O-CB 3.43Å; L1896-A2007 HydrophobicContact CD2-CB 4.37Å; K1929-A2007 HydrophobicContact CB-CB 4.28Å; K1929-A2007 HydrophobicContact CD-CB 4.35Å; K1929-A2007 HydrophobicContact CG-CB 3.81Å; K1929-A2007 PolarHBondContact N-O 2.96Å
2008	I	77.5	Confident	73.8	Confident	18.2 Å²	18.2	45.9 Å²	45.9	9%	0.093	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	118	171.7	-63.7	-178.6	0	0	0	109.1	T1911 V1913 V1926 D1927 V1928 V2005 V2010 V2019	T1911-I2008 HydrophobicContact CG2-CD1 3.35Å; T1911-I2008 HydrophobicContact CG2-CG1 4.31Å; V1913-I2008 HydrophobicContact CG2-CD1 4.4Å; V1913-I2008 HydrophobicContact CG2-CG2 4Å; V1926-I2008 HydrophobicContact CG1-CG2 4.1Å; D1927-I2008 WeakPolarHBondContact O-CA 3.29Å; V1928-I2008 HydrophobicContact CB-CD1 4.48Å; V1928-I2008 HydrophobicContact CB-CG1 4.33Å; V1928-I2008 HydrophobicContact CG1-CD1 4.12Å; V1928-I2008 HydrophobicContact CG1-CG1 3.98Å; V1928-I2008 HydrophobicContact CG2-CD1 4Å; V1928-I2008 HydrophobicContact CG2-CG1 4.12Å; V1928-I2008 HydrophobicContact CG2-CG2 4.48Å; V2005-I2008 HydrophobicContact CG1-CD1 4.22Å; V2005-I2008 HydrophobicContact CG1-CG1 3.97Å; I2008-V2010 HydrophobicContact CG2-CG2 4.32Å; I2008-V2019 HydrophobicContact CB-CG1 4.29Å; I2008-V2019 HydrophobicContact CB-CG2 4.19Å; I2008-V2019 HydrophobicContact CD1-CG1 3.92Å; I2008-V2019 VanDerWaalsContact CD1-CG1 3.48Å; I2008-V2019 HydrophobicContact CG1-CG1 4.49Å; I2008-V2019 HydrophobicContact CG2-CG1 4.33Å; I2008-V2019 HydrophobicContact CG2-CG2 4.06Å
2009	E	77.4	Confident	73.3	Confident	67 Å²	67	47.3 Å²	47.3	31%	0.313	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	133.4	-178.4	-81.5	172.9	172.5	0	0	109.7	Q1894 V1926 D1927 K1929 T2011	Q1894-E2009 HydrophobicContact CG-CG 4.36Å; Q1894-E2009 PolarHBondContact NE2-OE1 2.88Å; V1926-E2009 CarbonylContact C-O 3.5Å; V1926-E2009 WeakPolarHBondContact CA-O 3.42Å; D1927-E2009 HydrophobicContact CB-CB 4.4Å; D1927-E2009 PolarHBondContact N-O 3.13Å; D1927-E2009 PolarHBondContact O-N 3.08Å; K1929-E2009 WeakPolarHBondContact CE-OE1 3.4Å; K1929-E2009 WeakPolarHBondContact CE-OE2 3.29Å; K1929-E2009 IonicContact NZ-OE1 3.49Å; K1929-E2009 PolarHBondContact NZ-OE1 3.18Å; K1929-E2009 IonicContact NZ-OE2 2.91Å; K1929-E2009 PolarHBondContact NZ-OE2 2.94Å; E2009-T2011 HydrophobicContact CG-CG2 4.46Å
2010	V	81.4	Confident	72.7	Confident	11.6 Å²	11.6	48 Å²	48	7%	0.07	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	122.4	-178.7	-178.7	0	0	0	0	109.2	V1913 V1915 R1925 V1926 I2008 V2014 Y2017	V1913-V2010 HydrophobicContact CG1-CG2 3.74Å; V1915-V2010 HydrophobicContact CG1-CG1 4.2Å; V1915-V2010 HydrophobicContact CG2-CG1 4.06Å; R1925-V2010 WeakPolarHBondContact O-CA 3.39Å; V1926-V2010 HydrophobicContact CG1-CG2 4.22Å; V1926-V2010 HydrophobicContact CG2-CG1 4.28Å; V1926-V2010 HydrophobicContact CG2-CG2 4.12Å; I2008-V2010 HydrophobicContact CG2-CG2 4.32Å; V2010-V2014 HydrophobicContact CG1-CG1 4.28Å; V2010-V2014 HydrophobicContact CG1-CG2 4.04Å; V2010-Y2017 HydrophobicContact CB-CD1 3.67Å; V2010-Y2017 HydrophobicContact CB-CD2 3.92Å; V2010-Y2017 HydrophobicContact CB-CE1 3.75Å; V2010-Y2017 HydrophobicContact CB-CE2 3.98Å; V2010-Y2017 HydrophobicContact CB-CG 3.75Å; V2010-Y2017 HydrophobicContact CG1-CD1 4.09Å; V2010-Y2017 HydrophobicContact CG1-CG 4.11Å; V2010-Y2017 HydrophobicContact CG2-CD1 4.21Å; V2010-Y2017 HydrophobicContact CG2-CD2 3.49Å; V2010-Y2017 VanDerWaalsContact CG2-CD2 3.46Å; V2010-Y2017 HydrophobicContact CG2-CE1 4.33Å; V2010-Y2017 HydrophobicContact CG2-CE2 3.62Å; V2010-Y2017 VanDerWaalsContact CG2-CE2 3.5Å; V2010-Y2017 HydrophobicContact CG2-CG 3.8Å
2011	T	81.6	Confident	71.9	Confident	57 Å²	57	49.3 Å²	49.3	35%	0.35	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	173.1	-170.5	54.3	0	0	0	0	112.1	T1892 F1924 R1925 E2009	T1892-T2011 HydrophobicContact CG2-CG2 3.81Å; F1924-T2011 CarbonylContact C-O 3.43Å; F1924-T2011 VanDerWaalsContact CA-O 3.3Å; F1924-T2011 WeakPolarHBondContact CA-O 3.39Å; F1924-T2011 WeakPolarHBondContact CB-O 3.3Å; R1925-T2011 WeakPolarHBondContact CB-OG1 3.34Å; R1925-T2011 PolarHBondContact N-O 2.91Å; R1925-T2011 PolarHBondContact O-N 3.22Å; E2009-T2011 HydrophobicContact CG-CG2 4.46Å
2012	G	82.5	Confident	71.1	Confident	41.2 Å²	41.2	50.8 Å²	50.8	43%	0.425	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	92.7	-149.8	-174.6	0	0	0	0	0	113.4	V2014	G2012-V2014 PolarHBondContact O-N 3.14Å
2013	D	80.3	Confident	69.8	Low	45.4 Å²	45.4	54.3 Å²	54.3	24%	0.243	30%	0.3	C	S	.	.	S	Bend	trans	-78.4	50.6	-170.3	-63.7	-51.4	0	0	0	113.7	R1918 A1921 Q1922 N1923 R2220	R1918-D2013 PolarHBondContact N-O 3.13Å; A1921-D2013 HydrophobicContact CB-CB 3.43Å; A1921-D2013 VanDerWaalsContact CB-CB 3.44Å; Q1922-D2013 WeakPolarHBondContact CA-OD2 3.35Å; Q1922-D2013 PolarHBondContact N-OD2 3.09Å; N1923-D2013 PolarHBondContact N-OD2 3.06Å; N1923-D2013 PolarHBondContact ND2-OD2 3.19Å; N1923-D2013 VanDerWaalsContact O-CB 3.3Å; N1923-D2013 WeakPolarHBondContact O-CB 3.35Å; N1923-D2013 PolarHBondContact O-N 2.96Å; D2013-R2220 IonicContact OD1-NH1 2.75Å
2014	V	74.4	Confident	68.5	Low	14.8 Å²	14.8	51.5 Å²	51.5	9%	0.09	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	135.5	-170.8	179	0	0	0	0	110.1	V1915 A1916 L1917 R1918 F1924 V2010 G2012 G2016 Y2017	V1915-V2014 HydrophobicContact CG1-CB 4.47Å; V1915-V2014 HydrophobicContact CG1-CG1 4.01Å; V1915-V2014 HydrophobicContact CG1-CG2 3.79Å; A1916-V2014 WeakPolarHBondContact O-CG1 3.37Å; L1917-V2014 HydrophobicContact CD2-CG2 4.09Å; R1918-V2014 PolarHBondContact NE-O 3.07Å; F1924-V2014 HydrophobicContact CB-CG2 3.77Å; V2010-V2014 HydrophobicContact CG1-CG1 4.28Å; V2010-V2014 HydrophobicContact CG1-CG2 4.04Å; G2012-V2014 PolarHBondContact O-N 3.14Å; V2014-G2016 WeakPolarHBondContact CG1-O 3.29Å; V2014-Y2017 HydrophobicContact CG1-CD1 4.39Å
2015	Y	65.1	Low	66.8	Low	134.2 Å²	134.2	54.6 Å²	54.6	53%	0.526	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	-31.9	173.2	177.5	-97.4	0	0	0	111.3	T1858 A1916 K2090 K2260 A2262	T1858-Y2015 WeakPolarHBondContact CG2-OH 3.35Å; A1916-Y2015 HydrophobicContact CB-CD1 4.3Å; A1916-Y2015 PolarHBondContact O-N 3.02Å; Y2015-K2090 WeakPolarHBondContact OH-CD 3.45Å; Y2015-K2260 WeakPolarHBondContact CE2-O 3.32Å; Y2015-K2260 WeakPolarHBondContact OH-CB 3.45Å; Y2015-K2260 PolarHBondContact OH-O 3.47Å; Y2015-A2262 VanDerWaalsContact O-CB 3.32Å; Y2015-A2262 WeakPolarHBondContact O-CB 3.24Å
2016	G	60.4	Low	64.9	Low	25.4 Å²	25.4	57 Å²	57	26%	0.262	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	175.6	167.9	172.6	0	0	0	0	0	110.4	A1916 V2014	A1916-G2016 WeakPolarHBondContact CA-O 3.33Å; A1916-G2016 WeakPolarHBondContact CB-O 3.37Å; A1916-G2016 PolarHBondContact N-O 3.13Å; A1916-G2016 PolarHBondContact O-N 3.11Å; V2014-G2016 WeakPolarHBondContact CG1-O 3.29Å
2017	Y	75.5	Confident	63	Low	83 Å²	83	58.9 Å²	58.9	33%	0.325	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	164.7	175.5	67.9	-80.7	0	0	0	112.1	V1893 Y1895 V1913 N1914 V2010 V2014 V2019	V1893-Y2017 HydrophobicContact CB-CE1 3.83Å; V1893-Y2017 HydrophobicContact CG2-CE1 4.33Å; V1893-Y2017 PolarHBondContact O-OH 2.88Å; V1893-Y2017 VanDerWaalsContact O-OH 3.14Å; Y1895-Y2017 PolarHBondContact OH-OH 3.38Å; V1913-Y2017 HydrophobicContact CG1-CD2 4.26Å; N1914-Y2017 CarbonylContact O-C 3.57Å; N1914-Y2017 WeakPolarHBondContact O-CA 3.29Å; N1914-Y2017 VanDerWaalsContact O-CB 3.24Å; N1914-Y2017 WeakPolarHBondContact O-CB 3.28Å; V2010-Y2017 HydrophobicContact CB-CD1 3.67Å; V2010-Y2017 HydrophobicContact CB-CD2 3.92Å; V2010-Y2017 HydrophobicContact CB-CE1 3.75Å; V2010-Y2017 HydrophobicContact CB-CE2 3.98Å; V2010-Y2017 HydrophobicContact CB-CG 3.75Å; V2010-Y2017 HydrophobicContact CG1-CD1 4.09Å; V2010-Y2017 HydrophobicContact CG1-CG 4.11Å; V2010-Y2017 HydrophobicContact CG2-CD1 4.21Å; V2010-Y2017 HydrophobicContact CG2-CD2 3.49Å; V2010-Y2017 VanDerWaalsContact CG2-CD2 3.46Å; V2010-Y2017 HydrophobicContact CG2-CE1 4.33Å; V2010-Y2017 HydrophobicContact CG2-CE2 3.62Å; V2010-Y2017 VanDerWaalsContact CG2-CE2 3.5Å; V2010-Y2017 HydrophobicContact CG2-CG 3.8Å; V2014-Y2017 HydrophobicContact CG1-CD1 4.39Å; Y2017-V2019 HydrophobicContact CD2-CG2 3.99Å; Y2017-V2019 HydrophobicContact CE2-CG2 3.95Å
2018	S	63	Low	60.9	Low	46.6 Å²	46.6	65.1 Å²	65.1	33%	0.326	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	147.9	164.9	76.6	0	0	0	0	110.5	F1884 V1913 N1914	F1884-S2018 WeakPolarHBondContact O-CA 3.2Å; F1884-S2018 WeakPolarHBondContact O-CB 3.12Å; V1913-S2018 CarbonylContact C-O 3.46Å; V1913-S2018 WeakPolarHBondContact CA-O 3.44Å; N1914-S2018 PolarHBondContact N-O 2.91Å; N1914-S2018 PolarHBondContact ND2-OG 3.09Å; N1914-S2018 PolarHBondContact O-N 3.02Å; N1914-S2018 VanDerWaalsContact O-N 3.09Å
2019	V	67.8	Low	58.5	Low	43.2 Å²	43.2	70 Å²	70	26%	0.262	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	137	174.7	-177	0	0	0	0	108.3	Q1898 T1911 T1912 V1913 I2008 Y2017 T2021	Q1898-V2019 PolarHBondContact NE2-O 2.88Å; T1911-V2019 HydrophobicContact CG2-CG1 3.9Å; T1912-V2019 CarbonylContact O-C 3.54Å; T1912-V2019 WeakPolarHBondContact O-CA 3.31Å; V1913-V2019 HydrophobicContact CG1-CG2 4.49Å; V1913-V2019 HydrophobicContact CG2-CG2 4.42Å; I2008-V2019 HydrophobicContact CB-CG1 4.29Å; I2008-V2019 HydrophobicContact CB-CG2 4.19Å; I2008-V2019 HydrophobicContact CD1-CG1 3.92Å; I2008-V2019 VanDerWaalsContact CD1-CG1 3.48Å; I2008-V2019 HydrophobicContact CG1-CG1 4.49Å; I2008-V2019 HydrophobicContact CG2-CG1 4.33Å; I2008-V2019 HydrophobicContact CG2-CG2 4.06Å; Y2017-V2019 HydrophobicContact CD2-CG2 3.99Å; Y2017-V2019 HydrophobicContact CE2-CG2 3.95Å; V2019-T2021 HydrophobicContact CG1-CG2 4.41Å; V2019-T2021 WeakPolarHBondContact CG1-OG1 3.49Å
2020	D	66.2	Low	56	Low	63.4 Å²	63.4	70 Å²	70	34%	0.339	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	118.5	-178.7	-166.3	17.7	0	0	0	107.5	T1911 T1912 R1975	T1911-D2020 CarbonylContact C-O 3.6Å; T1912-D2020 WeakPolarHBondContact CA-O 3.4Å; T1912-D2020 WeakPolarHBondContact CB-O 3.43Å; T1912-D2020 HydrophobicContact CG2-CB 4.32Å; T1912-D2020 PolarHBondContact N-O 3.08Å; T1912-D2020 PolarHBondContact O-N 3.17Å; R1975-D2020 IonicContact NH2-OD2 2.77Å
2021	T	63.8	Low	53.6	Low	48 Å²	48	75.6 Å²	75.6	29%	0.294	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	120.9	-164.5	-44	0	0	0	0	111.3	P1908 K1910 T1911 V2019 L2023	P1908-T2021 HydrophobicContact CB-CG2 3.34Å; P1908-T2021 VanDerWaalsContact CB-CG2 3.46Å; P1908-T2021 HydrophobicContact CG-CG2 3.7Å; K1910-T2021 CarbonylContact O-C 3.57Å; K1910-T2021 WeakPolarHBondContact O-CA 3.47Å; T1911-T2021 HydrophobicContact CG2-CG2 4.34Å; T1911-T2021 VanDerWaalsContact CG2-OG1 3.31Å; T1911-T2021 WeakPolarHBondContact CG2-OG1 3.42Å; V2019-T2021 HydrophobicContact CG1-CG2 4.41Å; V2019-T2021 WeakPolarHBondContact CG1-OG1 3.49Å; T2021-L2023 VanDerWaalsContact C-N 3.34Å; T2021-L2023 HydrophobicContact CG2-CD2 4.07Å; T2021-L2023 VanDerWaalsContact CG2-CD2 3.5Å; T2021-L2023 HydrophobicContact CG2-CG 4.23Å; T2021-L2023 PolarHBondContact O-N 2.92Å
2022	D	59.8	Low	50.9	Low	57.6 Å²	57.6	77.2 Å²	77.2	31%	0.308	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	86.8	175.4	-62.2	-7.5	0	0	0	109.3	P1908 K1909 K1910 E2105	P1908-D2022 CarbonylContact C-O 3.54Å; P1908-D2022 VanDerWaalsContact C-O 3.26Å; P1908-D2022 WeakPolarHBondContact CA-O 3.31Å; P1908-D2022 VanDerWaalsContact CB-O 3.3Å; P1908-D2022 WeakPolarHBondContact CB-O 3.33Å; K1909-D2022 PolarHBondContact N-O 2.96Å; K1909-D2022 VanDerWaalsContact N-O 3.11Å; K1910-D2022 HydrophobicContact CB-CB 4.25Å; K1910-D2022 WeakPolarHBondContact CB-OD2 3.17Å; K1910-D2022 WeakPolarHBondContact CD-OD2 3.17Å; K1910-D2022 WeakPolarHBondContact CE-OD2 3.37Å; K1910-D2022 VanDerWaalsContact CG-OD2 3.25Å; K1910-D2022 WeakPolarHBondContact CG-OD2 3.48Å; K1910-D2022 IonicContact NZ-OD2 3.2Å; K1910-D2022 PolarHBondContact NZ-OD2 3.12Å; K1910-D2022 PolarHBondContact O-N 2.83Å; K1910-D2022 VanDerWaalsContact O-N 3.09Å; D2022-E2105 WeakPolarHBondContact CA-OE2 3.31Å; D2022-E2105 HydrophobicContact CB-CG 3.85Å
2023	L	44.9	Very low	48.4	Very low	93.8 Å²	93.8	83 Å²	83	49%	0.491	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-73.7	131.3	171.3	-67.5	170.6	0	0	0	110.1	L1899 V1905 P1908 T2021 V2025 E2105	L1899-L2023 HydrophobicContact CD1-CD1 4.33Å; V1905-L2023 HydrophobicContact CG1-CB 4.48Å; V1905-L2023 HydrophobicContact CG1-CD2 3.6Å; P1908-L2023 HydrophobicContact CB-CD2 4.34Å; T2021-L2023 VanDerWaalsContact C-N 3.34Å; T2021-L2023 HydrophobicContact CG2-CD2 4.07Å; T2021-L2023 VanDerWaalsContact CG2-CD2 3.5Å; T2021-L2023 HydrophobicContact CG2-CG 4.23Å; T2021-L2023 PolarHBondContact O-N 2.92Å; L2023-V2025 PolarHBondContact O-N 3.32Å; L2023-E2105 VanDerWaalsContact C-OE2 3.23Å; L2023-E2105 PolarHBondContact N-OE1 2.99Å; L2023-E2105 PolarHBondContact N-OE2 2.85Å
2024	P	39.6	Very low	45.9	Very low	45.2 Å²	45.2	85.6 Å²	85.6	29%	0.294	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-62.1	131.4	174.6	17.1	-21.2	0	0	0	111.3	E1906 S2026	E1906-P2024 HydrophobicContact CB-CB 3.96Å; E1906-P2024 HydrophobicContact CB-CG 3.84Å; E1906-P2024 HydrophobicContact CG-CB 4.49Å; E1906-P2024 WeakPolarHBondContact OE2-CB 3.46Å; E1906-P2024 WeakPolarHBondContact OE2-CG 3.36Å; P2024-S2026 PolarHBondContact O-N 2.86Å
2025	V	32.7	Very low	43.6	Very low	105.8 Å²	105.8	92.2 Å²	92.2	64%	0.641	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-81.6	119.1	166.4	-176.8	0	0	0	0	107.3	K1880 L2023 D2027	K1880-V2025 HydrophobicContact CB-CG2 4.45Å; K1880-V2025 HydrophobicContact CD-CG1 4.3Å; L2023-V2025 PolarHBondContact O-N 3.32Å; V2025-D2027 VanDerWaalsContact C-N 3.34Å; V2025-D2027 HydrophobicContact CG1-CB 3.76Å; V2025-D2027 WeakPolarHBondContact CG1-OD2 3.43Å; V2025-D2027 PolarHBondContact O-N 2.99Å
2026	S	30	Very low	41.9	Very low	72.8 Å²	72.8	92 Å²	92	51%	0.509	54%	0.543	S	S	.	.			trans	-85.7	82	179.4	-175.5	0	0	0	0	110.1	S1878 P2024 Q2028	S1878-S2026 VanDerWaalsContact CB-O 3.31Å; S1878-S2026 WeakPolarHBondContact CB-O 3.37Å; S1878-S2026 WeakPolarHBondContact CB-OG 3.17Å; S1878-S2026 PolarHBondContact O-OG 3.47Å; S1878-S2026 WeakPolarHBondContact OG-CB 3.22Å; S1878-S2026 PolarHBondContact OG-O 2.8Å; S1878-S2026 PolarHBondContact OG-OG 3.4Å; P2024-S2026 PolarHBondContact O-N 2.86Å; S2026-Q2028 VanDerWaalsContact C-N 3.32Å; S2026-Q2028 PolarHBondContact O-N 2.98Å
2027	D	27	Very low	40.3	Very low	129.6 Å²	129.6	99.6 Å²	99.6	69%	0.693	57%	0.568	S	S	*	*			trans	-81.4	99.2	173.3	-67.7	-24.9	0	0	0	110.1	K1880 V2025 T2029	K1880-D2027 IonicContact NZ-OD1 3.13Å; K1880-D2027 IonicContact NZ-OD2 2.82Å; K1880-D2027 PolarHBondContact NZ-OD2 2.95Å; V2025-D2027 VanDerWaalsContact C-N 3.34Å; V2025-D2027 HydrophobicContact CG1-CB 3.76Å; V2025-D2027 WeakPolarHBondContact CG1-OD2 3.43Å; V2025-D2027 PolarHBondContact O-N 2.99Å; D2027-T2029 VanDerWaalsContact C-N 3.29Å; D2027-T2029 PolarHBondContact O-N 3.49Å
2028	Q	28.3	Very low	38	Very low	162.4 Å²	162.4	100.1 Å²	100.1	76%	0.759	58%	0.584	S	S	*	*			trans	-124.9	114.6	164.7	-66.8	-170.9	6.9	0	0	111.6	S2026 G2030	S2026-Q2028 VanDerWaalsContact C-N 3.32Å; S2026-Q2028 PolarHBondContact O-N 2.98Å; Q2028-G2030 PolarHBondContact O-N 2.82Å
2029	T	27.2	Very low	36.3	Very low	123 Å²	123	104.9 Å²	104.9	76%	0.755	61%	0.607	S	S	*	*			trans	-81.2	133.2	159.3	37.2	0	0	0	0	111.5	D2027	D2027-T2029 VanDerWaalsContact C-N 3.29Å; D2027-T2029 PolarHBondContact O-N 3.49Å
2030	G	25.4	Very low	34.4	Very low	66.6 Å²	66.6	107.1 Å²	107.1	69%	0.687	63%	0.629	S	S	*	*			trans	-80.8	165.7	168.1	0	0	0	0	0	112.1	Q2028 S2032	Q2028-G2030 PolarHBondContact O-N 2.82Å; G2030-S2032 PolarHBondContact O-N 2.91Å; G2030-S2032 VanDerWaalsContact O-N 3.12Å
2031	P	30.1	Very low	32.6	Very low	127.6 Å²	127.6	112 Å²	112	83%	0.829	65%	0.65	S	S	*	*			trans	-99.1	157.8	145.1	34.3	-29.7	0	0	0	113.3
2032	S	25.4	Very low	30.8	Very low	91.6 Å²	91.6	117 Å²	117	64%	0.641	68%	0.675	S	S	*	*			trans	-37.4	128.3	157.2	66.5	0	0	0	0	114.3	G2030	G2030-S2032 PolarHBondContact O-N 2.91Å; G2030-S2032 VanDerWaalsContact O-N 3.12Å
2033	E	28.8	Very low	29.2	Very low	162 Å²	162	117.5 Å²	117.5	76%	0.757	69%	0.694	S	S	*	*			trans	-142	131.4	133	-91.1	-178.8	-178.8	0	0	113	V1476 I1477	V1476-E2033 HydrophobicContact CG1-CG 4.42Å; I1477-E2033 HydrophobicContact CB-CG 4.48Å; I1477-E2033 WeakPolarHBondContact CG1-OE1 3.41Å; I1477-E2033 PolarHBondContact N-OE1 2.79Å
2034	T	28.5	Very low	28.4	Very low	101.8 Å²	101.8	121.7 Å²	121.7	63%	0.625	71%	0.711	S	S	*	*			trans	18	145.8	159.9	59.4	0	0	0	0	116.4	E1479	E1479-T2034 HydrophobicContact CB-CG2 3.47Å; E1479-T2034 VanDerWaalsContact CB-CG2 3.47Å; E1479-T2034 HydrophobicContact CG-CG2 3.45Å; E1479-T2034 VanDerWaalsContact CG-CG2 3.45Å; E1479-T2034 WeakPolarHBondContact OE1-CA 3.47Å; E1479-T2034 WeakPolarHBondContact OE1-CB 3.25Å; E1479-T2034 VanDerWaalsContact OE1-CG2 3.3Å; E1479-T2034 WeakPolarHBondContact OE1-CG2 3.14Å
2035	N	26.6	Very low	27.7	Very low	152.6 Å²	152.6	126.1 Å²	126.1	82%	0.816	73%	0.731	S	S	*	*			trans	-160.1	132	148.7	-110.2	-21.2	0	0	0	114	K2037	N2035-K2037 PolarHBondContact O-N 3.01Å
2036	V	29	Very low	27.4	Very low	130.6 Å²	130.6	127.9 Å²	127.9	79%	0.792	74%	0.736	S	S	*	*			trans	-172.7	123	151.2	177.1	0	0	0	0	112	E1479 S2038	E1479-V2036 WeakPolarHBondContact OE1-CG2 3.24Å; V2036-S2038 PolarHBondContact O-N 3.48Å
2037	K	27.2	Very low	27.3	Very low	183.4 Å²	183.4	131.5 Å²	131.5	80%	0.797	75%	0.745	S	S	*	*			trans	-84.4	144.5	159.8	-70	-175.1	177.3	-172.7	0	112.7	N2035	N2035-K2037 PolarHBondContact O-N 3.01Å
2038	S	27.2	Very low	27.2	Very low	94.4 Å²	94.4	130 Å²	130	66%	0.66	74%	0.741	S	S	*	*				177.5	138	123.8	43.2	0	0	0	0	113.2	V2036	V2036-S2038 PolarHBondContact O-N 3.48Å
2039	D	27.6	Very low	27.1	Very low	148 Å²	148	132.7 Å²	132.7	79%	0.791	74%	0.744	S	S	*	*			trans	169.5	155.5	136.9	-67.4	-36.4	0	0	0	114.9
2040	A	27.2	Very low	27	Very low	88.4 Å²	88.4	135.4 Å²	135.4	73%	0.731	75%	0.745	S	S	*	*			trans	57.9	127.4	157.5	0	0	0	0	0	117.4
2041	E	27.2	Very low	27.1	Very low	166.8 Å²	166.8	138 Å²	138	78%	0.779	75%	0.748	S	S	*	*				113.4	137.6	58.7	-92	-178.6	-173.6	0	0	116.8
2042	N	27.9	Very low	26.9	Very low	152.4 Å²	152.4	137.8 Å²	137.8	82%	0.815	74%	0.744	S	S	*	*			trans	85.7	149.8	142	-61	-35.8	0	0	0	118.3
2043	G	26	Very low	27	Very low	68.4 Å²	68.4	143.7 Å²	143.7	71%	0.705	75%	0.752	S	S	*	*			trans	120.8	107.4	-179	0	0	0	0	0	113.3
2044	E	27.2	Very low	26.9	Very low	182.2 Å²	182.2	141.3 Å²	141.3	85%	0.851	75%	0.749	S	S	*	*				50.6	139.8	105.4	-60.4	-161.9	118.7	0	0	115
2045	L	25	Very low	26.9	Very low	137.6 Å²	137.6	141.8 Å²	141.8	72%	0.72	75%	0.752	S	S	*	*			cis	108.4	126.8	47.9	-123.9	127	0	0	0	114.3
2046	L	25.6	Very low	27	Very low	144 Å²	144	140.6 Å²	140.6	75%	0.754	75%	0.745	S	S	*	*			trans	28	137.2	155.6	-62.2	173	0	0	0	115.2
2047	E	28.2	Very low	27	Very low	148 Å²	148	141.4 Å²	141.4	69%	0.692	75%	0.745	S	S	*	*				174.7	158.1	77	-96.5	-153.9	-177.8	0	0	113.4	R2049	E2047-R2049 IonicContact OE2-CZ 3.02Å; E2047-R2049 IonicContact OE2-NE 2.7Å; E2047-R2049 IonicContact OE2-NH2 3.79Å; E2047-R2049 PolarHBondContact OE2-NH2 2.89Å
2048	T	25.1	Very low	27.1	Very low	99 Å²	99	136.1 Å²	136.1	61%	0.607	74%	0.743	S	S	*	*				-150	148.8	75.1	45.2	0	0	0	0	113.3
2049	R	25.7	Very low	27.2	Very low	218.2 Å²	218.2	135.9 Å²	135.9	82%	0.823	75%	0.747	S	S	*	*			trans	114.5	148.1	137.9	-88.5	165.8	178.1	-174.5	0.5	116.3	E2047	E2047-R2049 IonicContact OE2-CZ 3.02Å; E2047-R2049 IonicContact OE2-NE 2.7Å; E2047-R2049 IonicContact OE2-NH2 3.79Å; E2047-R2049 PolarHBondContact OE2-NH2 2.89Å
2050	K	26.3	Very low	27.3	Very low	179.4 Å²	179.4	136.8 Å²	136.8	78%	0.78	75%	0.752	S	S	*	*			trans	128.1	152.2	134.7	-90.3	175	-179.8	179.3	0	113
2051	V	26.7	Very low	27.5	Very low	122.6 Å²	122.6	136 Å²	136	74%	0.743	75%	0.753	S	S	*	*			trans	167.1	137.5	141.1	168.8	0	0	0	0	113.4
2052	V	27.3	Very low	27.6	Very low	122.4 Å²	122.4	136.7 Å²	136.7	74%	0.742	76%	0.756	S	S	*	*			trans	100.3	144	173.2	151.4	0	0	0	0	115.4
2053	R	27.1	Very low	27.7	Very low	214.6 Å²	214.6	136.3 Å²	136.3	81%	0.81	75%	0.753	S	S	*	*			trans	165.2	154.1	169.4	-114.2	175.5	-172.9	154.4	-1	115.6
2054	T	27.1	Very low	27.8	Very low	111.6 Å²	111.6	142.4 Å²	142.4	69%	0.685	76%	0.763	S	S	*	*			trans	45.2	155.4	132.5	41.7	0	0	0	0	119
2055	T	27	Very low	28	Very low	112.8 Å²	112.8	137.2 Å²	137.2	69%	0.692	76%	0.759	S	S	*	*				153.8	148.1	57.4	19.8	0	0	0	0	116.8
2056	N	28.8	Very low	28.3	Very low	127 Å²	127	138.2 Å²	138.2	68%	0.679	77%	0.765	S	S	*	*			trans	77.4	141.9	141.3	-72.9	42.9	0	0	0	122.7
2057	D	29.2	Very low	28.5	Very low	147.8 Å²	147.8	135 Å²	135	79%	0.79	76%	0.759	S	S	*	*			trans	104.5	149.1	132.6	-63	-28.3	0	0	0	116.1
2058	G	29.7	Very low	28.7	Very low	73.4 Å²	73.4	136.7 Å²	136.7	76%	0.757	76%	0.764	S	S	*	*			trans	161.4	158.3	168.4	0	0	0	0	0	111.7
2059	A	29.1	Very low	28.8	Very low	89.6 Å²	89.6	135.4 Å²	135.4	74%	0.74	77%	0.77	S	S	*	*			trans	95	159.9	139.4	0	0	0	0	0	115.6
2060	D	30.2	Very low	29.1	Very low	167 Å²	167	133.8 Å²	133.8	89%	0.893	77%	0.772	S	S	*	*				154.9	153.3	-50.5	-79.1	-28.7	0	0	0	113
2061	G	31.2	Very low	29.2	Very low	72.2 Å²	72.2	130.7 Å²	130.7	74%	0.744	77%	0.77	S	S	*	*			trans	126.4	112.9	167.7	0	0	0	0	0	116.5
2062	E	28.7	Very low	29.4	Very low	180.2 Å²	180.2	130.8 Å²	130.8	84%	0.842	77%	0.773	S	S	*	*				41.3	141.2	129.6	-64.3	-173.1	154	0	0	116.9
2063	N	30.7	Very low	29.4	Very low	143.8 Å²	143.8	134.7 Å²	134.7	77%	0.769	78%	0.78	S	S	*	*			trans	85.5	130.6	146.2	-68.2	-41.3	0	0	0	119.4
2064	E	28.7	Very low	29.3	Very low	196.6 Å²	196.6	133.5 Å²	133.5	92%	0.919	79%	0.786	S	S	*	*			trans	57.6	142.6	141.1	-64.5	-167.4	153.7	0	0	117.2
2065	G	29.8	Very low	29.2	Very low	73.4 Å²	73.4	132.9 Å²	132.9	76%	0.757	79%	0.786	S	S	*	*			trans	167	132.9	176.9	0	0	0	0	0	115.2
2066	D	31.2	Very low	29.3	Very low	159.6 Å²	159.6	132 Å²	132	85%	0.853	78%	0.782	S	S	*	*			trans	-82.1	151.1	179.1	-99.4	-52.2	0	0	0	116.3	R1828	R1828-D2066 PolarHBondContact NH1-O 3.4Å; R1828-D2066 PolarHBondContact NH2-O 2.78Å
2067	A	30.7	Very low	29.3	Very low	74.8 Å²	74.8	134.4 Å²	134.4	62%	0.618	79%	0.787	S	S	*	*			trans	160.3	137	155.1	0	0	0	0	0	117.2	R1828	R1828-A2067 PolarHBondContact NE-O 3.27Å; R1828-A2067 PolarHBondContact NH2-O 2.81Å
2068	K	31.9	Very low	29.3	Very low	184.4 Å²	184.4	135 Å²	135	80%	0.802	78%	0.779	S	S	*	*			trans	107.9	121.7	144.7	-71.5	174.9	-176	-171.6	0	115.5	L1829 E1831	L1829-K2068 HydrophobicContact CB-CD 3.98Å; L1829-K2068 HydrophobicContact CD1-CD 4.33Å; E1831-K2068 IonicContact OE1-NZ 2.63Å; E1831-K2068 PolarHBondContact OE1-NZ 3.35Å; E1831-K2068 IonicContact OE2-NZ 3.9Å; E1831-K2068 PolarHBondContact OE2-NZ 2.72Å
2069	G	27.8	Very low	29.3	Very low	71.4 Å²	71.4	138.3 Å²	138.3	74%	0.736	78%	0.775	S	S	*	*			trans	-178.5	119.2	149.9	0	0	0	0	0	116.8
2070	H	30.8	Very low	29.6	Very low	186 Å²	186	136.2 Å²	136.2	86%	0.861	75%	0.754	S	S	*	*			trans	-113.2	145	171	-80.6	1.2	0	0	0	111.5
2071	P	30.4	Very low	30.2	Very low	114.4 Å²	114.4	132 Å²	132	74%	0.743	74%	0.743	S	S	*	*			trans	-92	148.9	175.6	33.9	-32.6	0	0	0	112.9	K2073	P2071-K2073 PolarHBondContact O-N 2.95Å
2072	P	29.3	Very low	30.7	Very low	123.2 Å²	123.2	131.2 Å²	131.2	80%	0.8	72%	0.722	S	S	*	*			trans	-83.3	128.3	-178.6	29.8	-28.1	0	0	0	111.5	M2074	P2072-M2074 PolarHBondContact O-N 3.01Å
2073	K	28.3	Very low	31.6	Very low	204.2 Å²	204.2	129.6 Å²	129.6	89%	0.888	71%	0.708	S	S	*	*			trans	-61.5	111.5	175.9	-69.7	175.9	178	173.7	0	112.8	P2071 S2075	P2071-K2073 PolarHBondContact O-N 2.95Å; K2073-S2075 VanDerWaalsContact C-N 3.31Å; K2073-S2075 PolarHBondContact O-N 3.26Å
2074	M	25.4	Very low	32.8	Very low	190.2 Å²	190.2	126.4 Å²	126.4	94%	0.937	69%	0.687	S	S	*	*			trans	-77.8	131.2	159.7	-88.3	-171.6	169.7	0	0	110.3	P2072	P2072-M2074 PolarHBondContact O-N 3.01Å
2075	S	25.1	Very low	34.1	Very low	98.2 Å²	98.2	117.7 Å²	117.7	69%	0.687	65%	0.647	S	S	*	*			trans	-123.6	138	169.7	34.5	0	0	0	0	110.1	K2073 K2077	K2073-S2075 VanDerWaalsContact C-N 3.31Å; K2073-S2075 PolarHBondContact O-N 3.26Å; S2075-K2077 PolarHBondContact O-N 2.87Å
2076	P	28.6	Very low	35.6	Very low	94.8 Å²	94.8	117.6 Å²	117.6	62%	0.616	63%	0.628	S	S	*	*			trans	-73.6	136.7	-169.9	0.1	7	0	0	0	112.7	S1478 Y2078	S1478-P2076 PolarHBondContact OG-O 2.89Å; P2076-Y2078 HydrophobicContact CB-CD2 4.23Å; P2076-Y2078 HydrophobicContact CB-CE2 4.04Å; P2076-Y2078 HydrophobicContact CG-CE2 4.15Å; P2076-Y2078 VanDerWaalsContact O-CD2 3.32Å; P2076-Y2078 WeakPolarHBondContact O-CD2 3.39Å; P2076-Y2078 PolarHBondContact O-N 2.97Å; P2076-Y2078 VanDerWaalsContact O-N 3.11Å
2077	K	27.6	Very low	36.8	Very low	178 Å²	178	111.1 Å²	111.1	77%	0.774	59%	0.594	S	S	*	*			trans	-82.5	110.9	170.2	-78.5	-179.7	175.2	177	0	109.7	S1478 S2075 E2079	S1478-K2077 WeakPolarHBondContact OG-CG 3.29Å; S2075-K2077 PolarHBondContact O-N 2.87Å; K2077-E2079 VanDerWaalsContact C-N 3.34Å; K2077-E2079 HydrophobicContact CB-CG 4.49Å; K2077-E2079 PolarHBondContact O-N 3.03Å
2078	Y	30.5	Very low	38.4	Very low	160 Å²	160	112.4 Å²	112.4	63%	0.627	59%	0.586	S	S	*	*			trans	-86.5	110.4	167.9	-73.8	-85.6	0	0	0	110.4	E1480 P2076 S2080	E1480-Y2078 VanDerWaalsContact CD-CD2 3.43Å; E1480-Y2078 HydrophobicContact CG-CD2 3.24Å; E1480-Y2078 HydrophobicContact CG-CE2 3.75Å; E1480-Y2078 HydrophobicContact CG-CG 3.81Å; E1480-Y2078 WeakPolarHBondContact OE1-CD2 3.26Å; E1480-Y2078 WeakPolarHBondContact OE1-CE2 3.43Å; P2076-Y2078 HydrophobicContact CB-CD2 4.23Å; P2076-Y2078 HydrophobicContact CB-CE2 4.04Å; P2076-Y2078 HydrophobicContact CG-CE2 4.15Å; P2076-Y2078 VanDerWaalsContact O-CD2 3.32Å; P2076-Y2078 WeakPolarHBondContact O-CD2 3.39Å; P2076-Y2078 PolarHBondContact O-N 2.97Å; P2076-Y2078 VanDerWaalsContact O-N 3.11Å; Y2078-S2080 VanDerWaalsContact C-N 3.28Å; Y2078-S2080 PolarHBondContact O-N 2.98Å
2079	E	30	Very low	40.2	Very low	143.2 Å²	143.2	104.6 Å²	104.6	67%	0.669	55%	0.553	S	S	*	*			trans	-91.1	113.8	173.6	-66.2	-160.7	157.9	0	0	110.8	P1475 K2077 A2081 R2083	P1475-E2079 WeakPolarHBondContact CB-OE2 3.48Å; P1475-E2079 WeakPolarHBondContact CG-OE1 3.19Å; P1475-E2079 VanDerWaalsContact CG-OE2 3.32Å; P1475-E2079 WeakPolarHBondContact CG-OE2 3.06Å; K2077-E2079 VanDerWaalsContact C-N 3.34Å; K2077-E2079 HydrophobicContact CB-CG 4.49Å; K2077-E2079 PolarHBondContact O-N 3.03Å; E2079-A2081 PolarHBondContact O-N 3.19Å; E2079-A2081 VanDerWaalsContact O-N 3.09Å; E2079-R2083 IonicContact OE1-CZ 3.76Å; E2079-R2083 IonicContact OE1-NH1 2.74Å; E2079-R2083 IonicContact OE1-NH2 3.89Å; E2079-R2083 PolarHBondContact OE1-NH2 2.98Å; E2079-R2083 IonicContact OE2-CZ 3.24Å; E2079-R2083 IonicContact OE2-NH2 3.16Å; E2079-R2083 PolarHBondContact OE2-NH2 3.04Å
2080	S	35.4	Very low	42.6	Very low	43.8 Å²	43.8	106.8 Å²	106.8	31%	0.306	54%	0.542	S	S	.	.			trans	-93.9	117	170.3	109.1	0	0	0	0	109.6	Y2078 L2082 R2083 Q2104	Y2078-S2080 VanDerWaalsContact C-N 3.28Å; Y2078-S2080 PolarHBondContact O-N 2.98Å; S2080-L2082 VanDerWaalsContact C-N 3.26Å; S2080-L2082 PolarHBondContact O-N 3.14Å; S2080-L2082 VanDerWaalsContact O-N 3.12Å; S2080-R2083 WeakPolarHBondContact O-CG 3.48Å; S2080-R2083 PolarHBondContact O-NH2 2.81Å; S2080-R2083 VanDerWaalsContact O-NH2 3.16Å; S2080-Q2104 PolarHBondContact OG-NE2 3.22Å
2081	A	41.8	Very low	44.7	Very low	79.6 Å²	79.6	98.3 Å²	98.3	66%	0.658	50%	0.503	S	S	*	.	S	Bend	trans	-60.8	-33.7	-174.6	0	0	0	0	0	113.5	F1882 E2079 R2083	F1882-A2081 HydrophobicContact CE2-CB 4.47Å; F1882-A2081 HydrophobicContact CZ-CB 4.19Å; E2079-A2081 PolarHBondContact O-N 3.19Å; E2079-A2081 VanDerWaalsContact O-N 3.09Å; A2081-R2083 WeakPolarHBondContact O-CG 3.44Å; A2081-R2083 PolarHBondContact O-N 2.96Å; A2081-R2083 VanDerWaalsContact O-N 3.13Å; A2081-R2083 PolarHBondContact O-NE 3.3Å
2082	L	41.9	Very low	46.8	Very low	56.2 Å²	56.2	98.2 Å²	98.2	29%	0.294	49%	0.491	S	S	.	.			trans	-79.6	95.4	-179	-156.4	89	0	0	0	111.1	F1882 S2080 I2085 M2102 I2155	F1882-L2082 HydrophobicContact CD1-CB 4.11Å; F1882-L2082 HydrophobicContact CD1-CD2 4.17Å; F1882-L2082 HydrophobicContact CE1-CB 3.69Å; F1882-L2082 HydrophobicContact CZ-CB 4Å; S2080-L2082 VanDerWaalsContact C-N 3.26Å; S2080-L2082 PolarHBondContact O-N 3.14Å; S2080-L2082 VanDerWaalsContact O-N 3.12Å; L2082-I2085 HydrophobicContact CD2-CD1 3.9Å; L2082-I2085 HydrophobicContact CD2-CG1 4.12Å; L2082-M2102 HydrophobicContact CD1-CE 4.3Å; L2082-M2102 HydrophobicContact CD2-CE 3.92Å; L2082-M2102 VanDerWaalsContact CD2-CE 3.48Å; L2082-M2102 HydrophobicContact CD2-SD 3.77Å; L2082-M2102 WeakPolarHBondContact CD2-SD 3.21Å; L2082-I2155 HydrophobicContact CB-CD1 4.32Å; L2082-I2155 HydrophobicContact CD2-CD1 3.79Å; L2082-I2155 HydrophobicContact CD2-CG1 4.37Å; L2082-I2155 HydrophobicContact CG-CD1 4.22Å; L2082-I2155 VanDerWaalsContact O-CB 3.28Å; L2082-I2155 WeakPolarHBondContact O-CB 3.34Å; L2082-I2155 WeakPolarHBondContact O-CD1 3.24Å; L2082-I2155 VanDerWaalsContact O-CG1 3.27Å; L2082-I2155 WeakPolarHBondContact O-CG1 3.47Å; L2082-I2155 WeakPolarHBondContact O-CG2 3.5Å
2083	R	48.9	Very low	49.1	Very low	145.8 Å²	145.8	97.7 Å²	97.7	55%	0.55	49%	0.488	S	S	*	.			trans	-87.1	-22.6	-177.5	-61.8	-156.8	-178.3	-158.7	1.9	115.1	E2079 S2080 A2081 I2155	E2079-R2083 IonicContact OE1-CZ 3.76Å; E2079-R2083 IonicContact OE1-NH1 2.74Å; E2079-R2083 IonicContact OE1-NH2 3.89Å; E2079-R2083 PolarHBondContact OE1-NH2 2.98Å; E2079-R2083 IonicContact OE2-CZ 3.24Å; E2079-R2083 IonicContact OE2-NH2 3.16Å; E2079-R2083 PolarHBondContact OE2-NH2 3.04Å; S2080-R2083 WeakPolarHBondContact O-CG 3.48Å; S2080-R2083 PolarHBondContact O-NH2 2.81Å; S2080-R2083 VanDerWaalsContact O-NH2 3.16Å; A2081-R2083 WeakPolarHBondContact O-CG 3.44Å; A2081-R2083 PolarHBondContact O-N 2.96Å; A2081-R2083 VanDerWaalsContact O-N 3.13Å; A2081-R2083 PolarHBondContact O-NE 3.3Å; R2083-I2155 PolarHBondContact O-N 3.12Å
2084	K	54.4	Low	51.6	Low	77 Å²	77	93.2 Å²	93.2	34%	0.335	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	142.6	-174.6	-167.4	175.6	-178.1	135.1	0	112.2	I2086 T2152 G2153 N2154 D2163	K2084-I2086 HydrophobicContact CD-CD1 4.29Å; K2084-I2086 HydrophobicContact CD-CG1 4.36Å; K2084-I2086 HydrophobicContact CG-CG1 4.3Å; K2084-T2152 HydrophobicContact CD-CG2 4.42Å; K2084-T2152 VanDerWaalsContact CE-CG2 3.48Å; K2084-T2152 HydrophobicContact CG-CG2 4.38Å; K2084-G2153 CarbonylContact C-O 3.56Å; K2084-G2153 WeakPolarHBondContact CA-O 3.42Å; K2084-G2153 WeakPolarHBondContact CG-O 3.39Å; K2084-N2154 PolarHBondContact NZ-OD1 2.82Å; K2084-D2163 IonicContact NZ-OD2 3.58Å; K2084-D2163 PolarHBondContact NZ-OD2 3.29Å
2085	I	56	Low	54.2	Low	13.6 Å²	13.6	85.2 Å²	85.2	7%	0.07	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	132.6	169.9	-58.5	152.4	0	0	0	108.3	L2082 T2087 M2102 W2110 T2152 G2153 I2155 I2160	L2082-I2085 HydrophobicContact CD2-CD1 3.9Å; L2082-I2085 HydrophobicContact CD2-CG1 4.12Å; I2085-T2087 HydrophobicContact CG2-CG2 4.27Å; I2085-T2087 WeakPolarHBondContact CG2-OG1 3.46Å; I2085-M2102 HydrophobicContact CD1-CE 3.67Å; I2085-M2102 VanDerWaalsContact CD1-CE 3.47Å; I2085-M2102 HydrophobicContact CD1-SD 4.16Å; I2085-M2102 HydrophobicContact CG1-CE 3.85Å; I2085-M2102 HydrophobicContact CG1-SD 4.13Å; I2085-M2102 HydrophobicContact CG2-CE 4.4Å; I2085-M2102 HydrophobicContact CG2-SD 4.01Å; I2085-W2110 HydrophobicContact CD1-CH2 4.07Å; I2085-W2110 HydrophobicContact CD1-CZ2 3.67Å; I2085-T2152 VanDerWaalsContact O-CA 3.31Å; I2085-T2152 WeakPolarHBondContact O-CA 3.25Å; I2085-T2152 WeakPolarHBondContact O-CG2 3.29Å; I2085-G2153 PolarHBondContact N-O 2.94Å; I2085-G2153 PolarHBondContact O-N 3.12Å; I2085-G2153 VanDerWaalsContact O-N 3.1Å; I2085-I2155 HydrophobicContact CD1-CD1 3.96Å; I2085-I2155 HydrophobicContact CD1-CG1 4.02Å; I2085-I2155 HydrophobicContact CG1-CD1 4.24Å; I2085-I2160 HydrophobicContact CD1-CD1 3.56Å; I2085-I2160 VanDerWaalsContact CD1-CD1 3.45Å; I2085-I2160 HydrophobicContact CD1-CG1 3.98Å
2086	I	60.8	Low	56.8	Low	72 Å²	72	88.4 Å²	88.4	37%	0.369	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	116.3	165	-52.5	176.7	0	0	0	106	F1884 K2084 T2152	F1884-I2086 PolarHBondContact N-O 2.74Å; K2084-I2086 HydrophobicContact CD-CD1 4.29Å; K2084-I2086 HydrophobicContact CD-CG1 4.36Å; K2084-I2086 HydrophobicContact CG-CG1 4.3Å; I2086-T2152 HydrophobicContact CG1-CG2 4.25Å
2087	T	58	Low	59.6	Low	23 Å²	23	87 Å²	87	14%	0.141	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	138.1	178.4	-160.3	0	0	0	0	110.2	Q1894 I2085 I2089 L2100 L2151	Q1894-T2087 PolarHBondContact O-OG1 2.84Å; I2085-T2087 HydrophobicContact CG2-CG2 4.27Å; I2085-T2087 WeakPolarHBondContact CG2-OG1 3.46Å; T2087-I2089 HydrophobicContact CG2-CD1 4.3Å; T2087-I2089 HydrophobicContact CG2-CG1 4.18Å; T2087-L2100 HydrophobicContact CG2-CD2 3.91Å; T2087-L2151 HydrophobicContact CG2-CB 3.96Å; T2087-L2151 HydrophobicContact CG2-CD2 4.26Å; T2087-L2151 HydrophobicContact CG2-CG 4.43Å; T2087-L2151 PolarHBondContact N-O 3Å; T2087-L2151 PolarHBondContact O-N 2.82Å; T2087-L2151 VanDerWaalsContact O-O 3.07Å
2088	K	64.3	Low	62.2	Low	100.6 Å²	100.6	79.5 Å²	79.5	44%	0.437	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	125.8	175.2	179.4	169.9	-71.7	-155.4	0	108.9	E2148 F2149 D2150	K2088-E2148 HydrophobicContact CD-CG 4.18Å; K2088-E2148 VanDerWaalsContact CD-OE1 3.26Å; K2088-E2148 WeakPolarHBondContact CD-OE1 3.3Å; K2088-E2148 WeakPolarHBondContact CE-OE1 3.43Å; K2088-E2148 HydrophobicContact CG-CG 4.11Å; K2088-E2148 IonicContact NZ-OE1 3.22Å; K2088-E2148 PolarHBondContact NZ-OE1 3.1Å; K2088-F2149 WeakPolarHBondContact CA-O 3.15Å; K2088-D2150 WeakPolarHBondContact CB-OD1 3.26Å; K2088-D2150 VanDerWaalsContact CE-OD1 3.26Å; K2088-D2150 WeakPolarHBondContact CE-OD1 3.36Å; K2088-D2150 WeakPolarHBondContact CG-OD1 3.25Å; K2088-D2150 IonicContact NZ-OD1 2.67Å; K2088-D2150 IonicContact NZ-OD2 3.46Å
2089	I	69.9	Low	64.6	Low	21.8 Å²	21.8	75.2 Å²	75.2	11%	0.112	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	127	-175.8	-58.9	177.3	0	0	0	108.2	T2087 L2091 F2098 L2100 E2148 F2149 L2151	T2087-I2089 HydrophobicContact CG2-CD1 4.3Å; T2087-I2089 HydrophobicContact CG2-CG1 4.18Å; I2089-L2091 HydrophobicContact CG2-CD2 4Å; I2089-F2098 HydrophobicContact CD1-CE2 4.18Å; I2089-L2100 HydrophobicContact CD1-CD2 4.42Å; I2089-E2148 CarbonylContact O-C 3.53Å; I2089-E2148 VanDerWaalsContact O-CA 3.29Å; I2089-E2148 WeakPolarHBondContact O-CA 3.28Å; I2089-F2149 HydrophobicContact CB-CD1 4.27Å; I2089-F2149 HydrophobicContact CB-CE1 3.7Å; I2089-F2149 HydrophobicContact CB-CE2 4.14Å; I2089-F2149 HydrophobicContact CB-CZ 3.62Å; I2089-F2149 HydrophobicContact CD1-CE2 4.03Å; I2089-F2149 HydrophobicContact CD1-CZ 3.83Å; I2089-F2149 HydrophobicContact CG1-CE2 4.47Å; I2089-F2149 HydrophobicContact CG1-CZ 4.25Å; I2089-F2149 HydrophobicContact CG2-CD1 4.48Å; I2089-F2149 HydrophobicContact CG2-CE1 3.64Å; I2089-F2149 HydrophobicContact CG2-CZ 3.72Å; I2089-F2149 PolarHBondContact N-O 3.13Å; I2089-F2149 WeakPolarHBondContact O-CD1 3.41Å; I2089-F2149 PolarHBondContact O-N 2.93Å; I2089-L2151 HydrophobicContact CD1-CB 4.09Å; I2089-L2151 HydrophobicContact CD1-CD2 3.87Å; I2089-L2151 HydrophobicContact CD1-CG 4.5Å
2090	K	76.6	Confident	66.7	Low	116.6 Å²	116.6	69.6 Å²	69.6	51%	0.507	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	115.8	169.5	-172	179.6	-174.3	152.7	0	109.2	Y2015 Q2147 E2148	Y2015-K2090 WeakPolarHBondContact OH-CD 3.45Å; K2090-Q2147 WeakPolarHBondContact CA-O 3.21Å; K2090-E2148 HydrophobicContact CB-CB 4.37Å; K2090-E2148 HydrophobicContact CB-CG 4.21Å; K2090-E2148 WeakPolarHBondContact CD-OE2 3.47Å; K2090-E2148 HydrophobicContact CG-CB 4.23Å; K2090-E2148 HydrophobicContact CG-CG 4.25Å; K2090-E2148 IonicContact NZ-OE2 2.82Å; K2090-E2148 PolarHBondContact NZ-OE2 3.06Å
2091	L	76.7	Confident	68.5	Low	8 Å²	8	74 Å²	74	4%	0.042	37%	0.371	C	S	.	.			trans	-75.9	149.5	176.1	-56.2	176.1	0	0	0	109.6	I2089 T2095 F2098 L2116 L2143 A2144 G2146 Q2147 F2149	I2089-L2091 HydrophobicContact CG2-CD2 4Å; L2091-T2095 HydrophobicContact CD2-CG2 4.32Å; L2091-F2098 HydrophobicContact CD1-CD1 4.35Å; L2091-F2098 HydrophobicContact CD1-CE1 4.21Å; L2091-F2098 HydrophobicContact CD2-CB 4.29Å; L2091-F2098 HydrophobicContact CD2-CD1 3.54Å; L2091-F2098 VanDerWaalsContact CD2-CD1 3.44Å; L2091-F2098 HydrophobicContact CD2-CE1 4.06Å; L2091-F2098 HydrophobicContact CD2-CG 4.03Å; L2091-L2116 HydrophobicContact CD1-CD1 3.94Å; L2091-L2116 HydrophobicContact CD1-CD2 4.07Å; L2091-L2143 HydrophobicContact CD1-CB 4.2Å; L2091-L2143 HydrophobicContact CD1-CD1 4.39Å; L2091-A2144 WeakPolarHBondContact CD1-O 3.38Å; L2091-G2146 CarbonylContact O-C 3.55Å; L2091-G2146 WeakPolarHBondContact O-CA 3.3Å; L2091-G2146 PolarHBondContact O-N 2.84Å; L2091-Q2147 PolarHBondContact N-O 3.04Å; L2091-F2149 HydrophobicContact CD1-CE1 4.08Å; L2091-F2149 HydrophobicContact CD2-CE1 4.17Å; L2091-F2149 HydrophobicContact CG-CE1 3.97Å
2092	K	73.8	Confident	69.7	Low	112.8 Å²	112.8	71.8 Å²	71.8	49%	0.49	35%	0.348	S	S	.	.			trans	-76.5	157	168.2	-63.2	-170.4	176.3	179.4	0	110.8	D1890 D2094 T2095 A2145 G2146	D1890-K2092 HydrophobicContact CB-CD 3.61Å; D1890-K2092 HydrophobicContact CB-CG 4.27Å; D1890-K2092 VanDerWaalsContact O-CE 3.27Å; D1890-K2092 WeakPolarHBondContact O-CE 3.22Å; D1890-K2092 IonicContact OD1-NZ 2.69Å; K2092-D2094 WeakPolarHBondContact CB-OD1 3.41Å; K2092-D2094 VanDerWaalsContact CD-OD1 3.27Å; K2092-D2094 WeakPolarHBondContact CD-OD1 3.22Å; K2092-D2094 WeakPolarHBondContact CD-OD2 3.28Å; K2092-D2094 IonicContact NZ-OD1 3.81Å; K2092-D2094 IonicContact NZ-OD2 2.65Å; K2092-D2094 PolarHBondContact NZ-OD2 2.78Å; K2092-D2094 PolarHBondContact O-N 3.01Å; K2092-D2094 VanDerWaalsContact O-N 3.15Å; K2092-T2095 WeakPolarHBondContact CA-OG1 3.31Å; K2092-T2095 WeakPolarHBondContact CB-OG1 3.4Å; K2092-T2095 PolarHBondContact N-OG1 3.07Å; K2092-T2095 WeakPolarHBondContact O-CB 3.4Å; K2092-T2095 PolarHBondContact O-N 2.95Å; K2092-T2095 VanDerWaalsContact O-N 3.13Å; K2092-T2095 PolarHBondContact O-OG1 3.08Å; K2092-A2145 CarbonylContact O-C 3.52Å; K2092-A2145 WeakPolarHBondContact O-CB 3.17Å; K2092-G2146 VanDerWaalsContact C-N 3.31Å; K2092-G2146 PolarHBondContact O-N 3.14Å
2093	P	77.6	Confident	70.7	Confident	113.2 Å²	113.2	75.6 Å²	75.6	74%	0.735	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-21.9	177	-25.2	35.8	0	0	0	115.4	A2145	P2093-A2145 VanDerWaalsContact O-CB 3.24Å; P2093-A2145 WeakPolarHBondContact O-CB 3.31Å
2094	D	80.9	Confident	71.1	Confident	109.8 Å²	109.8	70.9 Å²	70.9	59%	0.587	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	3.5	-179.2	61	-40.2	0	0	0	114.1	K2092 K2096	K2092-D2094 WeakPolarHBondContact CB-OD1 3.41Å; K2092-D2094 VanDerWaalsContact CD-OD1 3.27Å; K2092-D2094 WeakPolarHBondContact CD-OD1 3.22Å; K2092-D2094 WeakPolarHBondContact CD-OD2 3.28Å; K2092-D2094 IonicContact NZ-OD1 3.81Å; K2092-D2094 IonicContact NZ-OD2 2.65Å; K2092-D2094 PolarHBondContact NZ-OD2 2.78Å; K2092-D2094 PolarHBondContact O-N 3.01Å; K2092-D2094 VanDerWaalsContact O-N 3.15Å; D2094-K2096 PolarHBondContact O-N 3.33Å
2095	T	79.1	Confident	70.9	Confident	22.2 Å²	22.2	73.2 Å²	73.2	14%	0.136	36%	0.36	C	S	.	.			trans	-66	121.9	-173.1	-49.9	0	0	0	0	112	L2091 K2092 S2097 L2116	L2091-T2095 HydrophobicContact CD2-CG2 4.32Å; K2092-T2095 WeakPolarHBondContact CA-OG1 3.31Å; K2092-T2095 WeakPolarHBondContact CB-OG1 3.4Å; K2092-T2095 PolarHBondContact N-OG1 3.07Å; K2092-T2095 WeakPolarHBondContact O-CB 3.4Å; K2092-T2095 PolarHBondContact O-N 2.95Å; K2092-T2095 VanDerWaalsContact O-N 3.13Å; K2092-T2095 PolarHBondContact O-OG1 3.08Å; T2095-S2097 VanDerWaalsContact CG2-O 3.3Å; T2095-S2097 WeakPolarHBondContact CG2-O 3.42Å; T2095-L2116 HydrophobicContact CG2-CD1 3.65Å; T2095-L2116 VanDerWaalsContact O-CD1 3.29Å; T2095-L2116 WeakPolarHBondContact O-CD1 3.32Å
2096	K	81.2	Confident	70.8	Confident	165 Å²	165	77 Å²	77	72%	0.717	39%	0.388	S	S	*	.	S	Bend	trans	-95.4	-31.8	171.9	-62.4	-176.9	-178.1	179.7	0	112.9	D2094 L2116 P2117	D2094-K2096 PolarHBondContact O-N 3.33Å; K2096-L2116 WeakPolarHBondContact O-CB 3.33Å; K2096-L2116 PolarHBondContact O-N 3.21Å; K2096-P2117 WeakPolarHBondContact O-CD 3.37Å
2097	S	86.8	Confident	70.6	Confident	65 Å²	65	75.7 Å²	75.7	46%	0.455	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	162.1	173.8	58.3	0	0	0	0	110.9	T2095 V2114	T2095-S2097 VanDerWaalsContact CG2-O 3.3Å; T2095-S2097 WeakPolarHBondContact CG2-O 3.42Å; S2097-V2114 CarbonylContact C-O 3.56Å; S2097-V2114 WeakPolarHBondContact CA-O 3.37Å; S2097-V2114 WeakPolarHBondContact CB-O 3.28Å
2098	F	82.4	Confident	70.6	Confident	21 Å²	21	77.3 Å²	77.3	9%	0.092	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	150.7	168.1	73.2	-91.6	0	0	0	111.1	I2089 L2091 L2112 V2114 L2116 W2121 L2143 F2149	I2089-F2098 HydrophobicContact CD1-CE2 4.18Å; L2091-F2098 HydrophobicContact CD1-CD1 4.35Å; L2091-F2098 HydrophobicContact CD1-CE1 4.21Å; L2091-F2098 HydrophobicContact CD2-CB 4.29Å; L2091-F2098 HydrophobicContact CD2-CD1 3.54Å; L2091-F2098 VanDerWaalsContact CD2-CD1 3.44Å; L2091-F2098 HydrophobicContact CD2-CE1 4.06Å; L2091-F2098 HydrophobicContact CD2-CG 4.03Å; F2098-L2112 HydrophobicContact CE2-CD2 4.46Å; F2098-V2114 HydrophobicContact CD1-CB 3.87Å; F2098-V2114 HydrophobicContact CD1-CG1 4.2Å; F2098-V2114 HydrophobicContact CD2-CB 4.42Å; F2098-V2114 HydrophobicContact CE1-CB 3.49Å; F2098-V2114 VanDerWaalsContact CE1-CB 3.47Å; F2098-V2114 HydrophobicContact CE1-CG1 3.57Å; F2098-V2114 VanDerWaalsContact CE1-CG1 3.49Å; F2098-V2114 HydrophobicContact CE1-CG2 3.91Å; F2098-V2114 HydrophobicContact CE2-CB 4.15Å; F2098-V2114 HydrophobicContact CE2-CG2 3.86Å; F2098-V2114 HydrophobicContact CG-CB 4.37Å; F2098-V2114 HydrophobicContact CZ-CB 3.63Å; F2098-V2114 HydrophobicContact CZ-CG1 4Å; F2098-V2114 HydrophobicContact CZ-CG2 3.49Å; F2098-V2114 VanDerWaalsContact CZ-CG2 3.47Å; F2098-V2114 PolarHBondContact N-O 3.08Å; F2098-V2114 PolarHBondContact O-N 2.93Å; F2098-L2116 HydrophobicContact CD1-CD1 4.46Å; F2098-L2116 HydrophobicContact CD1-CD2 4.38Å; F2098-L2116 HydrophobicContact CD1-CG 4.49Å; F2098-L2116 HydrophobicContact CE1-CD2 4.27Å; F2098-W2121 HydrophobicContact CZ-CH2 4.33Å; F2098-L2143 HydrophobicContact CE1-CD1 3.82Å; F2098-L2143 HydrophobicContact CZ-CD1 4.18Å; F2098-F2149 HydrophobicContact CE1-CE1 4.44Å; F2098-F2149 AromaticContact CE1-CZ 3.91Å; F2098-F2149 HydrophobicContact CE1-CZ 3.99Å; F2098-F2149 HydrophobicContact CE2-CZ 4.29Å; F2098-F2149 HydrophobicContact CZ-CE1 4.4Å; F2098-F2149 HydrophobicContact CZ-CE2 4.38Å; F2098-F2149 AromaticContact CZ-CZ 3.6Å; F2098-F2149 HydrophobicContact CZ-CZ 3.6Å
2099	V	80.4	Confident	70.8	Confident	69.2 Å²	69.2	72.8 Å²	72.8	42%	0.419	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	125.1	179	-176.9	0	0	0	0	109	R2101 Q2111 L2112 D2113	V2099-R2101 HydrophobicContact CG1-CG 4.26Å; V2099-Q2111 VanDerWaalsContact CG1-CD 3.43Å; V2099-Q2111 HydrophobicContact CG1-CG 3.5Å; V2099-Q2111 VanDerWaalsContact CG1-CG 3.45Å; V2099-L2112 CarbonylContact C-O 3.55Å; V2099-L2112 WeakPolarHBondContact CA-O 3.29Å; V2099-D2113 WeakPolarHBondContact CG1-OD1 3.16Å; V2099-D2113 HydrophobicContact CG2-CB 4.32Å; V2099-D2113 WeakPolarHBondContact CG2-OD1 3.3Å
2100	L	74	Confident	71	Confident	25.2 Å²	25.2	72.2 Å²	72.2	13%	0.132	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	114.3	171.2	-178.9	67.2	0	0	0	108.5	F1884 Y1895 T2087 I2089 W2110 Q2111 L2112 L2151	F1884-L2100 HydrophobicContact CE1-CD1 4.41Å; F1884-L2100 HydrophobicContact CE2-CD1 3.9Å; F1884-L2100 HydrophobicContact CZ-CD1 3.59Å; Y1895-L2100 VanDerWaalsContact OH-CD1 3.23Å; Y1895-L2100 WeakPolarHBondContact OH-CD1 3.34Å; T2087-L2100 HydrophobicContact CG2-CD2 3.91Å; I2089-L2100 HydrophobicContact CD1-CD2 4.42Å; L2100-W2110 HydrophobicContact CD2-CH2 3.82Å; L2100-W2110 HydrophobicContact CD2-CZ3 4.23Å; L2100-W2110 HydrophobicContact CG-CH2 4.08Å; L2100-W2110 HydrophobicContact CG-CZ3 4.3Å; L2100-Q2111 CarbonylContact O-C 3.54Å; L2100-Q2111 VanDerWaalsContact O-CA 3.31Å; L2100-Q2111 WeakPolarHBondContact O-CA 3.25Å; L2100-L2112 HydrophobicContact CB-CB 4.44Å; L2100-L2112 PolarHBondContact N-O 2.88Å; L2100-L2112 PolarHBondContact O-N 2.91Å; L2100-L2151 HydrophobicContact CD2-CD2 3.48Å; L2100-L2151 VanDerWaalsContact CD2-CD2 3.47Å
2101	R	74.3	Confident	71.1	Confident	136.8 Å²	136.8	68.2 Å²	68.2	52%	0.516	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	136.5	173.9	-157.6	-176.1	-84	166	-0.3	109.7	V1885 V2099 W2110 Q2111 W2131	V1885-R2101 PolarHBondContact N-O 2.76Å; V2099-R2101 HydrophobicContact CG1-CG 4.26Å; R2101-W2110 CarbonylContact C-O 3.55Å; R2101-W2110 VanDerWaalsContact CA-O 3.22Å; R2101-W2110 WeakPolarHBondContact CA-O 3.32Å; R2101-W2110 VanDerWaalsContact CG-O 3.28Å; R2101-W2110 WeakPolarHBondContact CG-O 3.39Å; R2101-Q2111 HydrophobicContact CB-CB 4.37Å; R2101-Q2111 HydrophobicContact CB-CG 4.43Å; R2101-Q2111 HydrophobicContact CG-CB 4.28Å; R2101-Q2111 HydrophobicContact CG-CG 3.89Å; R2101-Q2111 VanDerWaalsContact CZ-OE1 3.27Å; R2101-Q2111 VanDerWaalsContact NE-OE1 3.09Å; R2101-W2131 HydrophobicContact CG-CH2 4.27Å
2102	M	66.5	Low	71.3	Confident	32.8 Å²	32.8	67.9 Å²	67.9	16%	0.162	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	127.8	169.7	-148.1	-166.7	-65.4	0	0	109	F1884 L2082 I2085 A2109 W2110 I2155	F1884-M2102 HydrophobicContact CD2-CE 3.93Å; F1884-M2102 HydrophobicContact CE2-CE 4.33Å; L2082-M2102 HydrophobicContact CD1-CE 4.3Å; L2082-M2102 HydrophobicContact CD2-CE 3.92Å; L2082-M2102 VanDerWaalsContact CD2-CE 3.48Å; L2082-M2102 HydrophobicContact CD2-SD 3.77Å; L2082-M2102 WeakPolarHBondContact CD2-SD 3.21Å; I2085-M2102 HydrophobicContact CD1-CE 3.67Å; I2085-M2102 VanDerWaalsContact CD1-CE 3.47Å; I2085-M2102 HydrophobicContact CD1-SD 4.16Å; I2085-M2102 HydrophobicContact CG1-CE 3.85Å; I2085-M2102 HydrophobicContact CG1-SD 4.13Å; I2085-M2102 HydrophobicContact CG2-CE 4.4Å; I2085-M2102 HydrophobicContact CG2-SD 4.01Å; M2102-A2109 CarbonylContact O-C 3.5Å; M2102-A2109 VanDerWaalsContact O-CA 3.26Å; M2102-A2109 WeakPolarHBondContact O-CA 3.29Å; M2102-A2109 VanDerWaalsContact O-CB 3.3Å; M2102-A2109 WeakPolarHBondContact O-CB 3.33Å; M2102-W2110 HydrophobicContact CB-CD2 4.21Å; M2102-W2110 VanDerWaalsContact CB-CE2 3.46Å; M2102-W2110 HydrophobicContact CB-CH2 4.16Å; M2102-W2110 HydrophobicContact CB-CZ2 3.52Å; M2102-W2110 HydrophobicContact CE-CZ2 4.14Å; M2102-W2110 HydrophobicContact CG-CH2 3.94Å; M2102-W2110 HydrophobicContact CG-CZ2 3.87Å; M2102-W2110 VanDerWaalsContact CG-CZ2 3.44Å; M2102-W2110 PolarHBondContact N-O 3.27Å; M2102-W2110 PolarHBondContact O-N 3.12Å; M2102-W2110 HydrophobicContact SD-CH2 4.4Å; M2102-W2110 HydrophobicContact SD-CZ2 3.71Å; M2102-W2110 VanDerWaalsContact SD-CZ2 3.58Å; M2102-W2110 PolarHBondContact SD-NE1 3.28Å; M2102-W2110 VanDerWaalsContact SD-NE1 3.4Å; M2102-I2155 HydrophobicContact SD-CD1 4.01Å
2103	Q	63	Low	71.7	Confident	136.2 Å²	136.2	64.1 Å²	64.1	64%	0.636	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.6	143.6	173	-154.5	164.2	-20.6	0	0	109.3	N1883 A2109	N1883-Q2103 HydrophobicContact CB-CB 4.44Å; N1883-Q2103 PolarHBondContact O-N 2.58Å; N1883-Q2103 VanDerWaalsContact O-N 3.13Å; Q2103-A2109 HydrophobicContact CB-CB 4.27Å; Q2103-A2109 HydrophobicContact CG-CB 4.17Å
2104	Q	57.1	Low	72.1	Confident	47.2 Å²	47.2	58.7 Å²	58.7	22%	0.221	31%	0.307	C	S	.	.			trans	-112.5	169.4	172	-61.2	-177.2	-62	0	0	108.4	S2080 S2106 G2107 K2108	S2080-Q2104 PolarHBondContact OG-NE2 3.22Å; Q2104-S2106 PolarHBondContact O-N 2.9Å; Q2104-G2107 PolarHBondContact O-N 2.83Å; Q2104-G2107 VanDerWaalsContact O-N 3.15Å; Q2104-K2108 WeakPolarHBondContact CA-O 3.25Å; Q2104-K2108 HydrophobicContact CB-CB 4.27Å; Q2104-K2108 WeakPolarHBondContact CB-O 3.48Å; Q2104-K2108 PolarHBondContact N-O 3.1Å; Q2104-K2108 VanDerWaalsContact O-O 3.07Å; Q2104-K2108 VanDerWaalsContact OE1-CB 3.31Å
2105	E	50.1	Low	72.4	Confident	124.6 Å²	124.6	55 Å²	55	58%	0.582	29%	0.287	S	S	*	.	S	Bend	trans	-58.3	171.5	167.3	-52.8	-175.8	-179.4	0	0	112.1	D2022 L2023 G2107 K2108	D2022-E2105 WeakPolarHBondContact CA-OE2 3.31Å; D2022-E2105 HydrophobicContact CB-CG 3.85Å; L2023-E2105 VanDerWaalsContact C-OE2 3.23Å; L2023-E2105 PolarHBondContact N-OE1 2.99Å; L2023-E2105 PolarHBondContact N-OE2 2.85Å; E2105-G2107 VanDerWaalsContact C-N 3.25Å; E2105-G2107 PolarHBondContact O-N 3Å; E2105-K2108 HydrophobicContact CG-CB 4.47Å; E2105-K2108 HydrophobicContact CG-CD 3.87Å; E2105-K2108 HydrophobicContact CG-CG 4.47Å; E2105-K2108 PolarHBondContact O-N 2.82Å; E2105-K2108 WeakPolarHBondContact OE1-CD 3.44Å; E2105-K2108 WeakPolarHBondContact OE1-CE 3.19Å; E2105-K2108 IonicContact OE1-NZ 3.68Å; E2105-K2108 PolarHBondContact OE1-NZ 2.9Å
2106	S	53.3	Low	72.5	Confident	93.8 Å²	93.8	54.5 Å²	54.5	66%	0.656	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	22.6	34.4	-173.5	71.6	0	0	0	0	115.2	Q2104 K2108	Q2104-S2106 PolarHBondContact O-N 2.9Å; S2106-K2108 VanDerWaalsContact C-N 3.33Å; S2106-K2108 PolarHBondContact O-N 3.08Å; S2106-K2108 VanDerWaalsContact O-N 3.1Å; S2106-K2108 WeakPolarHBondContact OG-CD 3.39Å; S2106-K2108 WeakPolarHBondContact OG-CE 3.34Å; S2106-K2108 WeakPolarHBondContact OG-CG 2.99Å; S2106-K2108 PolarHBondContact OG-NZ 3.14Å
2107	G	56.1	Low	72.5	Confident	44.4 Å²	44.4	51.2 Å²	51.2	46%	0.458	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.1	9.9	178.4	0	0	0	0	0	114.6	Q2104 E2105 L2126	Q2104-G2107 PolarHBondContact O-N 2.83Å; Q2104-G2107 VanDerWaalsContact O-N 3.15Å; E2105-G2107 VanDerWaalsContact C-N 3.25Å; E2105-G2107 PolarHBondContact O-N 3Å; G2107-L2126 WeakPolarHBondContact O-CD2 3.41Å
2108	K	59.5	Low	72.4	Confident	57.2 Å²	57.2	50.5 Å²	50.5	25%	0.249	27%	0.272	C	S	.	.			trans	-92.1	147.5	173	-65.6	173.5	-172	167.7	0	109.9	L1485 Q2104 E2105 S2106 L2126	L1485-K2108 HydrophobicContact CD1-CG 4.44Å; Q2104-K2108 WeakPolarHBondContact CA-O 3.25Å; Q2104-K2108 HydrophobicContact CB-CB 4.27Å; Q2104-K2108 WeakPolarHBondContact CB-O 3.48Å; Q2104-K2108 PolarHBondContact N-O 3.1Å; Q2104-K2108 VanDerWaalsContact O-O 3.07Å; Q2104-K2108 VanDerWaalsContact OE1-CB 3.31Å; E2105-K2108 HydrophobicContact CG-CB 4.47Å; E2105-K2108 HydrophobicContact CG-CD 3.87Å; E2105-K2108 HydrophobicContact CG-CG 4.47Å; E2105-K2108 PolarHBondContact O-N 2.82Å; E2105-K2108 WeakPolarHBondContact OE1-CD 3.44Å; E2105-K2108 WeakPolarHBondContact OE1-CE 3.19Å; E2105-K2108 IonicContact OE1-NZ 3.68Å; E2105-K2108 PolarHBondContact OE1-NZ 2.9Å; S2106-K2108 VanDerWaalsContact C-N 3.33Å; S2106-K2108 PolarHBondContact O-N 3.08Å; S2106-K2108 VanDerWaalsContact O-N 3.1Å; S2106-K2108 WeakPolarHBondContact OG-CD 3.39Å; S2106-K2108 WeakPolarHBondContact OG-CE 3.34Å; S2106-K2108 WeakPolarHBondContact OG-CG 2.99Å; S2106-K2108 PolarHBondContact OG-NZ 3.14Å; K2108-L2126 CarbonylContact C-O 3.51Å; K2108-L2126 VanDerWaalsContact CA-O 3.29Å; K2108-L2126 WeakPolarHBondContact CA-O 3.27Å
2109	A	67.6	Low	72.4	Confident	6 Å²	6	51.1 Å²	51.1	5%	0.05	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.1	168.4	174.1	0	0	0	0	0	109.9	M2102 Q2103 S2125 L2126 W2131	M2102-A2109 CarbonylContact O-C 3.5Å; M2102-A2109 VanDerWaalsContact O-CA 3.26Å; M2102-A2109 WeakPolarHBondContact O-CA 3.29Å; M2102-A2109 VanDerWaalsContact O-CB 3.3Å; M2102-A2109 WeakPolarHBondContact O-CB 3.33Å; Q2103-A2109 HydrophobicContact CB-CB 4.27Å; Q2103-A2109 HydrophobicContact CG-CB 4.17Å; A2109-S2125 CarbonylContact O-C 3.52Å; A2109-S2125 VanDerWaalsContact O-CA 3.29Å; A2109-S2125 WeakPolarHBondContact O-CA 3.33Å; A2109-S2125 WeakPolarHBondContact O-CB 3.22Å; A2109-L2126 HydrophobicContact CB-CB 3.8Å; A2109-L2126 HydrophobicContact CB-CD2 3.92Å; A2109-L2126 HydrophobicContact CB-CG 4.44Å; A2109-L2126 PolarHBondContact N-O 3.05Å; A2109-L2126 VanDerWaalsContact N-O 3.15Å; A2109-L2126 PolarHBondContact O-N 3.01Å; A2109-W2131 HydrophobicContact CB-CH2 4.11Å; A2109-W2131 HydrophobicContact CB-CZ2 4.48Å
2110	W	74.9	Confident	72.5	Confident	10.2 Å²	10.2	49.8 Å²	49.8	4%	0.039	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	157.6	163.3	62.6	-92.6	0	0	0	111	I2085 L2100 R2101 M2102 L2112 S2124 I2160 F2162	I2085-W2110 HydrophobicContact CD1-CH2 4.07Å; I2085-W2110 HydrophobicContact CD1-CZ2 3.67Å; L2100-W2110 HydrophobicContact CD2-CH2 3.82Å; L2100-W2110 HydrophobicContact CD2-CZ3 4.23Å; L2100-W2110 HydrophobicContact CG-CH2 4.08Å; L2100-W2110 HydrophobicContact CG-CZ3 4.3Å; R2101-W2110 CarbonylContact C-O 3.55Å; R2101-W2110 VanDerWaalsContact CA-O 3.22Å; R2101-W2110 WeakPolarHBondContact CA-O 3.32Å; R2101-W2110 VanDerWaalsContact CG-O 3.28Å; R2101-W2110 WeakPolarHBondContact CG-O 3.39Å; M2102-W2110 HydrophobicContact CB-CD2 4.21Å; M2102-W2110 VanDerWaalsContact CB-CE2 3.46Å; M2102-W2110 HydrophobicContact CB-CH2 4.16Å; M2102-W2110 HydrophobicContact CB-CZ2 3.52Å; M2102-W2110 HydrophobicContact CE-CZ2 4.14Å; M2102-W2110 HydrophobicContact CG-CH2 3.94Å; M2102-W2110 HydrophobicContact CG-CZ2 3.87Å; M2102-W2110 VanDerWaalsContact CG-CZ2 3.44Å; M2102-W2110 PolarHBondContact N-O 3.27Å; M2102-W2110 PolarHBondContact O-N 3.12Å; M2102-W2110 HydrophobicContact SD-CH2 4.4Å; M2102-W2110 HydrophobicContact SD-CZ2 3.71Å; M2102-W2110 VanDerWaalsContact SD-CZ2 3.58Å; M2102-W2110 PolarHBondContact SD-NE1 3.28Å; M2102-W2110 VanDerWaalsContact SD-NE1 3.4Å; W2110-L2112 HydrophobicContact CE3-CB 4.4Å; W2110-L2112 HydrophobicContact CZ3-CB 4.06Å; W2110-S2124 CarbonylContact C-O 3.52Å; W2110-S2124 VanDerWaalsContact CA-O 3.27Å; W2110-S2124 WeakPolarHBondContact CA-O 3.22Å; W2110-S2124 WeakPolarHBondContact CB-O 3.29Å; W2110-I2160 HydrophobicContact CB-CG2 4.28Å; W2110-I2160 HydrophobicContact CD2-CB 4.26Å; W2110-I2160 HydrophobicContact CD2-CD1 4.05Å; W2110-I2160 HydrophobicContact CD2-CG2 3.87Å; W2110-I2160 VanDerWaalsContact CD2-CG2 3.45Å; W2110-I2160 HydrophobicContact CE3-CD1 4.28Å; W2110-I2160 HydrophobicContact CE3-CG2 4.01Å; W2110-I2160 HydrophobicContact CG-CB 4.33Å; W2110-I2160 HydrophobicContact CG-CD1 3.65Å; W2110-I2160 HydrophobicContact CG-CG2 3.93Å; W2110-I2160 HydrophobicContact CH2-CD1 3.58Å; W2110-I2160 VanDerWaalsContact CH2-CD1 3.46Å; W2110-I2160 HydrophobicContact CZ2-CD1 3.45Å; W2110-I2160 HydrophobicContact CZ3-CD1 4.03Å; W2110-I2160 HydrophobicContact CZ3-CG2 4.43Å; W2110-F2162 AromaticContact CE3-CZ 3.78Å; W2110-F2162 HydrophobicContact CE3-CZ 4.02Å; W2110-F2162 HydrophobicContact CH2-CE1 4.08Å; W2110-F2162 HydrophobicContact CH2-CZ 4.29Å; W2110-F2162 AromaticContact CZ3-CE1 3.88Å; W2110-F2162 HydrophobicContact CZ3-CE1 3.88Å; W2110-F2162 AromaticContact CZ3-CZ 3.65Å; W2110-F2162 HydrophobicContact CZ3-CZ 3.99Å; W2110-F2162 VanDerWaalsContact CZ3-CZ 3.48Å
2111	Q	77.5	Confident	73	Confident	32.6 Å²	32.6	49 Å²	49	15%	0.152	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	132.4	-180	-179.6	176.7	-61.7	0	0	109.2	V2099 L2100 R2101 D2113 V2123 S2124 W2131	V2099-Q2111 VanDerWaalsContact CG1-CD 3.43Å; V2099-Q2111 HydrophobicContact CG1-CG 3.5Å; V2099-Q2111 VanDerWaalsContact CG1-CG 3.45Å; L2100-Q2111 CarbonylContact O-C 3.54Å; L2100-Q2111 VanDerWaalsContact O-CA 3.31Å; L2100-Q2111 WeakPolarHBondContact O-CA 3.25Å; R2101-Q2111 HydrophobicContact CB-CB 4.37Å; R2101-Q2111 HydrophobicContact CB-CG 4.43Å; R2101-Q2111 HydrophobicContact CG-CB 4.28Å; R2101-Q2111 HydrophobicContact CG-CG 3.89Å; R2101-Q2111 VanDerWaalsContact CZ-OE1 3.27Å; R2101-Q2111 VanDerWaalsContact NE-OE1 3.09Å; Q2111-D2113 PolarHBondContact NE2-OD1 2.81Å; Q2111-V2123 CarbonylContact O-C 3.55Å; Q2111-V2123 WeakPolarHBondContact O-CA 3.35Å; Q2111-S2124 PolarHBondContact N-O 3.05Å; Q2111-S2124 PolarHBondContact O-N 2.83Å; Q2111-S2124 PolarHBondContact O-OG 3.09Å; Q2111-W2131 HydrophobicContact CB-CE3 4.36Å; Q2111-W2131 HydrophobicContact CB-CH2 3.85Å; Q2111-W2131 HydrophobicContact CB-CZ3 3.66Å
2112	L	81	Confident	73.4	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	119.3	163.5	168.6	66.5	0	0	0	107.8	F2098 V2099 L2100 W2110 V2114 W2121 R2122 V2123 L2151 F2162	F2098-L2112 HydrophobicContact CE2-CD2 4.46Å; V2099-L2112 CarbonylContact C-O 3.55Å; V2099-L2112 WeakPolarHBondContact CA-O 3.29Å; L2100-L2112 HydrophobicContact CB-CB 4.44Å; L2100-L2112 PolarHBondContact N-O 2.88Å; L2100-L2112 PolarHBondContact O-N 2.91Å; W2110-L2112 HydrophobicContact CE3-CB 4.4Å; W2110-L2112 HydrophobicContact CZ3-CB 4.06Å; L2112-V2114 HydrophobicContact CD1-CG2 3.84Å; L2112-V2114 HydrophobicContact CD2-CG2 4.1Å; L2112-V2114 HydrophobicContact CG-CG2 3.79Å; L2112-W2121 HydrophobicContact CD1-CB 4.13Å; L2112-W2121 HydrophobicContact CD1-CD2 4.46Å; L2112-W2121 HydrophobicContact CD1-CE3 3.86Å; L2112-W2121 HydrophobicContact CD2-CE3 3.86Å; L2112-W2121 HydrophobicContact CD2-CZ3 3.89Å; L2112-W2121 HydrophobicContact CG-CE3 4.4Å; L2112-R2122 WeakPolarHBondContact CA-O 3.43Å; L2112-V2123 HydrophobicContact CD1-CG2 3.9Å; L2112-L2151 HydrophobicContact CD2-CD1 4.45Å; L2112-L2151 HydrophobicContact CD2-CD2 4.08Å; L2112-F2162 HydrophobicContact CB-CE1 4.49Å; L2112-F2162 HydrophobicContact CB-CE2 4.22Å; L2112-F2162 HydrophobicContact CB-CZ 3.93Å; L2112-F2162 HydrophobicContact CD1-CE2 4.3Å; L2112-F2162 HydrophobicContact CD1-CZ 4.41Å; L2112-F2162 HydrophobicContact CD2-CD1 4.41Å; L2112-F2162 HydrophobicContact CD2-CE1 4.04Å; L2112-F2162 HydrophobicContact CD2-CE2 4.28Å; L2112-F2162 HydrophobicContact CD2-CZ 3.83Å; L2112-F2162 HydrophobicContact CG-CE2 4.4Å; L2112-F2162 HydrophobicContact CG-CZ 4.2Å
2113	D	82.9	Confident	74	Confident	33.8 Å²	33.8	46 Å²	46	18%	0.181	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	126	172.8	169.2	39.4	0	0	0	108.8	V2099 Q2111 W2121 R2122	V2099-D2113 WeakPolarHBondContact CG1-OD1 3.16Å; V2099-D2113 HydrophobicContact CG2-CB 4.32Å; V2099-D2113 WeakPolarHBondContact CG2-OD1 3.3Å; Q2111-D2113 PolarHBondContact NE2-OD1 2.81Å; D2113-W2121 CarbonylContact O-C 3.58Å; D2113-W2121 WeakPolarHBondContact O-CA 3.39Å; D2113-R2122 HydrophobicContact CB-CB 4.29Å; D2113-R2122 PolarHBondContact N-O 2.81Å; D2113-R2122 PolarHBondContact O-N 3.05Å; D2113-R2122 IonicContact OD1-NH1 3.3Å; D2113-R2122 VanDerWaalsContact OD2-CD 3.31Å; D2113-R2122 WeakPolarHBondContact OD2-CD 3.43Å; D2113-R2122 IonicContact OD2-CZ 3.55Å; D2113-R2122 IonicContact OD2-NE 3.75Å; D2113-R2122 IonicContact OD2-NH1 3.06Å; D2113-R2122 PolarHBondContact OD2-NH1 2.86Å
2114	V	84.8	Confident	74.6	Confident	0.4 Å²	0.4	40.3 Å²	40.3	0%	0.002	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	118.8	-177	-177.9	0	0	0	0	110.5	S2097 F2098 L2112 L2116 I2120 W2121	S2097-V2114 CarbonylContact C-O 3.56Å; S2097-V2114 WeakPolarHBondContact CA-O 3.37Å; S2097-V2114 WeakPolarHBondContact CB-O 3.28Å; F2098-V2114 HydrophobicContact CD1-CB 3.87Å; F2098-V2114 HydrophobicContact CD1-CG1 4.2Å; F2098-V2114 HydrophobicContact CD2-CB 4.42Å; F2098-V2114 HydrophobicContact CE1-CB 3.49Å; F2098-V2114 VanDerWaalsContact CE1-CB 3.47Å; F2098-V2114 HydrophobicContact CE1-CG1 3.57Å; F2098-V2114 VanDerWaalsContact CE1-CG1 3.49Å; F2098-V2114 HydrophobicContact CE1-CG2 3.91Å; F2098-V2114 HydrophobicContact CE2-CB 4.15Å; F2098-V2114 HydrophobicContact CE2-CG2 3.86Å; F2098-V2114 HydrophobicContact CG-CB 4.37Å; F2098-V2114 HydrophobicContact CZ-CB 3.63Å; F2098-V2114 HydrophobicContact CZ-CG1 4Å; F2098-V2114 HydrophobicContact CZ-CG2 3.49Å; F2098-V2114 VanDerWaalsContact CZ-CG2 3.47Å; F2098-V2114 PolarHBondContact N-O 3.08Å; F2098-V2114 PolarHBondContact O-N 2.93Å; L2112-V2114 HydrophobicContact CD1-CG2 3.84Å; L2112-V2114 HydrophobicContact CD2-CG2 4.1Å; L2112-V2114 HydrophobicContact CG-CG2 3.79Å; V2114-L2116 HydrophobicContact CG1-CD2 4.17Å; V2114-I2120 WeakPolarHBondContact CA-O 3.48Å; V2114-W2121 HydrophobicContact CB-CD2 4.44Å; V2114-W2121 HydrophobicContact CG1-CD2 4.01Å; V2114-W2121 HydrophobicContact CG1-CG 4.1Å; V2114-W2121 HydrophobicContact CG1-CZ2 4.14Å; V2114-W2121 HydrophobicContact CG2-CB 4.34Å; V2114-W2121 HydrophobicContact CG2-CD2 3.54Å; V2114-W2121 VanDerWaalsContact CG2-CD2 3.5Å; V2114-W2121 HydrophobicContact CG2-CE3 3.67Å; V2114-W2121 HydrophobicContact CG2-CG 3.87Å; V2114-W2121 HydrophobicContact CG2-CH2 4.47Å; V2114-W2121 HydrophobicContact CG2-CZ2 4.42Å; V2114-W2121 HydrophobicContact CG2-CZ3 4.16Å
2115	D	87.6	Confident	75.4	Confident	31 Å²	31	39.2 Å²	39.2	17%	0.166	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	113.7	178	166.5	-6.2	0	0	0	108.5	P2117 T2118 Q2119 I2120 R2122	D2115-P2117 WeakPolarHBondContact OD1-CD 3.29Å; D2115-T2118 PolarHBondContact OD1-N 3.01Å; D2115-T2118 PolarHBondContact OD1-OG1 3.02Å; D2115-T2118 VanDerWaalsContact OD1-OG1 3.1Å; D2115-T2118 WeakPolarHBondContact OD2-CG2 3.36Å; D2115-T2118 PolarHBondContact OD2-OG1 2.87Å; D2115-Q2119 CarbonylContact O-C 3.46Å; D2115-Q2119 WeakPolarHBondContact O-CA 3.32Å; D2115-Q2119 PolarHBondContact O-N 3.06Å; D2115-I2120 PolarHBondContact N-O 2.99Å; D2115-I2120 VanDerWaalsContact N-O 3.11Å; D2115-I2120 PolarHBondContact O-N 3.1Å; D2115-R2122 IonicContact OD2-CZ 3.46Å; D2115-R2122 IonicContact OD2-NH1 3.24Å; D2115-R2122 IonicContact OD2-NH2 2.72Å; D2115-R2122 PolarHBondContact OD2-NH2 3.06Å
2116	L	81.4	Confident	76.3	Confident	11.8 Å²	11.8	34.6 Å²	34.6	6%	0.062	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-40.7	-171	-61.2	169.5	0	0	0	112.9	L2091 T2095 K2096 F2098 V2114 T2118 Q2119 L2143	L2091-L2116 HydrophobicContact CD1-CD1 3.94Å; L2091-L2116 HydrophobicContact CD1-CD2 4.07Å; T2095-L2116 HydrophobicContact CG2-CD1 3.65Å; T2095-L2116 VanDerWaalsContact O-CD1 3.29Å; T2095-L2116 WeakPolarHBondContact O-CD1 3.32Å; K2096-L2116 WeakPolarHBondContact O-CB 3.33Å; K2096-L2116 PolarHBondContact O-N 3.21Å; F2098-L2116 HydrophobicContact CD1-CD1 4.46Å; F2098-L2116 HydrophobicContact CD1-CD2 4.38Å; F2098-L2116 HydrophobicContact CD1-CG 4.49Å; F2098-L2116 HydrophobicContact CE1-CD2 4.27Å; V2114-L2116 HydrophobicContact CG1-CD2 4.17Å; L2116-T2118 VanDerWaalsContact C-N 3.31Å; L2116-T2118 PolarHBondContact O-N 2.87Å; L2116-Q2119 WeakPolarHBondContact O-CG 3.4Å; L2116-Q2119 PolarHBondContact O-N 2.92Å; L2116-Q2119 PolarHBondContact O-NE2 2.8Å; L2116-L2143 HydrophobicContact CD2-CB 3.63Å; L2116-L2143 HydrophobicContact CD2-CD1 4.38Å
2117	P	81.9	Confident	76.6	Confident	95.2 Å²	95.2	33.1 Å²	33.1	62%	0.618	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-44.5	170.7	-29.4	36.3	0	0	0	113.8	K2096 D2115	K2096-P2117 WeakPolarHBondContact O-CD 3.37Å; D2115-P2117 WeakPolarHBondContact OD1-CD 3.29Å
2118	T	83.4	Confident	76.9	Confident	52 Å²	52	34 Å²	34	32%	0.319	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-13.2	-179.2	72.4	0	0	0	0	113.8	D2115 L2116 I2120 K2138	D2115-T2118 PolarHBondContact OD1-N 3.01Å; D2115-T2118 PolarHBondContact OD1-OG1 3.02Å; D2115-T2118 VanDerWaalsContact OD1-OG1 3.1Å; D2115-T2118 WeakPolarHBondContact OD2-CG2 3.36Å; D2115-T2118 PolarHBondContact OD2-OG1 2.87Å; L2116-T2118 VanDerWaalsContact C-N 3.31Å; L2116-T2118 PolarHBondContact O-N 2.87Å; T2118-I2120 PolarHBondContact O-N 2.97Å; T2118-I2120 VanDerWaalsContact OG1-CB 3.32Å; T2118-I2120 WeakPolarHBondContact OG1-CB 3.35Å; T2118-I2120 WeakPolarHBondContact OG1-CD1 3.4Å; T2118-I2120 VanDerWaalsContact OG1-CG1 3.25Å; T2118-I2120 WeakPolarHBondContact OG1-CG1 3.35Å; T2118-I2120 PolarHBondContact OG1-N 3.07Å; T2118-K2138 VanDerWaalsContact O-CE 3.27Å; T2118-K2138 WeakPolarHBondContact O-CE 3.39Å; T2118-K2138 PolarHBondContact O-NZ 3.04Å
2119	Q	84	Confident	77.3	Confident	31.8 Å²	31.8	34.1 Å²	34.1	15%	0.149	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	28.8	-169.1	-62.7	-69	-33.6	0	0	113.5	D2115 L2116 W2121 K2138 P2142 L2143	D2115-Q2119 CarbonylContact O-C 3.46Å; D2115-Q2119 WeakPolarHBondContact O-CA 3.32Å; D2115-Q2119 PolarHBondContact O-N 3.06Å; L2116-Q2119 WeakPolarHBondContact O-CG 3.4Å; L2116-Q2119 PolarHBondContact O-N 2.92Å; L2116-Q2119 PolarHBondContact O-NE2 2.8Å; Q2119-W2121 VanDerWaalsContact O-CD1 3.32Å; Q2119-K2138 HydrophobicContact CB-CD 4.48Å; Q2119-K2138 VanDerWaalsContact O-CA 3.3Å; Q2119-K2138 WeakPolarHBondContact O-CA 3.39Å; Q2119-K2138 WeakPolarHBondContact O-CB 3.38Å; Q2119-K2138 WeakPolarHBondContact O-CG 3.33Å; Q2119-P2142 HydrophobicContact CG-CB 4.05Å; Q2119-P2142 VanDerWaalsContact OE1-CA 3.27Å; Q2119-L2143 PolarHBondContact NE2-O 3.07Å
2120	I	81	Confident	77.2	Confident	43 Å²	43	38.3 Å²	38.3	22%	0.221	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	125.8	178.8	-63.4	172.8	0	0	0	110.2	V2114 D2115 T2118 R2122 K2138	V2114-I2120 WeakPolarHBondContact CA-O 3.48Å; D2115-I2120 PolarHBondContact N-O 2.99Å; D2115-I2120 VanDerWaalsContact N-O 3.11Å; D2115-I2120 PolarHBondContact O-N 3.1Å; T2118-I2120 PolarHBondContact O-N 2.97Å; T2118-I2120 VanDerWaalsContact OG1-CB 3.32Å; T2118-I2120 WeakPolarHBondContact OG1-CB 3.35Å; T2118-I2120 WeakPolarHBondContact OG1-CD1 3.4Å; T2118-I2120 VanDerWaalsContact OG1-CG1 3.25Å; T2118-I2120 WeakPolarHBondContact OG1-CG1 3.35Å; T2118-I2120 PolarHBondContact OG1-N 3.07Å; I2120-R2122 HydrophobicContact CG2-CG 3.83Å; I2120-K2138 HydrophobicContact CG1-CD 4.44Å; I2120-K2138 HydrophobicContact CG1-CG 4.3Å
2121	W	85.5	Confident	77.2	Confident	7.4 Å²	7.4	42.2 Å²	42.2	3%	0.028	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	117.8	177.5	-65.4	51	0	0	0	107.7	F2098 L2112 D2113 V2114 Q2119 S2136 F2137 N2139 L2143 F2149 L2151	F2098-W2121 HydrophobicContact CZ-CH2 4.33Å; L2112-W2121 HydrophobicContact CD1-CB 4.13Å; L2112-W2121 HydrophobicContact CD1-CD2 4.46Å; L2112-W2121 HydrophobicContact CD1-CE3 3.86Å; L2112-W2121 HydrophobicContact CD2-CE3 3.86Å; L2112-W2121 HydrophobicContact CD2-CZ3 3.89Å; L2112-W2121 HydrophobicContact CG-CE3 4.4Å; D2113-W2121 CarbonylContact O-C 3.58Å; D2113-W2121 WeakPolarHBondContact O-CA 3.39Å; V2114-W2121 HydrophobicContact CB-CD2 4.44Å; V2114-W2121 HydrophobicContact CG1-CD2 4.01Å; V2114-W2121 HydrophobicContact CG1-CG 4.1Å; V2114-W2121 HydrophobicContact CG1-CZ2 4.14Å; V2114-W2121 HydrophobicContact CG2-CB 4.34Å; V2114-W2121 HydrophobicContact CG2-CD2 3.54Å; V2114-W2121 VanDerWaalsContact CG2-CD2 3.5Å; V2114-W2121 HydrophobicContact CG2-CE3 3.67Å; V2114-W2121 HydrophobicContact CG2-CG 3.87Å; V2114-W2121 HydrophobicContact CG2-CH2 4.47Å; V2114-W2121 HydrophobicContact CG2-CZ2 4.42Å; V2114-W2121 HydrophobicContact CG2-CZ3 4.16Å; Q2119-W2121 VanDerWaalsContact O-CD1 3.32Å; W2121-S2136 CarbonylContact O-C 3.57Å; W2121-S2136 VanDerWaalsContact O-CA 3.25Å; W2121-S2136 WeakPolarHBondContact O-CA 3.37Å; W2121-S2136 WeakPolarHBondContact O-CB 3.39Å; W2121-F2137 WeakPolarHBondContact CA-O 3.5Å; W2121-F2137 HydrophobicContact CB-CD1 4.29Å; W2121-F2137 HydrophobicContact CB-CD2 3.88Å; W2121-F2137 HydrophobicContact CB-CE1 4.07Å; W2121-F2137 HydrophobicContact CB-CE2 3.56Å; W2121-F2137 VanDerWaalsContact CB-CE2 3.49Å; W2121-F2137 HydrophobicContact CB-CG 4.26Å; W2121-F2137 HydrophobicContact CB-CZ 3.67Å; W2121-F2137 WeakPolarHBondContact CB-O 3.37Å; W2121-F2137 AromaticContact CD2-CE2 3.9Å; W2121-F2137 HydrophobicContact CD2-CE2 3.97Å; W2121-F2137 HydrophobicContact CD2-CZ 4.29Å; W2121-F2137 AromaticContact CE3-CE2 3.87Å; W2121-F2137 HydrophobicContact CE3-CE2 3.96Å; W2121-F2137 AromaticContact CE3-CZ 3.9Å; W2121-F2137 HydrophobicContact CE3-CZ 4.03Å; W2121-F2137 HydrophobicContact CG-CD2 4.21Å; W2121-F2137 AromaticContact CG-CE2 3.75Å; W2121-F2137 HydrophobicContact CG-CE2 3.82Å; W2121-F2137 HydrophobicContact CG-CZ 4.2Å; W2121-F2137 PolarHBondContact N-O 2.96Å; W2121-F2137 PolarHBondContact O-N 3.17Å; W2121-N2139 HydrophobicContact CD2-CB 4.33Å; W2121-N2139 HydrophobicContact CZ2-CB 3.88Å; W2121-N2139 VanDerWaalsContact CZ2-ND2 3.3Å; W2121-N2139 WeakPolarHBondContact CZ2-ND2 3.32Å; W2121-L2143 HydrophobicContact CH2-CD1 3.85Å; W2121-L2143 HydrophobicContact CZ2-CD1 3.43Å; W2121-L2143 VanDerWaalsContact CZ2-CD1 3.45Å; W2121-L2143 HydrophobicContact CZ2-CG 4.04Å; W2121-F2149 HydrophobicContact CH2-CE2 4.3Å; W2121-L2151 HydrophobicContact CH2-CD1 4.33Å; W2121-L2151 HydrophobicContact CZ3-CD1 4Å
2122	R	82.6	Confident	76.9	Confident	89.2 Å²	89.2	46.6 Å²	46.6	34%	0.337	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	122.1	-175.8	-49.6	-176	-173.5	86.1	4.4	108.7	L2112 D2113 D2115 I2120	L2112-R2122 WeakPolarHBondContact CA-O 3.43Å; D2113-R2122 HydrophobicContact CB-CB 4.29Å; D2113-R2122 PolarHBondContact N-O 2.81Å; D2113-R2122 PolarHBondContact O-N 3.05Å; D2113-R2122 IonicContact OD1-NH1 3.3Å; D2113-R2122 VanDerWaalsContact OD2-CD 3.31Å; D2113-R2122 WeakPolarHBondContact OD2-CD 3.43Å; D2113-R2122 IonicContact OD2-CZ 3.55Å; D2113-R2122 IonicContact OD2-NE 3.75Å; D2113-R2122 IonicContact OD2-NH1 3.06Å; D2113-R2122 PolarHBondContact OD2-NH1 2.86Å; D2115-R2122 IonicContact OD2-CZ 3.46Å; D2115-R2122 IonicContact OD2-NH1 3.24Å; D2115-R2122 IonicContact OD2-NH2 2.72Å; D2115-R2122 PolarHBondContact OD2-NH2 3.06Å; I2120-R2122 HydrophobicContact CG2-CG 3.83Å
2123	V	78.1	Confident	76.6	Confident	18.6 Å²	18.6	55 Å²	55	11%	0.113	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	141	177.2	179.8	0	0	0	0	109.4	Q2111 L2112 H2134 F2137 I2160 F2162	Q2111-V2123 CarbonylContact O-C 3.55Å; Q2111-V2123 WeakPolarHBondContact O-CA 3.35Å; L2112-V2123 HydrophobicContact CD1-CG2 3.9Å; V2123-H2134 HydrophobicContact CB-CB 4.16Å; V2123-H2134 HydrophobicContact CG1-CB 4.3Å; V2123-H2134 WeakPolarHBondContact O-CB 3.23Å; V2123-H2134 PolarHBondContact O-CD2 2.75Å; V2123-H2134 PolarHBondContact O-N 3.14Å; V2123-F2137 HydrophobicContact CG2-CE1 3.92Å; V2123-I2160 HydrophobicContact CG1-CG2 4.25Å; V2123-F2162 HydrophobicContact CB-CE2 4.36Å; V2123-F2162 HydrophobicContact CG1-CE2 4.08Å; V2123-F2162 HydrophobicContact CG2-CD2 4.02Å; V2123-F2162 HydrophobicContact CG2-CE2 3.83Å; V2123-F2162 VanDerWaalsContact CG2-CE2 3.48Å; V2123-F2162 HydrophobicContact CG2-CZ 4.3Å
2124	S	77.4	Confident	76	Confident	15.8 Å²	15.8	56.4 Å²	56.4	11%	0.11	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	146.6	175.6	-19.2	0	0	0	0	110.1	W2110 Q2111 K2132	W2110-S2124 CarbonylContact C-O 3.52Å; W2110-S2124 VanDerWaalsContact CA-O 3.27Å; W2110-S2124 WeakPolarHBondContact CA-O 3.22Å; W2110-S2124 WeakPolarHBondContact CB-O 3.29Å; Q2111-S2124 PolarHBondContact N-O 3.05Å; Q2111-S2124 PolarHBondContact O-N 2.83Å; Q2111-S2124 PolarHBondContact O-OG 3.09Å; S2124-K2132 CarbonylContact C-O 3.46Å; S2124-K2132 VanDerWaalsContact CA-O 3.29Å; S2124-K2132 WeakPolarHBondContact CA-O 3.3Å; S2124-K2132 WeakPolarHBondContact CB-O 3.38Å
2125	S	72.4	Confident	74.9	Confident	24.4 Å²	24.4	61.7 Å²	61.7	17%	0.171	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	126.8	175.1	60.6	0	0	0	0	111	A2109 S2127 K2132 H2134	A2109-S2125 CarbonylContact O-C 3.52Å; A2109-S2125 VanDerWaalsContact O-CA 3.29Å; A2109-S2125 WeakPolarHBondContact O-CA 3.33Å; A2109-S2125 WeakPolarHBondContact O-CB 3.22Å; S2125-S2127 PolarHBondContact O-N 2.74Å; S2125-K2132 PolarHBondContact N-O 3.09Å; S2125-K2132 WeakPolarHBondContact O-CB 3.31Å; S2125-K2132 PolarHBondContact O-N 2.93Å; S2125-H2134 WeakPolarHBondContact CB-NE2 3.45Å; S2125-H2134 PolarHBondContact OG-NE2 3.09Å
2126	L	70.1	Confident	74.2	Confident	27.4 Å²	27.4	63.9 Å²	63.9	14%	0.143	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	123.5	167.7	-176.8	68.4	0	0	0	108.6	G2107 K2108 A2109 G2129 T2130 W2131	G2107-L2126 WeakPolarHBondContact O-CD2 3.41Å; K2108-L2126 CarbonylContact C-O 3.51Å; K2108-L2126 VanDerWaalsContact CA-O 3.29Å; K2108-L2126 WeakPolarHBondContact CA-O 3.27Å; A2109-L2126 HydrophobicContact CB-CB 3.8Å; A2109-L2126 HydrophobicContact CB-CD2 3.92Å; A2109-L2126 HydrophobicContact CB-CG 4.44Å; A2109-L2126 PolarHBondContact N-O 3.05Å; A2109-L2126 VanDerWaalsContact N-O 3.15Å; A2109-L2126 PolarHBondContact O-N 3.01Å; L2126-G2129 VanDerWaalsContact CD1-O 3.27Å; L2126-G2129 WeakPolarHBondContact CD1-O 3.29Å; L2126-T2130 WeakPolarHBondContact CA-O 3.37Å; L2126-W2131 HydrophobicContact CB-CD2 3.97Å; L2126-W2131 HydrophobicContact CB-CE3 3.95Å; L2126-W2131 HydrophobicContact CB-CG 4.49Å; L2126-W2131 HydrophobicContact CB-CH2 4.02Å; L2126-W2131 HydrophobicContact CB-CZ2 4.03Å; L2126-W2131 HydrophobicContact CB-CZ3 3.98Å; L2126-W2131 HydrophobicContact CD1-CD2 4.19Å; L2126-W2131 HydrophobicContact CD1-CG 4.15Å; L2126-W2131 HydrophobicContact CD1-CZ2 4.31Å; L2126-W2131 HydrophobicContact CD2-CZ2 4.34Å; L2126-W2131 HydrophobicContact CG-CZ2 4.49Å
2127	S	60	Low	73.4	Confident	62.6 Å²	62.6	66.9 Å²	66.9	44%	0.438	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	130	171	-175.5	0	0	0	0	108.9	S2125 G2129 T2130	S2125-S2127 PolarHBondContact O-N 2.74Å; S2127-G2129 VanDerWaalsContact C-N 3.26Å; S2127-G2129 PolarHBondContact O-N 3Å; S2127-T2130 PolarHBondContact N-O 2.93Å; S2127-T2130 VanDerWaalsContact N-O 3.13Å; S2127-T2130 PolarHBondContact O-N 3.07Å; S2127-T2130 VanDerWaalsContact O-N 3.14Å
2128	G	60.8	Low	72.5	Confident	62.6 Å²	62.6	68.5 Å²	68.5	65%	0.645	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.5	42.6	-174.9	0	0	0	0	0	112.8	R1486 T2130	R1486-G2128 PolarHBondContact NH2-O 3.48Å; G2128-T2130 PolarHBondContact O-N 2.92Å; G2128-T2130 VanDerWaalsContact O-N 3.09Å; G2128-T2130 PolarHBondContact O-OG1 3.05Å; G2128-T2130 VanDerWaalsContact O-OG1 3.12Å
2129	G	68.1	Low	71.3	Confident	60.6 Å²	60.6	68.6 Å²	68.6	63%	0.625	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.8	-12.3	-177.5	0	0	0	0	0	115.9	L2126 S2127	L2126-G2129 VanDerWaalsContact CD1-O 3.27Å; L2126-G2129 WeakPolarHBondContact CD1-O 3.29Å; S2127-G2129 VanDerWaalsContact C-N 3.26Å; S2127-G2129 PolarHBondContact O-N 3Å
2130	T	66.7	Low	69.4	Low	94 Å²	94	75.2 Å²	75.2	58%	0.577	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105	132.5	-173.3	-53.2	0	0	0	0	112.2	L2126 S2127 G2128 K2132	L2126-T2130 WeakPolarHBondContact CA-O 3.37Å; S2127-T2130 PolarHBondContact N-O 2.93Å; S2127-T2130 VanDerWaalsContact N-O 3.13Å; S2127-T2130 PolarHBondContact O-N 3.07Å; S2127-T2130 VanDerWaalsContact O-N 3.14Å; G2128-T2130 PolarHBondContact O-N 2.92Å; G2128-T2130 VanDerWaalsContact O-N 3.09Å; G2128-T2130 PolarHBondContact O-OG1 3.05Å; G2128-T2130 VanDerWaalsContact O-OG1 3.12Å; T2130-K2132 PolarHBondContact O-N 3.19Å; T2130-K2132 VanDerWaalsContact O-N 3.11Å
2131	W	74.7	Confident	68	Low	92.8 Å²	92.8	76.2 Å²	76.2	35%	0.352	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	104.1	175.3	-76.2	100.9	0	0	0	111.8	R2101 A2109 Q2111 L2126 K2133	R2101-W2131 HydrophobicContact CG-CH2 4.27Å; A2109-W2131 HydrophobicContact CB-CH2 4.11Å; A2109-W2131 HydrophobicContact CB-CZ2 4.48Å; Q2111-W2131 HydrophobicContact CB-CE3 4.36Å; Q2111-W2131 HydrophobicContact CB-CH2 3.85Å; Q2111-W2131 HydrophobicContact CB-CZ3 3.66Å; L2126-W2131 HydrophobicContact CB-CD2 3.97Å; L2126-W2131 HydrophobicContact CB-CE3 3.95Å; L2126-W2131 HydrophobicContact CB-CG 4.49Å; L2126-W2131 HydrophobicContact CB-CH2 4.02Å; L2126-W2131 HydrophobicContact CB-CZ2 4.03Å; L2126-W2131 HydrophobicContact CB-CZ3 3.98Å; L2126-W2131 HydrophobicContact CD1-CD2 4.19Å; L2126-W2131 HydrophobicContact CD1-CG 4.15Å; L2126-W2131 HydrophobicContact CD1-CZ2 4.31Å; L2126-W2131 HydrophobicContact CD2-CZ2 4.34Å; L2126-W2131 HydrophobicContact CG-CZ2 4.49Å; W2131-K2133 PolarHBondContact O-N 3.11Å
2132	K	71.4	Confident	66.8	Low	123.6 Å²	123.6	79.8 Å²	79.8	54%	0.537	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	118.9	168.5	-136.8	-177.5	-179.4	179.5	0	109.8	S2124 S2125 T2130 H2134	S2124-K2132 CarbonylContact C-O 3.46Å; S2124-K2132 VanDerWaalsContact CA-O 3.29Å; S2124-K2132 WeakPolarHBondContact CA-O 3.3Å; S2124-K2132 WeakPolarHBondContact CB-O 3.38Å; S2125-K2132 PolarHBondContact N-O 3.09Å; S2125-K2132 WeakPolarHBondContact O-CB 3.31Å; S2125-K2132 PolarHBondContact O-N 2.93Å; T2130-K2132 PolarHBondContact O-N 3.19Å; T2130-K2132 VanDerWaalsContact O-N 3.11Å; K2132-H2134 VanDerWaalsContact CE-CE1 3.46Å; K2132-H2134 WeakPolarHBondContact CE-CE1 3.37Å; K2132-H2134 PolarHBondContact O-CD2 2.97Å
2133	K	74.1	Confident	66.4	Low	177.8 Å²	177.8	75.9 Å²	75.9	77%	0.773	42%	0.422	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.4	139.4	171.5	-65.7	179	-179.3	174.6	0	109.8	W2131	W2131-K2133 PolarHBondContact O-N 3.11Å
2134	H	70.9	Confident	66.2	Low	62.6 Å²	62.6	77.8 Å²	77.8	29%	0.29	44%	0.439	S	S	.	.			trans	-106.1	164.1	173.3	-66.3	-83	0	0	0	110.4	V2123 S2125 K2132 S2136	V2123-H2134 HydrophobicContact CB-CB 4.16Å; V2123-H2134 HydrophobicContact CG1-CB 4.3Å; V2123-H2134 WeakPolarHBondContact O-CB 3.23Å; V2123-H2134 PolarHBondContact O-CD2 2.75Å; V2123-H2134 PolarHBondContact O-N 3.14Å; S2125-H2134 WeakPolarHBondContact CB-NE2 3.45Å; S2125-H2134 PolarHBondContact OG-NE2 3.09Å; K2132-H2134 VanDerWaalsContact CE-CE1 3.46Å; K2132-H2134 WeakPolarHBondContact CE-CE1 3.37Å; K2132-H2134 PolarHBondContact O-CD2 2.97Å; H2134-S2136 PolarHBondContact O-N 2.94Å
2135	P	60.3	Low	66.2	Low	112 Å²	112	79.1 Å²	79.1	73%	0.727	45%	0.451	S	S	*	.			trans	-54.6	127.7	177.6	-27.1	36	0	0	0	112.4
2136	S	73.7	Confident	66.2	Low	76 Å²	76	79.4 Å²	79.4	53%	0.531	46%	0.458	S	S	.	.			trans	-75.8	146	173.3	56.2	0	0	0	0	111.2	W2121 H2134	W2121-S2136 CarbonylContact O-C 3.57Å; W2121-S2136 VanDerWaalsContact O-CA 3.25Å; W2121-S2136 WeakPolarHBondContact O-CA 3.37Å; W2121-S2136 WeakPolarHBondContact O-CB 3.39Å; H2134-S2136 PolarHBondContact O-N 2.94Å
2137	F	64.4	Low	66.4	Low	75.4 Å²	75.4	81 Å²	81	33%	0.331	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	164.4	177.8	58.9	-87.6	0	0	0	110.8	W2121 V2123 F2162	W2121-F2137 WeakPolarHBondContact CA-O 3.5Å; W2121-F2137 HydrophobicContact CB-CD1 4.29Å; W2121-F2137 HydrophobicContact CB-CD2 3.88Å; W2121-F2137 HydrophobicContact CB-CE1 4.07Å; W2121-F2137 HydrophobicContact CB-CE2 3.56Å; W2121-F2137 VanDerWaalsContact CB-CE2 3.49Å; W2121-F2137 HydrophobicContact CB-CG 4.26Å; W2121-F2137 HydrophobicContact CB-CZ 3.67Å; W2121-F2137 WeakPolarHBondContact CB-O 3.37Å; W2121-F2137 AromaticContact CD2-CE2 3.9Å; W2121-F2137 HydrophobicContact CD2-CE2 3.97Å; W2121-F2137 HydrophobicContact CD2-CZ 4.29Å; W2121-F2137 AromaticContact CE3-CE2 3.87Å; W2121-F2137 HydrophobicContact CE3-CE2 3.96Å; W2121-F2137 AromaticContact CE3-CZ 3.9Å; W2121-F2137 HydrophobicContact CE3-CZ 4.03Å; W2121-F2137 HydrophobicContact CG-CD2 4.21Å; W2121-F2137 AromaticContact CG-CE2 3.75Å; W2121-F2137 HydrophobicContact CG-CE2 3.82Å; W2121-F2137 HydrophobicContact CG-CZ 4.2Å; W2121-F2137 PolarHBondContact N-O 2.96Å; W2121-F2137 PolarHBondContact O-N 3.17Å; V2123-F2137 HydrophobicContact CG2-CE1 3.92Å; F2137-F2162 HydrophobicContact CE1-CD2 4.22Å; F2137-F2162 HydrophobicContact CZ-CB 4.4Å; F2137-F2162 HydrophobicContact CZ-CD2 4.18Å; F2137-F2162 HydrophobicContact CZ-CG 4.36Å
2138	K	63.2	Low	67.1	Low	128.6 Å²	128.6	82.7 Å²	82.7	56%	0.559	47%	0.465	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.2	143.2	163.9	-61.1	-158.5	-178.9	-163	0	109.7	T2118 Q2119 I2120	T2118-K2138 VanDerWaalsContact O-CE 3.27Å; T2118-K2138 WeakPolarHBondContact O-CE 3.39Å; T2118-K2138 PolarHBondContact O-NZ 3.04Å; Q2119-K2138 HydrophobicContact CB-CD 4.48Å; Q2119-K2138 VanDerWaalsContact O-CA 3.3Å; Q2119-K2138 WeakPolarHBondContact O-CA 3.39Å; Q2119-K2138 WeakPolarHBondContact O-CB 3.38Å; Q2119-K2138 WeakPolarHBondContact O-CG 3.33Å; I2120-K2138 HydrophobicContact CG1-CD 4.44Å; I2120-K2138 HydrophobicContact CG1-CG 4.3Å
2139	N	58.5	Low	67.6	Low	54.4 Å²	54.4	81 Å²	81	29%	0.291	44%	0.44	S	S	.	.			trans	-76.8	137.7	172.3	-170	-9.4	0	0	0	109.7	W2121 V2141	W2121-N2139 HydrophobicContact CD2-CB 4.33Å; W2121-N2139 HydrophobicContact CZ2-CB 3.88Å; W2121-N2139 VanDerWaalsContact CZ2-ND2 3.3Å; W2121-N2139 WeakPolarHBondContact CZ2-ND2 3.32Å; N2139-V2141 VanDerWaalsContact C-N 3.27Å; N2139-V2141 WeakPolarHBondContact CB-O 3.36Å; N2139-V2141 VanDerWaalsContact CG-O 3.25Å; N2139-V2141 PolarHBondContact ND2-O 3.07Å; N2139-V2141 VanDerWaalsContact ND2-O 3.15Å; N2139-V2141 PolarHBondContact O-N 2.88Å; N2139-V2141 PolarHBondContact OD1-N 3Å; N2139-V2141 VanDerWaalsContact OD1-N 3.11Å; N2139-V2141 PolarHBondContact OD1-O 2.82Å
2140	Y	43.9	Very low	67.6	Low	169.4 Å²	169.4	82.6 Å²	82.6	66%	0.664	43%	0.434	S	S	*	.	S	Bend	trans	-70.6	-13.9	177	-65.5	-82.2	0	0	0	113.3	K2165 K2166 K2243 R2289 D2290	Y2140-K2165 HydrophobicContact CD2-CD 4.17Å; Y2140-K2165 HydrophobicContact CD2-CG 4.49Å; Y2140-K2165 HydrophobicContact CG-CD 4.45Å; Y2140-K2166 HydrophobicContact CG-CD 4.47Å; Y2140-K2166 VanDerWaalsContact CG-CE 3.44Å; Y2140-K2166 VanDerWaalsContact CZ-NZ 3.33Å; Y2140-K2243 PolarHBondContact O-NZ 3Å; Y2140-R2289 VanDerWaalsContact CE1-CD 3.42Å; Y2140-R2289 HydrophobicContact CE1-CG 3.95Å; Y2140-R2289 HydrophobicContact CE2-CB 4.03Å; Y2140-R2289 HydrophobicContact CE2-CG 4.08Å; Y2140-D2290 WeakPolarHBondContact CE1-OD2 3.26Å; Y2140-D2290 WeakPolarHBondContact OH-CB 3.35Å; Y2140-D2290 PolarHBondContact OH-OD2 2.89Å
2141	V	51	Low	67.7	Low	65 Å²	65	78.7 Å²	78.7	39%	0.394	41%	0.41	S	S	.	.	S	Bend	trans	-111.1	114	164.8	-178.6	0	0	0	0	106.5	N2139 L2143	N2139-V2141 VanDerWaalsContact C-N 3.27Å; N2139-V2141 WeakPolarHBondContact CB-O 3.36Å; N2139-V2141 VanDerWaalsContact CG-O 3.25Å; N2139-V2141 PolarHBondContact ND2-O 3.07Å; N2139-V2141 VanDerWaalsContact ND2-O 3.15Å; N2139-V2141 PolarHBondContact O-N 2.88Å; N2139-V2141 PolarHBondContact OD1-N 3Å; N2139-V2141 VanDerWaalsContact OD1-N 3.11Å; N2139-V2141 PolarHBondContact OD1-O 2.82Å; V2141-L2143 PolarHBondContact O-N 3.11Å
2142	P	60.6	Low	67	Low	83.6 Å²	83.6	75.3 Å²	75.3	54%	0.543	40%	0.4	S	S	.	.	P	Polyproline II helix	trans	-63.8	138.9	173.4	18.3	-21.6	0	0	0	109.9	Q2119	Q2119-P2142 HydrophobicContact CG-CB 4.05Å; Q2119-P2142 VanDerWaalsContact OE1-CA 3.27Å
2143	L	73.8	Confident	66.5	Low	7.2 Å²	7.2	69.5 Å²	69.5	4%	0.038	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-91.6	124.4	172	-71.1	-178.7	0	0	0	110.3	L2091 F2098 L2116 Q2119 W2121 V2141 Q2147 F2149	L2091-L2143 HydrophobicContact CD1-CB 4.2Å; L2091-L2143 HydrophobicContact CD1-CD1 4.39Å; F2098-L2143 HydrophobicContact CE1-CD1 3.82Å; F2098-L2143 HydrophobicContact CZ-CD1 4.18Å; L2116-L2143 HydrophobicContact CD2-CB 3.63Å; L2116-L2143 HydrophobicContact CD2-CD1 4.38Å; Q2119-L2143 PolarHBondContact NE2-O 3.07Å; W2121-L2143 HydrophobicContact CH2-CD1 3.85Å; W2121-L2143 HydrophobicContact CZ2-CD1 3.43Å; W2121-L2143 VanDerWaalsContact CZ2-CD1 3.45Å; W2121-L2143 HydrophobicContact CZ2-CG 4.04Å; V2141-L2143 PolarHBondContact O-N 3.11Å; L2143-Q2147 HydrophobicContact CD2-CG 4.48Å; L2143-F2149 HydrophobicContact CD1-CD1 3.99Å; L2143-F2149 HydrophobicContact CD1-CD2 4.36Å; L2143-F2149 HydrophobicContact CD1-CE1 3.51Å; L2143-F2149 VanDerWaalsContact CD1-CE1 3.48Å; L2143-F2149 HydrophobicContact CD1-CE2 3.92Å; L2143-F2149 HydrophobicContact CD1-CG 4.4Å; L2143-F2149 HydrophobicContact CD1-CZ 3.47Å; L2143-F2149 VanDerWaalsContact CD1-CZ 3.46Å; L2143-F2149 HydrophobicContact CD2-CB 4.16Å; L2143-F2149 HydrophobicContact CD2-CD1 3.64Å; L2143-F2149 HydrophobicContact CD2-CD2 4.28Å; L2143-F2149 HydrophobicContact CD2-CE1 4.06Å; L2143-F2149 HydrophobicContact CD2-CG 3.76Å; L2143-F2149 HydrophobicContact CD2-CZ 4.45Å; L2143-F2149 HydrophobicContact CG-CD1 4.45Å; L2143-F2149 HydrophobicContact CG-CE1 4.43Å
2144	A	74.3	Confident	65.7	Low	57 Å²	57	62.4 Å²	62.4	47%	0.471	35%	0.345	S	S	.	.	P	Polyproline II helix	trans	-86	151.7	170.3	0	0	0	0	0	111.2	L2091 G2146 Q2147	L2091-A2144 WeakPolarHBondContact CD1-O 3.38Å; A2144-G2146 PolarHBondContact O-N 3.3Å; A2144-Q2147 HydrophobicContact CB-CB 4.43Å; A2144-Q2147 WeakPolarHBondContact O-CB 3.26Å; A2144-Q2147 PolarHBondContact O-N 2.92Å; A2144-Q2147 VanDerWaalsContact O-N 3.13Å
2145	A	77	Confident	64.8	Low	44.2 Å²	44.2	59.9 Å²	59.9	37%	0.365	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	144	165.6	0	0	0	0	0	109.9	K2092 P2093 Q2147	K2092-A2145 CarbonylContact O-C 3.52Å; K2092-A2145 WeakPolarHBondContact O-CB 3.17Å; P2093-A2145 VanDerWaalsContact O-CB 3.24Å; P2093-A2145 WeakPolarHBondContact O-CB 3.31Å; A2145-Q2147 VanDerWaalsContact C-N 3.29Å; A2145-Q2147 PolarHBondContact O-N 3.04Å
2146	G	72.3	Confident	64	Low	30.8 Å²	30.8	58.4 Å²	58.4	32%	0.318	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.3	-12.5	-172	0	0	0	0	0	115.6	L2091 K2092 A2144	L2091-G2146 CarbonylContact O-C 3.55Å; L2091-G2146 WeakPolarHBondContact O-CA 3.3Å; L2091-G2146 PolarHBondContact O-N 2.84Å; K2092-G2146 VanDerWaalsContact C-N 3.31Å; K2092-G2146 PolarHBondContact O-N 3.14Å; A2144-G2146 PolarHBondContact O-N 3.3Å
2147	Q	74.3	Confident	62.5	Low	60.8 Å²	60.8	61.6 Å²	61.6	28%	0.284	33%	0.33	S	S	.	.			trans	-73.7	143.3	-175	-171.8	173.6	-6.5	0	0	113.3	K2090 L2091 L2143 A2144 A2145	K2090-Q2147 WeakPolarHBondContact CA-O 3.21Å; L2091-Q2147 PolarHBondContact N-O 3.04Å; L2143-Q2147 HydrophobicContact CD2-CG 4.48Å; A2144-Q2147 HydrophobicContact CB-CB 4.43Å; A2144-Q2147 WeakPolarHBondContact O-CB 3.26Å; A2144-Q2147 PolarHBondContact O-N 2.92Å; A2144-Q2147 VanDerWaalsContact O-N 3.13Å; A2145-Q2147 VanDerWaalsContact C-N 3.29Å; A2145-Q2147 PolarHBondContact O-N 3.04Å
2148	E	75.6	Confident	61.4	Low	97.4 Å²	97.4	59.6 Å²	59.6	46%	0.455	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	133.6	168.6	-168.7	177.6	138	0	0	110.5	K2088 I2089 K2090	K2088-E2148 HydrophobicContact CD-CG 4.18Å; K2088-E2148 VanDerWaalsContact CD-OE1 3.26Å; K2088-E2148 WeakPolarHBondContact CD-OE1 3.3Å; K2088-E2148 WeakPolarHBondContact CE-OE1 3.43Å; K2088-E2148 HydrophobicContact CG-CG 4.11Å; K2088-E2148 IonicContact NZ-OE1 3.22Å; K2088-E2148 PolarHBondContact NZ-OE1 3.1Å; I2089-E2148 CarbonylContact O-C 3.53Å; I2089-E2148 VanDerWaalsContact O-CA 3.29Å; I2089-E2148 WeakPolarHBondContact O-CA 3.28Å; K2090-E2148 HydrophobicContact CB-CB 4.37Å; K2090-E2148 HydrophobicContact CB-CG 4.21Å; K2090-E2148 WeakPolarHBondContact CD-OE2 3.47Å; K2090-E2148 HydrophobicContact CG-CB 4.23Å; K2090-E2148 HydrophobicContact CG-CG 4.25Å; K2090-E2148 IonicContact NZ-OE2 2.82Å; K2090-E2148 PolarHBondContact NZ-OE2 3.06Å
2149	F	70.9	Confident	60.3	Low	26.8 Å²	26.8	58.4 Å²	58.4	12%	0.118	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	151.3	-179.8	67.2	-81.2	0	0	0	112.9	K2088 I2089 L2091 F2098 W2121 L2143 L2151	K2088-F2149 WeakPolarHBondContact CA-O 3.15Å; I2089-F2149 HydrophobicContact CB-CD1 4.27Å; I2089-F2149 HydrophobicContact CB-CE1 3.7Å; I2089-F2149 HydrophobicContact CB-CE2 4.14Å; I2089-F2149 HydrophobicContact CB-CZ 3.62Å; I2089-F2149 HydrophobicContact CD1-CE2 4.03Å; I2089-F2149 HydrophobicContact CD1-CZ 3.83Å; I2089-F2149 HydrophobicContact CG1-CE2 4.47Å; I2089-F2149 HydrophobicContact CG1-CZ 4.25Å; I2089-F2149 HydrophobicContact CG2-CD1 4.48Å; I2089-F2149 HydrophobicContact CG2-CE1 3.64Å; I2089-F2149 HydrophobicContact CG2-CZ 3.72Å; I2089-F2149 PolarHBondContact N-O 3.13Å; I2089-F2149 WeakPolarHBondContact O-CD1 3.41Å; I2089-F2149 PolarHBondContact O-N 2.93Å; L2091-F2149 HydrophobicContact CD1-CE1 4.08Å; L2091-F2149 HydrophobicContact CD2-CE1 4.17Å; L2091-F2149 HydrophobicContact CG-CE1 3.97Å; F2098-F2149 HydrophobicContact CE1-CE1 4.44Å; F2098-F2149 AromaticContact CE1-CZ 3.91Å; F2098-F2149 HydrophobicContact CE1-CZ 3.99Å; F2098-F2149 HydrophobicContact CE2-CZ 4.29Å; F2098-F2149 HydrophobicContact CZ-CE1 4.4Å; F2098-F2149 HydrophobicContact CZ-CE2 4.38Å; F2098-F2149 AromaticContact CZ-CZ 3.6Å; F2098-F2149 HydrophobicContact CZ-CZ 3.6Å; W2121-F2149 HydrophobicContact CH2-CE2 4.3Å; L2143-F2149 HydrophobicContact CD1-CD1 3.99Å; L2143-F2149 HydrophobicContact CD1-CD2 4.36Å; L2143-F2149 HydrophobicContact CD1-CE1 3.51Å; L2143-F2149 VanDerWaalsContact CD1-CE1 3.48Å; L2143-F2149 HydrophobicContact CD1-CE2 3.92Å; L2143-F2149 HydrophobicContact CD1-CG 4.4Å; L2143-F2149 HydrophobicContact CD1-CZ 3.47Å; L2143-F2149 VanDerWaalsContact CD1-CZ 3.46Å; L2143-F2149 HydrophobicContact CD2-CB 4.16Å; L2143-F2149 HydrophobicContact CD2-CD1 3.64Å; L2143-F2149 HydrophobicContact CD2-CD2 4.28Å; L2143-F2149 HydrophobicContact CD2-CE1 4.06Å; L2143-F2149 HydrophobicContact CD2-CG 3.76Å; L2143-F2149 HydrophobicContact CD2-CZ 4.45Å; L2143-F2149 HydrophobicContact CG-CD1 4.45Å; L2143-F2149 HydrophobicContact CG-CE1 4.43Å; F2149-L2151 HydrophobicContact CD2-CB 4.4Å; F2149-L2151 HydrophobicContact CE2-CB 4.12Å; F2149-L2151 HydrophobicContact CE2-CD1 4.48Å; F2149-L2151 PolarHBondContact O-N 2.81Å
2150	D	68.7	Low	59.8	Low	94.2 Å²	94.2	57.2 Å²	57.2	50%	0.504	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	116.6	172.3	-62.8	-40	0	0	0	110.1	K2088 R2167	K2088-D2150 WeakPolarHBondContact CB-OD1 3.26Å; K2088-D2150 VanDerWaalsContact CE-OD1 3.26Å; K2088-D2150 WeakPolarHBondContact CE-OD1 3.36Å; K2088-D2150 WeakPolarHBondContact CG-OD1 3.25Å; K2088-D2150 IonicContact NZ-OD1 2.67Å; K2088-D2150 IonicContact NZ-OD2 3.46Å; D2150-R2167 PolarHBondContact O-NH1 2.76Å; D2150-R2167 PolarHBondContact O-NH2 2.71Å
2151	L	69.1	Low	60.2	Low	13.8 Å²	13.8	53.5 Å²	53.5	7%	0.072	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	128.9	168.9	-176	65.3	0	0	0	109.6	T2087 I2089 L2100 L2112 W2121 F2149 F2162	T2087-L2151 HydrophobicContact CG2-CB 3.96Å; T2087-L2151 HydrophobicContact CG2-CD2 4.26Å; T2087-L2151 HydrophobicContact CG2-CG 4.43Å; T2087-L2151 PolarHBondContact N-O 3Å; T2087-L2151 PolarHBondContact O-N 2.82Å; T2087-L2151 VanDerWaalsContact O-O 3.07Å; I2089-L2151 HydrophobicContact CD1-CB 4.09Å; I2089-L2151 HydrophobicContact CD1-CD2 3.87Å; I2089-L2151 HydrophobicContact CD1-CG 4.5Å; L2100-L2151 HydrophobicContact CD2-CD2 3.48Å; L2100-L2151 VanDerWaalsContact CD2-CD2 3.47Å; L2112-L2151 HydrophobicContact CD2-CD1 4.45Å; L2112-L2151 HydrophobicContact CD2-CD2 4.08Å; W2121-L2151 HydrophobicContact CH2-CD1 4.33Å; W2121-L2151 HydrophobicContact CZ3-CD1 4Å; F2149-L2151 HydrophobicContact CD2-CB 4.4Å; F2149-L2151 HydrophobicContact CE2-CB 4.12Å; F2149-L2151 HydrophobicContact CE2-CD1 4.48Å; F2149-L2151 PolarHBondContact O-N 2.81Å; L2151-F2162 HydrophobicContact CD1-CD1 3.95Å; L2151-F2162 HydrophobicContact CD1-CE1 4.01Å; L2151-F2162 HydrophobicContact CD2-CE1 4.22Å; L2151-F2162 HydrophobicContact CG-CD1 4.42Å; L2151-F2162 HydrophobicContact CG-CE1 4.26Å
2152	T	58.8	Low	60.2	Low	21.4 Å²	21.4	51.8 Å²	51.8	13%	0.131	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	133.7	175.5	-58.2	0	0	0	0	110.2	K2084 I2085 I2086 D2163 K2165 R2167	K2084-T2152 HydrophobicContact CD-CG2 4.42Å; K2084-T2152 VanDerWaalsContact CE-CG2 3.48Å; K2084-T2152 HydrophobicContact CG-CG2 4.38Å; I2085-T2152 VanDerWaalsContact O-CA 3.31Å; I2085-T2152 WeakPolarHBondContact O-CA 3.25Å; I2085-T2152 WeakPolarHBondContact O-CG2 3.29Å; I2086-T2152 HydrophobicContact CG1-CG2 4.25Å; T2152-D2163 HydrophobicContact CG2-CB 3.61Å; T2152-D2163 VanDerWaalsContact CG2-OD2 3.28Å; T2152-D2163 WeakPolarHBondContact CG2-OD2 3.43Å; T2152-D2163 VanDerWaalsContact O-CB 3.28Å; T2152-D2163 WeakPolarHBondContact O-CB 3.06Å; T2152-D2163 PolarHBondContact O-N 3.06Å; T2152-D2163 VanDerWaalsContact O-N 3.16Å; T2152-K2165 PolarHBondContact OG1-NZ 3.05Å; T2152-R2167 VanDerWaalsContact CB-NH2 3.27Å; T2152-R2167 PolarHBondContact OG1-NH2 2.86Å
2153	G	62.1	Low	59.4	Low	1.2 Å²	1.2	50.1 Å²	50.1	1%	0.012	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138	131.6	172.7	0	0	0	0	0	110.8	K2084 I2085 Q2161	K2084-G2153 CarbonylContact C-O 3.56Å; K2084-G2153 WeakPolarHBondContact CA-O 3.42Å; K2084-G2153 WeakPolarHBondContact CG-O 3.39Å; I2085-G2153 PolarHBondContact N-O 2.94Å; I2085-G2153 PolarHBondContact O-N 3.12Å; I2085-G2153 VanDerWaalsContact O-N 3.1Å; G2153-Q2161 CarbonylContact C-O 3.4Å; G2153-Q2161 VanDerWaalsContact CA-O 3.27Å; G2153-Q2161 WeakPolarHBondContact CA-O 3.3Å
2154	N	56	Low	57.6	Low	28.4 Å²	28.4	57.8 Å²	57.8	15%	0.152	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	139.2	168.5	-47.1	-57.3	0	0	0	107.5	K2084 I2156 I2160 Q2161 D2163 K2165	K2084-N2154 PolarHBondContact NZ-OD1 2.82Å; N2154-I2156 HydrophobicContact CB-CD1 4.4Å; N2154-I2156 HydrophobicContact CB-CG1 4.34Å; N2154-I2160 CarbonylContact O-C 3.54Å; N2154-I2160 WeakPolarHBondContact O-CA 3.4Å; N2154-Q2161 HydrophobicContact CB-CB 4.49Å; N2154-Q2161 PolarHBondContact N-O 3Å; N2154-Q2161 PolarHBondContact ND2-OE1 2.79Å; N2154-Q2161 CarbonylContact O-C 3.56Å; N2154-Q2161 WeakPolarHBondContact O-CA 3.33Å; N2154-Q2161 PolarHBondContact O-N 2.95Å; N2154-D2163 PolarHBondContact ND2-OD1 3.09Å; N2154-K2165 PolarHBondContact ND2-NZ 2.78Å
2155	I	53	Low	55.7	Low	10.8 Å²	10.8	60 Å²	60	6%	0.055	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	120.2	171.3	-60.5	177.9	0	0	0	107.1	L2082 R2083 I2085 M2102 L2159 I2160	L2082-I2155 HydrophobicContact CB-CD1 4.32Å; L2082-I2155 HydrophobicContact CD2-CD1 3.79Å; L2082-I2155 HydrophobicContact CD2-CG1 4.37Å; L2082-I2155 HydrophobicContact CG-CD1 4.22Å; L2082-I2155 VanDerWaalsContact O-CB 3.28Å; L2082-I2155 WeakPolarHBondContact O-CB 3.34Å; L2082-I2155 WeakPolarHBondContact O-CD1 3.24Å; L2082-I2155 VanDerWaalsContact O-CG1 3.27Å; L2082-I2155 WeakPolarHBondContact O-CG1 3.47Å; L2082-I2155 WeakPolarHBondContact O-CG2 3.5Å; R2083-I2155 PolarHBondContact O-N 3.12Å; I2085-I2155 HydrophobicContact CD1-CD1 3.96Å; I2085-I2155 HydrophobicContact CD1-CG1 4.02Å; I2085-I2155 HydrophobicContact CG1-CD1 4.24Å; M2102-I2155 HydrophobicContact SD-CD1 4.01Å; I2155-L2159 WeakPolarHBondContact CA-O 3.47Å; I2155-I2160 HydrophobicContact CD1-CD1 4.28Å; I2155-I2160 HydrophobicContact CD1-CG1 4.27Å; I2155-I2160 HydrophobicContact CG1-CB 4.3Å; I2155-I2160 HydrophobicContact CG1-CD1 4.3Å; I2155-I2160 HydrophobicContact CG1-CG1 3.86Å
2156	I	42.8	Very low	53.8	Low	80 Å²	80	63.8 Å²	63.8	41%	0.41	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	117.5	-177.8	-56	176.8	0	0	0	106.5	N2154 G2158 L2159 Q2161	N2154-I2156 HydrophobicContact CB-CD1 4.4Å; N2154-I2156 HydrophobicContact CB-CG1 4.34Å; I2156-G2158 VanDerWaalsContact C-N 3.26Å; I2156-G2158 PolarHBondContact O-N 3.03Å; I2156-G2158 VanDerWaalsContact O-N 3.13Å; I2156-L2159 PolarHBondContact N-O 3.02Å; I2156-L2159 WeakPolarHBondContact O-CB 3.25Å; I2156-L2159 PolarHBondContact O-N 3.02Å; I2156-Q2161 HydrophobicContact CD1-CB 4.4Å
2157	N	42.5	Very low	52.3	Low	143.2 Å²	143.2	68.7 Å²	68.7	77%	0.766	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	38.5	-179.5	-53.7	-3.3	0	0	0	113.3	L2159	N2157-L2159 VanDerWaalsContact C-N 3.29Å; N2157-L2159 PolarHBondContact O-N 3.05Å; N2157-L2159 VanDerWaalsContact O-N 3.12Å
2158	G	41.5	Very low	50.8	Low	33.2 Å²	33.2	68.4 Å²	68.4	34%	0.342	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	78	-8.2	-176.9	0	0	0	0	0	115.7	I2156	I2156-G2158 VanDerWaalsContact C-N 3.26Å; I2156-G2158 PolarHBondContact O-N 3.03Å; I2156-G2158 VanDerWaalsContact O-N 3.13Å
2159	L	39.2	Very low	49.9	Very low	104 Å²	104	66.7 Å²	66.7	55%	0.545	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	136.5	173.5	-65.1	172.4	0	0	0	110.5	I2155 I2156 N2157 Q2161	I2155-L2159 WeakPolarHBondContact CA-O 3.47Å; I2156-L2159 PolarHBondContact N-O 3.02Å; I2156-L2159 WeakPolarHBondContact O-CB 3.25Å; I2156-L2159 PolarHBondContact O-N 3.02Å; N2157-L2159 VanDerWaalsContact C-N 3.29Å; N2157-L2159 PolarHBondContact O-N 3.05Å; N2157-L2159 VanDerWaalsContact O-N 3.12Å; L2159-Q2161 PolarHBondContact O-N 2.98Å
2160	I	49.2	Very low	49.6	Very low	28.8 Å²	28.8	66 Å²	66	15%	0.148	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	111.3	171.6	-142.4	166.3	0	0	0	110.7	I2085 W2110 V2123 N2154 I2155 F2162	I2085-I2160 HydrophobicContact CD1-CD1 3.56Å; I2085-I2160 VanDerWaalsContact CD1-CD1 3.45Å; I2085-I2160 HydrophobicContact CD1-CG1 3.98Å; W2110-I2160 HydrophobicContact CB-CG2 4.28Å; W2110-I2160 HydrophobicContact CD2-CB 4.26Å; W2110-I2160 HydrophobicContact CD2-CD1 4.05Å; W2110-I2160 HydrophobicContact CD2-CG2 3.87Å; W2110-I2160 VanDerWaalsContact CD2-CG2 3.45Å; W2110-I2160 HydrophobicContact CE3-CD1 4.28Å; W2110-I2160 HydrophobicContact CE3-CG2 4.01Å; W2110-I2160 HydrophobicContact CG-CB 4.33Å; W2110-I2160 HydrophobicContact CG-CD1 3.65Å; W2110-I2160 HydrophobicContact CG-CG2 3.93Å; W2110-I2160 HydrophobicContact CH2-CD1 3.58Å; W2110-I2160 VanDerWaalsContact CH2-CD1 3.46Å; W2110-I2160 HydrophobicContact CZ2-CD1 3.45Å; W2110-I2160 HydrophobicContact CZ3-CD1 4.03Å; W2110-I2160 HydrophobicContact CZ3-CG2 4.43Å; V2123-I2160 HydrophobicContact CG1-CG2 4.25Å; N2154-I2160 CarbonylContact O-C 3.54Å; N2154-I2160 WeakPolarHBondContact O-CA 3.4Å; I2155-I2160 HydrophobicContact CD1-CD1 4.28Å; I2155-I2160 HydrophobicContact CD1-CG1 4.27Å; I2155-I2160 HydrophobicContact CG1-CB 4.3Å; I2155-I2160 HydrophobicContact CG1-CD1 4.3Å; I2155-I2160 HydrophobicContact CG1-CG1 3.86Å; I2160-F2162 VanDerWaalsContact C-N 3.34Å; I2160-F2162 HydrophobicContact CB-CE2 4.42Å; I2160-F2162 HydrophobicContact CD1-CD1 4.2Å; I2160-F2162 HydrophobicContact CD1-CE1 3.59Å; I2160-F2162 VanDerWaalsContact CD1-CE1 3.47Å; I2160-F2162 HydrophobicContact CD1-CE2 4.02Å; I2160-F2162 HydrophobicContact CD1-CZ 3.5Å; I2160-F2162 VanDerWaalsContact CD1-CZ 3.45Å; I2160-F2162 HydrophobicContact CG1-CD1 4.29Å; I2160-F2162 HydrophobicContact CG1-CD2 4.16Å; I2160-F2162 HydrophobicContact CG1-CE1 4.05Å; I2160-F2162 HydrophobicContact CG1-CE2 4.03Å; I2160-F2162 HydrophobicContact CG1-CG 4.34Å; I2160-F2162 HydrophobicContact CG1-CZ 3.86Å; I2160-F2162 HydrophobicContact CG2-CD1 4.03Å; I2160-F2162 HydrophobicContact CG2-CD2 3.97Å; I2160-F2162 HydrophobicContact CG2-CE1 3.96Å; I2160-F2162 HydrophobicContact CG2-CE2 3.71Å; I2160-F2162 VanDerWaalsContact CG2-CE2 3.45Å; I2160-F2162 HydrophobicContact CG2-CG 3.86Å; I2160-F2162 HydrophobicContact CG2-CZ 3.96Å; I2160-F2162 PolarHBondContact O-N 2.87Å; I2160-F2162 VanDerWaalsContact O-N 3.1Å
2161	Q	52.2	Low	49.6	Very low	91.2 Å²	91.2	63.4 Å²	63.4	43%	0.426	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	95.3	163.2	-173.2	-170.7	54.5	0	0	108.4	G2153 N2154 I2156 L2159 D2163	G2153-Q2161 CarbonylContact C-O 3.4Å; G2153-Q2161 VanDerWaalsContact CA-O 3.27Å; G2153-Q2161 WeakPolarHBondContact CA-O 3.3Å; N2154-Q2161 HydrophobicContact CB-CB 4.49Å; N2154-Q2161 PolarHBondContact N-O 3Å; N2154-Q2161 PolarHBondContact ND2-OE1 2.79Å; N2154-Q2161 CarbonylContact O-C 3.56Å; N2154-Q2161 WeakPolarHBondContact O-CA 3.33Å; N2154-Q2161 PolarHBondContact O-N 2.95Å; I2156-Q2161 HydrophobicContact CD1-CB 4.4Å; L2159-Q2161 PolarHBondContact O-N 2.98Å; Q2161-D2163 PolarHBondContact O-N 2.83Å; Q2161-D2163 VanDerWaalsContact O-N 3.15Å
2162	F	51.4	Low	50	Low	30.8 Å²	30.8	62.8 Å²	62.8	14%	0.135	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	131.5	164.3	-68.1	-72	0	0	0	109	W2110 L2112 V2123 F2137 L2151 I2160 K2164	W2110-F2162 AromaticContact CE3-CZ 3.78Å; W2110-F2162 HydrophobicContact CE3-CZ 4.02Å; W2110-F2162 HydrophobicContact CH2-CE1 4.08Å; W2110-F2162 HydrophobicContact CH2-CZ 4.29Å; W2110-F2162 AromaticContact CZ3-CE1 3.88Å; W2110-F2162 HydrophobicContact CZ3-CE1 3.88Å; W2110-F2162 AromaticContact CZ3-CZ 3.65Å; W2110-F2162 HydrophobicContact CZ3-CZ 3.99Å; W2110-F2162 VanDerWaalsContact CZ3-CZ 3.48Å; L2112-F2162 HydrophobicContact CB-CE1 4.49Å; L2112-F2162 HydrophobicContact CB-CE2 4.22Å; L2112-F2162 HydrophobicContact CB-CZ 3.93Å; L2112-F2162 HydrophobicContact CD1-CE2 4.3Å; L2112-F2162 HydrophobicContact CD1-CZ 4.41Å; L2112-F2162 HydrophobicContact CD2-CD1 4.41Å; L2112-F2162 HydrophobicContact CD2-CE1 4.04Å; L2112-F2162 HydrophobicContact CD2-CE2 4.28Å; L2112-F2162 HydrophobicContact CD2-CZ 3.83Å; L2112-F2162 HydrophobicContact CG-CE2 4.4Å; L2112-F2162 HydrophobicContact CG-CZ 4.2Å; V2123-F2162 HydrophobicContact CB-CE2 4.36Å; V2123-F2162 HydrophobicContact CG1-CE2 4.08Å; V2123-F2162 HydrophobicContact CG2-CD2 4.02Å; V2123-F2162 HydrophobicContact CG2-CE2 3.83Å; V2123-F2162 VanDerWaalsContact CG2-CE2 3.48Å; V2123-F2162 HydrophobicContact CG2-CZ 4.3Å; F2137-F2162 HydrophobicContact CE1-CD2 4.22Å; F2137-F2162 HydrophobicContact CZ-CB 4.4Å; F2137-F2162 HydrophobicContact CZ-CD2 4.18Å; F2137-F2162 HydrophobicContact CZ-CG 4.36Å; L2151-F2162 HydrophobicContact CD1-CD1 3.95Å; L2151-F2162 HydrophobicContact CD1-CE1 4.01Å; L2151-F2162 HydrophobicContact CD2-CE1 4.22Å; L2151-F2162 HydrophobicContact CG-CD1 4.42Å; L2151-F2162 HydrophobicContact CG-CE1 4.26Å; I2160-F2162 VanDerWaalsContact C-N 3.34Å; I2160-F2162 HydrophobicContact CB-CE2 4.42Å; I2160-F2162 HydrophobicContact CD1-CD1 4.2Å; I2160-F2162 HydrophobicContact CD1-CE1 3.59Å; I2160-F2162 VanDerWaalsContact CD1-CE1 3.47Å; I2160-F2162 HydrophobicContact CD1-CE2 4.02Å; I2160-F2162 HydrophobicContact CD1-CZ 3.5Å; I2160-F2162 VanDerWaalsContact CD1-CZ 3.45Å; I2160-F2162 HydrophobicContact CG1-CD1 4.29Å; I2160-F2162 HydrophobicContact CG1-CD2 4.16Å; I2160-F2162 HydrophobicContact CG1-CE1 4.05Å; I2160-F2162 HydrophobicContact CG1-CE2 4.03Å; I2160-F2162 HydrophobicContact CG1-CG 4.34Å; I2160-F2162 HydrophobicContact CG1-CZ 3.86Å; I2160-F2162 HydrophobicContact CG2-CD1 4.03Å; I2160-F2162 HydrophobicContact CG2-CD2 3.97Å; I2160-F2162 HydrophobicContact CG2-CE1 3.96Å; I2160-F2162 HydrophobicContact CG2-CE2 3.71Å; I2160-F2162 VanDerWaalsContact CG2-CE2 3.45Å; I2160-F2162 HydrophobicContact CG2-CG 3.86Å; I2160-F2162 HydrophobicContact CG2-CZ 3.96Å; I2160-F2162 PolarHBondContact O-N 2.87Å; I2160-F2162 VanDerWaalsContact O-N 3.1Å; F2162-K2164 PolarHBondContact O-N 2.9Å; F2162-K2164 VanDerWaalsContact O-N 3.16Å
2163	D	42.6	Very low	51	Low	46.6 Å²	46.6	63.8 Å²	63.8	25%	0.249	31%	0.313	C	S	.	.			trans	-68.6	94.2	-171.8	-134.3	-6	0	0	0	109.2	K2084 T2152 N2154 Q2161 K2165 K2166 R2167	K2084-D2163 IonicContact NZ-OD2 3.58Å; K2084-D2163 PolarHBondContact NZ-OD2 3.29Å; T2152-D2163 HydrophobicContact CG2-CB 3.61Å; T2152-D2163 VanDerWaalsContact CG2-OD2 3.28Å; T2152-D2163 WeakPolarHBondContact CG2-OD2 3.43Å; T2152-D2163 VanDerWaalsContact O-CB 3.28Å; T2152-D2163 WeakPolarHBondContact O-CB 3.06Å; T2152-D2163 PolarHBondContact O-N 3.06Å; T2152-D2163 VanDerWaalsContact O-N 3.16Å; N2154-D2163 PolarHBondContact ND2-OD1 3.09Å; Q2161-D2163 PolarHBondContact O-N 2.83Å; Q2161-D2163 VanDerWaalsContact O-N 3.15Å; D2163-K2165 CarbonylContact C-O 3.59Å; D2163-K2165 HydrophobicContact CB-CB 4.44Å; D2163-K2165 HydrophobicContact CB-CG 4.16Å; D2163-K2165 PolarHBondContact O-N 3.03Å; D2163-K2165 WeakPolarHBondContact OD1-CD 3.26Å; D2163-K2165 WeakPolarHBondContact OD1-CE 3.32Å; D2163-K2165 VanDerWaalsContact OD1-CG 3.31Å; D2163-K2165 WeakPolarHBondContact OD1-CG 3.16Å; D2163-K2165 IonicContact OD1-NZ 2.64Å; D2163-K2165 WeakPolarHBondContact OD2-CD 3.25Å; D2163-K2165 VanDerWaalsContact OD2-CE 3.25Å; D2163-K2165 WeakPolarHBondContact OD2-CE 3.26Å; D2163-K2165 VanDerWaalsContact OD2-CG 3.3Å; D2163-K2165 WeakPolarHBondContact OD2-CG 3.48Å; D2163-K2165 IonicContact OD2-NZ 3.79Å; D2163-K2165 PolarHBondContact OD2-NZ 3.23Å; D2163-K2166 HydrophobicContact CB-CG 4.06Å; D2163-K2166 VanDerWaalsContact CG-CE 3.42Å; D2163-K2166 VanDerWaalsContact OD1-CE 3.31Å; D2163-K2166 WeakPolarHBondContact OD1-CE 3.45Å; D2163-K2166 VanDerWaalsContact OD2-CD 3.25Å; D2163-K2166 WeakPolarHBondContact OD2-CD 3.38Å; D2163-K2166 WeakPolarHBondContact OD2-CE 3.48Å; D2163-R2167 HydrophobicContact CB-CG 3.91Å; D2163-R2167 IonicContact OD2-NE 2.76Å
2164	K	36.4	Very low	51.8	Low	169.2 Å²	169.2	63.8 Å²	63.8	74%	0.736	31%	0.313	S	S	*	.			trans	-70.8	51.8	170.7	-90.6	-170.8	178.1	-177	0	109.6	F2162 K2166 R2289 D2290	F2162-K2164 PolarHBondContact O-N 2.9Å; F2162-K2164 VanDerWaalsContact O-N 3.16Å; K2164-K2166 VanDerWaalsContact C-N 3.31Å; K2164-K2166 WeakPolarHBondContact O-CA 3.35Å; K2164-K2166 WeakPolarHBondContact O-CG 3.49Å; K2164-K2166 PolarHBondContact O-N 3.03Å; K2164-K2166 VanDerWaalsContact O-N 3.08Å; K2164-R2289 PolarHBondContact NZ-O 3.19Å; K2164-D2290 PolarHBondContact NZ-O 3.36Å
2165	K	33.4	Very low	53.2	Low	103.8 Å²	103.8	64.9 Å²	64.9	45%	0.451	32%	0.317	S	S	.	.			trans	-44.4	95.9	173.5	-79.6	176.3	176.4	165.6	0	109.5	Y2140 T2152 N2154 D2163 R2167	Y2140-K2165 HydrophobicContact CD2-CD 4.17Å; Y2140-K2165 HydrophobicContact CD2-CG 4.49Å; Y2140-K2165 HydrophobicContact CG-CD 4.45Å; T2152-K2165 PolarHBondContact OG1-NZ 3.05Å; N2154-K2165 PolarHBondContact ND2-NZ 2.78Å; D2163-K2165 CarbonylContact C-O 3.59Å; D2163-K2165 HydrophobicContact CB-CB 4.44Å; D2163-K2165 HydrophobicContact CB-CG 4.16Å; D2163-K2165 PolarHBondContact O-N 3.03Å; D2163-K2165 WeakPolarHBondContact OD1-CD 3.26Å; D2163-K2165 WeakPolarHBondContact OD1-CE 3.32Å; D2163-K2165 VanDerWaalsContact OD1-CG 3.31Å; D2163-K2165 WeakPolarHBondContact OD1-CG 3.16Å; D2163-K2165 IonicContact OD1-NZ 2.64Å; D2163-K2165 WeakPolarHBondContact OD2-CD 3.25Å; D2163-K2165 VanDerWaalsContact OD2-CE 3.25Å; D2163-K2165 WeakPolarHBondContact OD2-CE 3.26Å; D2163-K2165 VanDerWaalsContact OD2-CG 3.3Å; D2163-K2165 WeakPolarHBondContact OD2-CG 3.48Å; D2163-K2165 IonicContact OD2-NZ 3.79Å; D2163-K2165 PolarHBondContact OD2-NZ 3.23Å; K2165-R2167 PolarHBondContact O-N 2.93Å
2166	K	37.1	Very low	54.8	Low	122.6 Å²	122.6	64.4 Å²	64.4	53%	0.533	32%	0.315	S	S	.	.			trans	-60	97.2	159.3	-66.5	-176.1	-179	-162.7	0	107.5	Y2140 D2163 K2164 P2168 Y2169	Y2140-K2166 HydrophobicContact CG-CD 4.47Å; Y2140-K2166 VanDerWaalsContact CG-CE 3.44Å; Y2140-K2166 VanDerWaalsContact CZ-NZ 3.33Å; D2163-K2166 HydrophobicContact CB-CG 4.06Å; D2163-K2166 VanDerWaalsContact CG-CE 3.42Å; D2163-K2166 VanDerWaalsContact OD1-CE 3.31Å; D2163-K2166 WeakPolarHBondContact OD1-CE 3.45Å; D2163-K2166 VanDerWaalsContact OD2-CD 3.25Å; D2163-K2166 WeakPolarHBondContact OD2-CD 3.38Å; D2163-K2166 WeakPolarHBondContact OD2-CE 3.48Å; K2164-K2166 VanDerWaalsContact C-N 3.31Å; K2164-K2166 WeakPolarHBondContact O-CA 3.35Å; K2164-K2166 WeakPolarHBondContact O-CG 3.49Å; K2164-K2166 PolarHBondContact O-N 3.03Å; K2164-K2166 VanDerWaalsContact O-N 3.08Å; K2166-P2168 WeakPolarHBondContact O-CA 3.4Å; K2166-P2168 WeakPolarHBondContact O-CD 3.5Å; K2166-Y2169 HydrophobicContact CB-CD1 3.96Å; K2166-Y2169 HydrophobicContact CB-CE1 3.94Å; K2166-Y2169 HydrophobicContact CB-CE2 4.45Å; K2166-Y2169 HydrophobicContact CD-CD1 4.35Å; K2166-Y2169 HydrophobicContact CD-CE1 3.54Å; K2166-Y2169 HydrophobicContact CD-CE2 4.11Å; K2166-Y2169 HydrophobicContact CG-CD1 4.27Å; K2166-Y2169 HydrophobicContact CG-CE1 4.04Å; K2166-Y2169 HydrophobicContact CG-CE2 4.22Å; K2166-Y2169 PolarHBondContact NZ-OH 3.1Å
2167	R	41.1	Very low	56.8	Low	135 Å²	135	61.2 Å²	61.2	51%	0.509	30%	0.299	S	S	.	.			trans	-65.7	134.2	173	-73.9	-176.6	179.9	171.2	3.9	107	D2150 T2152 D2163 K2165 Y2169 A2244	D2150-R2167 PolarHBondContact O-NH1 2.76Å; D2150-R2167 PolarHBondContact O-NH2 2.71Å; T2152-R2167 VanDerWaalsContact CB-NH2 3.27Å; T2152-R2167 PolarHBondContact OG1-NH2 2.86Å; D2163-R2167 HydrophobicContact CB-CG 3.91Å; D2163-R2167 IonicContact OD2-NE 2.76Å; K2165-R2167 PolarHBondContact O-N 2.93Å; R2167-Y2169 VanDerWaalsContact C-N 3.33Å; R2167-Y2169 WeakPolarHBondContact O-CA 3.39Å; R2167-Y2169 WeakPolarHBondContact O-CB 3.37Å; R2167-Y2169 PolarHBondContact O-N 2.82Å; R2167-Y2169 VanDerWaalsContact O-N 3.15Å; R2167-A2244 HydrophobicContact CB-CB 4.23Å
2168	P	43.5	Very low	58.8	Low	54.2 Å²	54.2	54.4 Å²	54.4	35%	0.352	26%	0.263	S	S	.	.			trans	-52	128.7	-178	20.9	-32.4	0	0	0	109.2	K2166 T2170 F2241 A2244 M2253 N2286	K2166-P2168 WeakPolarHBondContact O-CA 3.4Å; K2166-P2168 WeakPolarHBondContact O-CD 3.5Å; P2168-T2170 PolarHBondContact O-N 2.95Å; P2168-T2170 VanDerWaalsContact O-N 3.17Å; P2168-F2241 HydrophobicContact CB-CB 4.38Å; P2168-F2241 HydrophobicContact CB-CD1 4.13Å; P2168-F2241 HydrophobicContact CG-CD1 4.35Å; P2168-A2244 PolarHBondContact O-N 2.87Å; P2168-M2253 HydrophobicContact CB-CE 3.96Å; P2168-M2253 HydrophobicContact CB-CG 4.03Å; P2168-M2253 HydrophobicContact CB-SD 3.46Å; P2168-M2253 WeakPolarHBondContact CB-SD 3.39Å; P2168-M2253 HydrophobicContact CG-CE 3.9Å; P2168-M2253 HydrophobicContact CG-CG 3.52Å; P2168-M2253 HydrophobicContact CG-SD 3.6Å; P2168-N2286 VanDerWaalsContact CB-OD1 3.24Å; P2168-N2286 WeakPolarHBondContact CB-OD1 3.46Å
2169	Y	56.9	Low	60.7	Low	61.6 Å²	61.6	56.3 Å²	56.3	24%	0.242	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	120.6	177.1	61.9	-82.7	0	0	0	107.5	K2166 R2167 L2171 F2241 V2242 K2243 N2286 Y2287	K2166-Y2169 HydrophobicContact CB-CD1 3.96Å; K2166-Y2169 HydrophobicContact CB-CE1 3.94Å; K2166-Y2169 HydrophobicContact CB-CE2 4.45Å; K2166-Y2169 HydrophobicContact CD-CD1 4.35Å; K2166-Y2169 HydrophobicContact CD-CE1 3.54Å; K2166-Y2169 HydrophobicContact CD-CE2 4.11Å; K2166-Y2169 HydrophobicContact CG-CD1 4.27Å; K2166-Y2169 HydrophobicContact CG-CE1 4.04Å; K2166-Y2169 HydrophobicContact CG-CE2 4.22Å; K2166-Y2169 PolarHBondContact NZ-OH 3.1Å; R2167-Y2169 VanDerWaalsContact C-N 3.33Å; R2167-Y2169 WeakPolarHBondContact O-CA 3.39Å; R2167-Y2169 WeakPolarHBondContact O-CB 3.37Å; R2167-Y2169 PolarHBondContact O-N 2.82Å; R2167-Y2169 VanDerWaalsContact O-N 3.15Å; Y2169-L2171 VanDerWaalsContact C-N 3.32Å; Y2169-L2171 HydrophobicContact CD2-CB 4.23Å; Y2169-L2171 HydrophobicContact CE2-CB 4.24Å; Y2169-L2171 PolarHBondContact O-N 2.89Å; Y2169-F2241 HydrophobicContact CD2-CD2 4.4Å; Y2169-F2241 AromaticContact CD2-CE2 3.7Å; Y2169-F2241 HydrophobicContact CD2-CE2 3.7Å; Y2169-F2241 HydrophobicContact CD2-CZ 4.42Å; Y2169-F2241 HydrophobicContact CE2-CE2 4.14Å; Y2169-F2241 CarbonylContact O-C 3.53Å; Y2169-F2241 WeakPolarHBondContact O-CA 3.29Å; Y2169-V2242 CarbonylContact C-O 3.52Å; Y2169-V2242 WeakPolarHBondContact CA-O 3.34Å; Y2169-V2242 VanDerWaalsContact CB-O 3.25Å; Y2169-V2242 WeakPolarHBondContact CB-O 3.33Å; Y2169-V2242 PolarHBondContact N-O 2.82Å; Y2169-V2242 PolarHBondContact O-N 2.85Å; Y2169-K2243 HydrophobicContact CG-CD 4.46Å; Y2169-N2286 PolarHBondContact O-OD1 3.39Å; Y2169-Y2287 AromaticContact CD1-CD2 3.88Å; Y2169-Y2287 HydrophobicContact CD1-CD2 4.14Å; Y2169-Y2287 HydrophobicContact CD1-CE2 4.01Å; Y2169-Y2287 HydrophobicContact CD1-CG 4.25Å; Y2169-Y2287 AromaticContact CD2-CD2 3.99Å; Y2169-Y2287 HydrophobicContact CD2-CD2 4.14Å; Y2169-Y2287 HydrophobicContact CD2-CE2 4.49Å; Y2169-Y2287 AromaticContact CE1-CD2 3.66Å; Y2169-Y2287 HydrophobicContact CE1-CD2 4.11Å; Y2169-Y2287 HydrophobicContact CE1-CE2 4.43Å; Y2169-Y2287 AromaticContact CE1-CG 3.95Å; Y2169-Y2287 HydrophobicContact CE1-CG 4.23Å; Y2169-Y2287 WeakPolarHBondContact CE1-O 3.22Å; Y2169-Y2287 AromaticContact CE2-CD2 3.47Å; Y2169-Y2287 HydrophobicContact CE2-CD2 3.47Å; Y2169-Y2287 AromaticContact CE2-CE2 3.55Å; Y2169-Y2287 HydrophobicContact CE2-CE2 3.92Å; Y2169-Y2287 AromaticContact CE2-CG 3.71Å; Y2169-Y2287 HydrophobicContact CE2-CG 3.96Å; Y2169-Y2287 AromaticContact CZ-CD2 3.53Å; Y2169-Y2287 AromaticContact CZ-CE2 3.53Å; Y2169-Y2287 AromaticContact CZ-CG 3.73Å; Y2169-Y2287 PolarHBondContact O-N 3.12Å; Y2169-Y2287 WeakPolarHBondContact OH-CB 3.47Å; Y2169-Y2287 VanDerWaalsContact OH-CD2 3.26Å; Y2169-Y2287 WeakPolarHBondContact OH-CD2 3.45Å; Y2169-Y2287 VanDerWaalsContact OH-CE2 3.32Å; Y2169-Y2287 WeakPolarHBondContact OH-CE2 3.43Å
2170	T	63.4	Low	62.5	Low	12 Å²	12	56.3 Å²	56.3	7%	0.074	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	109.5	170.5	-47.3	0	0	0	0	106.2	P2168 A2172 D2173 L2239 I2240 V2242 V2268 I2271 V2285 N2286	P2168-T2170 PolarHBondContact O-N 2.95Å; P2168-T2170 VanDerWaalsContact O-N 3.17Å; T2170-A2172 HydrophobicContact CG2-CB 4.4Å; T2170-A2172 WeakPolarHBondContact CG2-O 3.25Å; T2170-D2173 HydrophobicContact CG2-CB 3.98Å; T2170-L2239 HydrophobicContact CG2-CD2 3.67Å; T2170-I2240 CarbonylContact C-O 3.58Å; T2170-V2242 PolarHBondContact N-O 3.22Å; T2170-V2242 VanDerWaalsContact N-O 3.09Å; T2170-V2242 PolarHBondContact O-N 3.01Å; T2170-V2268 HydrophobicContact CG2-CB 4.41Å; T2170-V2268 HydrophobicContact CG2-CG1 4.5Å; T2170-V2268 HydrophobicContact CG2-CG2 4.36Å; T2170-V2268 WeakPolarHBondContact OG1-CB 3.12Å; T2170-V2268 VanDerWaalsContact OG1-CG2 3.29Å; T2170-V2268 WeakPolarHBondContact OG1-CG2 3.18Å; T2170-I2271 HydrophobicContact CG2-CD1 3.85Å; T2170-V2285 HydrophobicContact CG2-CG2 4.41Å; T2170-V2285 WeakPolarHBondContact O-CB 3.32Å; T2170-V2285 WeakPolarHBondContact O-CG2 3.44Å; T2170-N2286 WeakPolarHBondContact CB-OD1 3.37Å; T2170-N2286 HydrophobicContact CG2-CB 4.37Å; T2170-N2286 WeakPolarHBondContact CG2-OD1 3.23Å; T2170-N2286 PolarHBondContact OG1-OD1 2.81Å
2171	L	69.9	Low	63.8	Low	40.2 Å²	40.2	62 Å²	62	21%	0.21	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	115.1	164.1	-175.9	73.2	0	0	0	106.7	Y2169 I2189 L2239 I2240 F2241 V2242 V2268 I2271 V2285 Y2287	Y2169-L2171 VanDerWaalsContact C-N 3.32Å; Y2169-L2171 HydrophobicContact CD2-CB 4.23Å; Y2169-L2171 HydrophobicContact CE2-CB 4.24Å; Y2169-L2171 PolarHBondContact O-N 2.89Å; L2171-I2189 HydrophobicContact CD2-CG2 4.35Å; L2171-L2239 HydrophobicContact CD1-CD1 3.88Å; L2171-L2239 HydrophobicContact CD1-CD2 4.06Å; L2171-L2239 HydrophobicContact CD1-CG 3.95Å; L2171-L2239 HydrophobicContact CD2-CD2 4.32Å; L2171-L2239 HydrophobicContact CG-CD1 4.26Å; L2171-L2239 HydrophobicContact CG-CD2 4.15Å; L2171-I2240 WeakPolarHBondContact CA-O 3.18Å; L2171-I2240 HydrophobicContact CB-CG2 4.38Å; L2171-I2240 WeakPolarHBondContact CB-O 3.48Å; L2171-I2240 HydrophobicContact CD2-CG2 4.06Å; L2171-I2240 PolarHBondContact N-O 3.32Å; L2171-F2241 HydrophobicContact CD1-CB 4.46Å; L2171-F2241 HydrophobicContact CD1-CD2 3.9Å; L2171-V2242 HydrophobicContact CB-CG2 3.9Å; L2171-V2242 HydrophobicContact CD2-CG2 3.9Å; L2171-V2242 HydrophobicContact CG-CG2 4.41Å; L2171-V2268 HydrophobicContact CD1-CB 4.29Å; L2171-V2268 HydrophobicContact CD1-CG1 4.48Å; L2171-V2268 HydrophobicContact CD1-CG2 3.98Å; L2171-V2268 HydrophobicContact CD2-CG2 3.94Å; L2171-I2271 HydrophobicContact CD1-CD1 4.47Å; L2171-I2271 HydrophobicContact CD2-CD1 4.17Å; L2171-I2271 HydrophobicContact CG-CD1 3.85Å; L2171-V2285 PolarHBondContact N-O 3.18Å; L2171-V2285 VanDerWaalsContact N-O 3.17Å; L2171-V2285 PolarHBondContact O-N 2.87Å; L2171-V2285 VanDerWaalsContact O-O 3.13Å; L2171-Y2287 HydrophobicContact CB-CE2 4.29Å; L2171-Y2287 HydrophobicContact CD2-CE2 4.46Å
2172	A	77.5	Confident	64.9	Low	0 Å²	0	57.8 Å²	57.8	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	139	167.6	0	0	0	0	0	110.1	T2170 L2239 I2240 I2271 L2282 S2283 A2284	T2170-A2172 HydrophobicContact CG2-CB 4.4Å; T2170-A2172 WeakPolarHBondContact CG2-O 3.25Å; A2172-L2239 CarbonylContact O-C 3.59Å; A2172-L2239 WeakPolarHBondContact O-CA 3.34Å; A2172-I2240 HydrophobicContact CB-CB 4.3Å; A2172-I2240 HydrophobicContact CB-CD1 4.13Å; A2172-I2240 HydrophobicContact CB-CG1 4.27Å; A2172-I2240 PolarHBondContact N-O 2.87Å; A2172-I2240 PolarHBondContact O-N 3.09Å; A2172-I2271 HydrophobicContact CB-CD1 3.38Å; A2172-L2282 HydrophobicContact CB-CD1 4.1Å; A2172-S2283 CarbonylContact C-O 3.52Å; A2172-S2283 VanDerWaalsContact CA-O 3.29Å; A2172-S2283 WeakPolarHBondContact CA-O 3.28Å; A2172-S2283 WeakPolarHBondContact CB-O 3.35Å; A2172-A2284 HydrophobicContact CB-CB 3.91Å
2173	D	78.7	Confident	66.4	Low	43.2 Å²	43.2	62.1 Å²	62.1	23%	0.231	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	131.1	-180	169.5	2.3	0	0	0	108.5	T2170 L2238 L2239 Y2281 L2282 S2283	T2170-D2173 HydrophobicContact CG2-CB 3.98Å; D2173-L2238 CarbonylContact C-O 3.56Å; D2173-L2238 WeakPolarHBondContact CA-O 3.42Å; D2173-L2239 HydrophobicContact CB-CD1 3.92Å; D2173-L2239 HydrophobicContact CB-CD2 3.62Å; D2173-L2239 VanDerWaalsContact OD1-CD2 3.23Å; D2173-L2239 WeakPolarHBondContact OD1-CD2 3.28Å; D2173-Y2281 HydrophobicContact CB-CE2 4.28Å; D2173-Y2281 VanDerWaalsContact CG-OH 3.24Å; D2173-Y2281 WeakPolarHBondContact O-CD2 3.4Å; D2173-Y2281 VanDerWaalsContact O-CE2 3.24Å; D2173-Y2281 WeakPolarHBondContact O-CE2 3.35Å; D2173-Y2281 PolarHBondContact OD1-OH 3.23Å; D2173-Y2281 VanDerWaalsContact OD2-CE2 3.29Å; D2173-Y2281 WeakPolarHBondContact OD2-CE2 3.26Å; D2173-Y2281 PolarHBondContact OD2-OH 3.24Å; D2173-L2282 CarbonylContact O-C 3.52Å; D2173-L2282 WeakPolarHBondContact O-CA 3.42Å; D2173-S2283 PolarHBondContact N-O 3.09Å; D2173-S2283 PolarHBondContact O-N 2.98Å; D2173-S2283 WeakPolarHBondContact OD1-CB 3.48Å; D2173-S2283 PolarHBondContact OD1-OG 2.82Å
2174	A	79.8	Confident	68.5	Low	0.4 Å²	0.4	62 Å²	62	0%	0.003	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	147.5	-177.8	0	0	0	0	0	111	L2176 P2237 L2238 I2273 Y2281 L2282	A2174-L2176 HydrophobicContact CB-CD2 4.44Å; A2174-P2237 CarbonylContact O-C 3.53Å; A2174-P2237 WeakPolarHBondContact O-CA 3.4Å; A2174-L2238 HydrophobicContact CB-CB 4.4Å; A2174-L2238 PolarHBondContact N-O 3.2Å; A2174-L2238 PolarHBondContact O-N 2.82Å; A2174-I2273 HydrophobicContact CB-CD1 4.15Å; A2174-Y2281 WeakPolarHBondContact CA-O 3.35Å; A2174-Y2281 VanDerWaalsContact CB-O 3.26Å; A2174-Y2281 WeakPolarHBondContact CB-O 3.28Å; A2174-L2282 HydrophobicContact CB-CB 4.22Å; A2174-L2282 HydrophobicContact CB-CD1 3.86Å; A2174-L2282 HydrophobicContact CB-CG 4.39Å
2175	E	84.6	Confident	71	Confident	52.8 Å²	52.8	53.9 Å²	53.9	25%	0.247	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	125.8	166.2	-178.2	-174.2	-116.8	0	0	109	K2235 F2236 H2280 Y2281	E2175-K2235 HydrophobicContact CG-CB 4.06Å; E2175-K2235 HydrophobicContact CG-CD 4.45Å; E2175-K2235 HydrophobicContact CG-CG 4.19Å; E2175-K2235 WeakPolarHBondContact OE1-CD 3.46Å; E2175-K2235 IonicContact OE1-NZ 3.26Å; E2175-K2235 WeakPolarHBondContact OE2-CD 3.41Å; E2175-K2235 WeakPolarHBondContact OE2-CE 3.41Å; E2175-K2235 IonicContact OE2-NZ 3.23Å; E2175-K2235 PolarHBondContact OE2-NZ 2.98Å; E2175-F2236 WeakPolarHBondContact CA-O 3.31Å; E2175-H2280 HydrophobicContact CB-CB 4.18Å; E2175-H2280 HydrophobicContact CG-CB 4.25Å; E2175-H2280 WeakPolarHBondContact O-CA 3.29Å; E2175-H2280 WeakPolarHBondContact O-CB 3.38Å; E2175-H2280 PolarHBondContact O-N 3.1Å; E2175-H2280 WeakPolarHBondContact OE2-CB 3.29Å; E2175-H2280 IonicContact OE2-CD2 3.29Å; E2175-H2280 IonicContact OE2-CG 3.44Å; E2175-Y2281 HydrophobicContact CB-CD1 3.65Å; E2175-Y2281 VanDerWaalsContact CB-CD1 3.48Å; E2175-Y2281 HydrophobicContact CB-CE1 3.39Å; E2175-Y2281 VanDerWaalsContact CB-CE1 3.4Å; E2175-Y2281 HydrophobicContact CB-CG 4.38Å; E2175-Y2281 HydrophobicContact CG-CE1 4.41Å; E2175-Y2281 PolarHBondContact N-O 3.07Å; E2175-Y2281 VanDerWaalsContact N-O 3.1Å; E2175-Y2281 PolarHBondContact O-N 3.31Å
2176	L	86.6	Confident	73.6	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	157	-177.3	-59.6	-172	0	0	0	111.2	A2174 I2185 K2235 F2236 L2238 I2273 D2278 V2279	A2174-L2176 HydrophobicContact CB-CD2 4.44Å; L2176-I2185 HydrophobicContact CD1-CG2 4.34Å; L2176-K2235 CarbonylContact O-C 3.53Å; L2176-K2235 VanDerWaalsContact O-CA 3.26Å; L2176-K2235 WeakPolarHBondContact O-CA 3.38Å; L2176-F2236 HydrophobicContact CB-CD1 4.34Å; L2176-F2236 HydrophobicContact CB-CD2 4.4Å; L2176-F2236 HydrophobicContact CB-CE1 3.77Å; L2176-F2236 HydrophobicContact CB-CE2 3.88Å; L2176-F2236 HydrophobicContact CB-CZ 3.51Å; L2176-F2236 VanDerWaalsContact CB-CZ 3.49Å; L2176-F2236 HydrophobicContact CD1-CE2 4Å; L2176-F2236 HydrophobicContact CD1-CZ 3.93Å; L2176-F2236 HydrophobicContact CG-CE2 4.37Å; L2176-F2236 HydrophobicContact CG-CZ 4.3Å; L2176-F2236 PolarHBondContact N-O 3.08Å; L2176-F2236 VanDerWaalsContact O-CD1 3.29Å; L2176-F2236 WeakPolarHBondContact O-CD1 3.28Å; L2176-F2236 PolarHBondContact O-N 3Å; L2176-L2238 HydrophobicContact CD1-CB 4.18Å; L2176-L2238 HydrophobicContact CD1-CD1 3.92Å; L2176-L2238 HydrophobicContact CD1-CD2 3.86Å; L2176-L2238 HydrophobicContact CD1-CG 4.41Å; L2176-L2238 HydrophobicContact CG-CB 4.33Å; L2176-L2238 HydrophobicContact CG-CD2 4.39Å; L2176-I2273 HydrophobicContact CD1-CD1 4.5Å; L2176-I2273 HydrophobicContact CD1-CG2 4.2Å; L2176-I2273 HydrophobicContact CD2-CD1 4.29Å; L2176-I2273 HydrophobicContact CD2-CG2 4.17Å; L2176-D2278 CarbonylContact C-O 3.57Å; L2176-D2278 WeakPolarHBondContact CA-O 3.35Å; L2176-V2279 HydrophobicContact CD2-CB 4.04Å; L2176-V2279 HydrophobicContact CD2-CG1 3.85Å; L2176-V2279 HydrophobicContact CD2-CG2 3.79Å
2177	T	85.1	Confident	76	Confident	13.2 Å²	13.2	47 Å²	47	8%	0.081	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	128.6	162.2	-66.4	0	0	0	0	109.4	R2179 K2234 K2235 V2277 D2278 H2280	T2177-R2179 PolarHBondContact O-N 3.16Å; T2177-K2234 WeakPolarHBondContact CA-O 3.3Å; T2177-K2234 PolarHBondContact OG1-O 3.04Å; T2177-K2235 WeakPolarHBondContact OG1-CA 3.43Å; T2177-K2235 WeakPolarHBondContact OG1-CG 3.29Å; T2177-V2277 CarbonylContact O-C 3.54Å; T2177-V2277 VanDerWaalsContact O-CA 3.28Å; T2177-V2277 WeakPolarHBondContact O-CA 3.32Å; T2177-D2278 PolarHBondContact N-O 3.02Å; T2177-D2278 PolarHBondContact O-N 3.02Å; T2177-H2280 WeakPolarHBondContact CB-NE2 3.29Å; T2177-H2280 PolarHBondContact OG1-CD2 2.87Å; T2177-H2280 VanDerWaalsContact OG1-CD2 3.26Å; T2177-H2280 PolarHBondContact OG1-NE2 3.09Å
2178	L	84.4	Confident	78.1	Confident	0 Å²	0	44 Å²	44	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	122.4	172.4	-173.2	72.3	0	0	0	108.8	I2185 A2203 L2230 Y2232 G2233 F2236 V2277	L2178-I2185 HydrophobicContact CD1-CD1 4.49Å; L2178-I2185 HydrophobicContact CD1-CG1 4.32Å; L2178-A2203 HydrophobicContact CD1-CB 4.3Å; L2178-A2203 HydrophobicContact CD2-CB 3.46Å; L2178-A2203 VanDerWaalsContact CD2-CB 3.45Å; L2178-A2203 HydrophobicContact CG-CB 4.47Å; L2178-L2230 HydrophobicContact CD2-CB 4.18Å; L2178-Y2232 HydrophobicContact CD2-CD1 3.71Å; L2178-Y2232 HydrophobicContact CD2-CE1 3.67Å; L2178-Y2232 VanDerWaalsContact CD2-CE1 3.48Å; L2178-Y2232 HydrophobicContact CD2-CG 4.3Å; L2178-Y2232 HydrophobicContact CG-CD1 4.17Å; L2178-Y2232 HydrophobicContact CG-CE1 4.34Å; L2178-G2233 PolarHBondContact O-N 2.89Å; L2178-F2236 HydrophobicContact CB-CE1 4.45Å; L2178-V2277 HydrophobicContact CD1-CG1 4.13Å
2179	R	82.1	Confident	80.1	Confident	71.8 Å²	71.8	41.4 Å²	41.4	27%	0.271	20%	0.196	S	C	.	.	P	Polyproline II helix	trans	-62.3	153.4	-179.3	-70.6	178	175.3	170.2	-0	111.1	T2177 N2181 G2182 Y2232 G2275 D2276 V2277 D2278 D2308	T2177-R2179 PolarHBondContact O-N 3.16Å; R2179-N2181 PolarHBondContact O-N 2.98Å; R2179-G2182 WeakPolarHBondContact O-CA 3.4Å; R2179-G2182 PolarHBondContact O-N 2.95Å; R2179-Y2232 WeakPolarHBondContact O-CD1 3.37Å; R2179-G2275 PolarHBondContact NH1-O 2.73Å; R2179-G2275 VanDerWaalsContact NH1-O 3.13Å; R2179-D2276 VanDerWaalsContact CB-O 3.29Å; R2179-D2276 WeakPolarHBondContact CB-O 3.37Å; R2179-D2276 WeakPolarHBondContact CG-O 3.31Å; R2179-D2276 PolarHBondContact N-O 2.92Å; R2179-V2277 PolarHBondContact NH1-O 2.98Å; R2179-V2277 PolarHBondContact NH2-O 2.78Å; R2179-D2278 VanDerWaalsContact CG-OD2 3.23Å; R2179-D2278 WeakPolarHBondContact CG-OD2 3.35Å; R2179-D2278 IonicContact CZ-OD1 3.16Å; R2179-D2278 VanDerWaalsContact CZ-OD1 3.23Å; R2179-D2278 IonicContact CZ-OD2 2.73Å; R2179-D2278 IonicContact NE-OD1 3.48Å; R2179-D2278 PolarHBondContact NE-OD1 2.78Å; R2179-D2278 IonicContact NE-OD2 3.5Å; R2179-D2278 PolarHBondContact NE-OD2 2.81Å; R2179-D2278 IonicContact NH2-OD1 3.27Å; R2179-D2278 PolarHBondContact NH2-OD1 3.09Å; R2179-D2278 IonicContact NH2-OD2 2.63Å; R2179-D2308 IonicContact CZ-OD2 3.15Å; R2179-D2308 IonicContact NH1-OD2 2.99Å; R2179-D2308 PolarHBondContact NH1-OD2 2.84Å; R2179-D2308 IonicContact NH2-OD2 3.02Å
2180	P	77.8	Confident	81.1	Confident	104 Å²	104	39.5 Å²	39.5	68%	0.675	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.7	129.7	171	-25.5	34.9	0	0	0	111.2	G2182	P2180-G2182 PolarHBondContact O-N 2.94Å; P2180-G2182 VanDerWaalsContact O-N 3.14Å
2181	N	75.8	Confident	81.9	Confident	149.8 Å²	149.8	39 Å²	39	80%	0.801	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	61	10.8	-173.7	-51.7	-32.9	0	0	0	115.9	R2179 R2183	R2179-N2181 PolarHBondContact O-N 2.98Å; N2181-R2183 PolarHBondContact O-N 3Å
2182	G	75.4	Confident	81.9	Confident	3 Å²	3	39.8 Å²	39.8	3%	0.031	19%	0.19	C	C	.	.			trans	-65	134.4	176.1	0	0	0	0	0	112.6	R2179 P2180 Y2232	R2179-G2182 WeakPolarHBondContact O-CA 3.4Å; R2179-G2182 PolarHBondContact O-N 2.95Å; P2180-G2182 PolarHBondContact O-N 2.94Å; P2180-G2182 VanDerWaalsContact O-N 3.14Å; G2182-Y2232 VanDerWaalsContact O-CE1 3.25Å; G2182-Y2232 WeakPolarHBondContact O-CE1 3.35Å; G2182-Y2232 PolarHBondContact O-OH 2.84Å
2183	R	83.3	Confident	81.4	Confident	120.2 Å²	120.2	47.5 Å²	47.5	45%	0.454	22%	0.224	S	C	.	.			trans	-108.6	-43.4	-176.5	-174.3	175.5	168.9	-156.7	-12	112.9	N2181 D2202 A2203 K2204 D2276	N2181-R2183 PolarHBondContact O-N 3Å; R2183-D2202 VanDerWaalsContact CG-OD1 3.27Å; R2183-D2202 WeakPolarHBondContact CG-OD1 3.28Å; R2183-D2202 IonicContact CZ-OD2 2.72Å; R2183-D2202 IonicContact NE-OD1 3.17Å; R2183-D2202 PolarHBondContact NE-OD1 2.98Å; R2183-D2202 IonicContact NE-OD2 3.3Å; R2183-D2202 PolarHBondContact NE-OD2 2.95Å; R2183-D2202 IonicContact NH2-OD2 3.12Å; R2183-D2202 PolarHBondContact NH2-OD2 3.05Å; R2183-D2202 CarbonylContact O-C 3.55Å; R2183-D2202 WeakPolarHBondContact O-CA 3.24Å; R2183-A2203 PolarHBondContact O-N 3.07Å; R2183-K2204 HydrophobicContact CG-CB 4.5Å; R2183-D2276 PolarHBondContact N-OD2 3.16Å
2184	H	86.6	Confident	81	Confident	44.2 Å²	44.2	49.6 Å²	49.6	21%	0.205	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	135.9	-169.5	-53.7	106.4	0	0	0	113.2	Y2186 A2201 D2202 G2275 D2276	H2184-Y2186 HydrophobicContact CB-CD2 4.35Å; H2184-Y2186 HydrophobicContact CB-CE1 4.3Å; H2184-Y2186 HydrophobicContact CB-CE2 3.58Å; H2184-Y2186 VanDerWaalsContact CB-CE2 3.48Å; H2184-Y2186 VanDerWaalsContact CB-CZ 3.5Å; H2184-Y2186 WeakPolarHBondContact CB-OH 3.45Å; H2184-Y2186 AromaticContact CG-CZ 3.98Å; H2184-Y2186 PolarHBondContact ND1-OH 3.35Å; H2184-A2201 CarbonylContact C-O 3.5Å; H2184-A2201 VanDerWaalsContact CA-O 3.31Å; H2184-A2201 WeakPolarHBondContact CA-O 3.33Å; H2184-D2202 IonicContact CD2-OD2 3.4Å; H2184-D2202 IonicContact NE2-OD2 3.36Å; H2184-G2275 CarbonylContact O-C 3.57Å; H2184-G2275 WeakPolarHBondContact O-CA 3.31Å; H2184-D2276 PolarHBondContact N-OD2 3.04Å; H2184-D2276 VanDerWaalsContact N-OD2 3.11Å; H2184-D2276 PolarHBondContact O-N 2.97Å
2185	I	87.6	Confident	80.9	Confident	0.6 Å²	0.6	50.1 Å²	50.1	0%	0.003	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	129.7	163.7	-41	-176	0	0	0	107.9	L2176 L2178 I2187 T2200 A2201 L2230 F2236 I2273 V2277	L2176-I2185 HydrophobicContact CD1-CG2 4.34Å; L2178-I2185 HydrophobicContact CD1-CD1 4.49Å; L2178-I2185 HydrophobicContact CD1-CG1 4.32Å; I2185-I2187 HydrophobicContact CG2-CG1 4.35Å; I2185-T2200 CarbonylContact O-C 3.5Å; I2185-T2200 VanDerWaalsContact O-CA 3.3Å; I2185-T2200 WeakPolarHBondContact O-CA 3.32Å; I2185-A2201 HydrophobicContact CB-CB 4.12Å; I2185-A2201 HydrophobicContact CD1-CB 4.42Å; I2185-A2201 HydrophobicContact CG1-CB 4.25Å; I2185-A2201 PolarHBondContact N-O 3.16Å; I2185-A2201 PolarHBondContact O-N 2.88Å; I2185-L2230 HydrophobicContact CD1-CD1 3.67Å; I2185-L2230 HydrophobicContact CD1-CD2 4.36Å; I2185-L2230 HydrophobicContact CG1-CD1 4.42Å; I2185-F2236 HydrophobicContact CD1-CE2 4.44Å; I2185-F2236 HydrophobicContact CD1-CZ 3.77Å; I2185-I2273 HydrophobicContact CG2-CG2 4.25Å; I2185-V2277 HydrophobicContact CB-CG1 4.36Å; I2185-V2277 HydrophobicContact CD1-CG1 3.77Å; I2185-V2277 HydrophobicContact CG1-CG1 3.66Å; I2185-V2277 HydrophobicContact CG2-CG1 4.04Å; I2185-V2277 HydrophobicContact CG2-CG2 4.17Å
2186	Y	87.7	Confident	80.8	Confident	80.2 Å²	80.2	48.3 Å²	48.3	32%	0.315	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	119.1	174.4	-56.1	-78.8	0	0	0	109.7	H2184 M2198 T2200 I2273 T2274	H2184-Y2186 HydrophobicContact CB-CD2 4.35Å; H2184-Y2186 HydrophobicContact CB-CE1 4.3Å; H2184-Y2186 HydrophobicContact CB-CE2 3.58Å; H2184-Y2186 VanDerWaalsContact CB-CE2 3.48Å; H2184-Y2186 VanDerWaalsContact CB-CZ 3.5Å; H2184-Y2186 WeakPolarHBondContact CB-OH 3.45Å; H2184-Y2186 AromaticContact CG-CZ 3.98Å; H2184-Y2186 PolarHBondContact ND1-OH 3.35Å; Y2186-M2198 HydrophobicContact CD1-CE 3.94Å; Y2186-T2200 HydrophobicContact CD1-CG2 3.78Å; Y2186-T2200 HydrophobicContact CE1-CG2 3.59Å; Y2186-I2273 CarbonylContact O-C 3.58Å; Y2186-I2273 WeakPolarHBondContact O-CA 3.26Å; Y2186-T2274 PolarHBondContact N-O 3.17Å; Y2186-T2274 PolarHBondContact O-N 2.86Å; Y2186-T2274 PolarHBondContact O-OG1 3.04Å
2187	I	88.5	Confident	81	Confident	1.4 Å²	1.4	48.3 Å²	48.3	1%	0.007	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	121.8	175.3	-53	160.5	0	0	0	107.1	I2185 I2189 M2198 I2199 W2208 L2238 I2240 V2249 I2271 M2272 I2273	I2185-I2187 HydrophobicContact CG2-CG1 4.35Å; I2187-I2189 HydrophobicContact CG2-CD1 4.02Å; I2187-I2189 HydrophobicContact CG2-CG1 4.08Å; I2187-M2198 CarbonylContact O-C 3.43Å; I2187-M2198 WeakPolarHBondContact O-CA 3.27Å; I2187-I2199 HydrophobicContact CB-CB 4.17Å; I2187-I2199 HydrophobicContact CB-CD1 4.1Å; I2187-I2199 HydrophobicContact CB-CG1 4.41Å; I2187-I2199 HydrophobicContact CD1-CB 4.36Å; I2187-I2199 HydrophobicContact CD1-CD1 4.38Å; I2187-I2199 HydrophobicContact CG2-CD1 4.05Å; I2187-I2199 PolarHBondContact N-O 3.15Å; I2187-I2199 PolarHBondContact O-N 3.04Å; I2187-W2208 HydrophobicContact CD1-CZ3 4.05Å; I2187-L2238 HydrophobicContact CD1-CD1 4.18Å; I2187-L2238 HydrophobicContact CD1-CD2 3.73Å; I2187-L2238 HydrophobicContact CD1-CG 4.46Å; I2187-L2238 HydrophobicContact CG1-CD2 4.3Å; I2187-I2240 HydrophobicContact CG2-CD1 3.85Å; I2187-I2240 HydrophobicContact CG2-CG1 4.45Å; I2187-V2249 HydrophobicContact CD1-CG1 4.29Å; I2187-I2271 HydrophobicContact CG2-CG2 4.41Å; I2187-M2272 CarbonylContact C-O 3.5Å; I2187-M2272 WeakPolarHBondContact CA-O 3.31Å; I2187-I2273 HydrophobicContact CG1-CG1 4.45Å; I2187-I2273 HydrophobicContact CG2-CG1 4.38Å
2188	R	85.8	Confident	81.2	Confident	70.6 Å²	70.6	48.8 Å²	48.8	27%	0.266	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	120	-174.2	-80.2	-170	72.6	171.6	5.7	110.1	P2190 E2196 M2198 I2271 M2272 S2576	R2188-P2190 VanDerWaalsContact O-CD 3.3Å; R2188-P2190 WeakPolarHBondContact O-CD 3.35Å; R2188-E2196 VanDerWaalsContact CB-OE1 3.24Å; R2188-E2196 WeakPolarHBondContact CB-OE1 3.38Å; R2188-E2196 WeakPolarHBondContact CG-OE1 3.28Å; R2188-E2196 IonicContact CZ-OE1 3.15Å; R2188-E2196 IonicContact CZ-OE2 2.93Å; R2188-E2196 IonicContact NE-OE1 3.64Å; R2188-E2196 PolarHBondContact NE-OE1 2.91Å; R2188-E2196 IonicContact NE-OE2 2.97Å; R2188-E2196 PolarHBondContact NE-OE2 3.35Å; R2188-E2196 IonicContact NH2-OE1 3.12Å; R2188-E2196 PolarHBondContact NH2-OE1 3.1Å; R2188-E2196 IonicContact NH2-OE2 3.07Å; R2188-E2196 PolarHBondContact NH2-OE2 2.97Å; R2188-M2198 HydrophobicContact CG-CB 4.33Å; R2188-M2198 HydrophobicContact CG-CE 4.08Å; R2188-M2198 HydrophobicContact CG-CG 4.1Å; R2188-M2198 HydrophobicContact CG-SD 4.28Å; R2188-I2271 CarbonylContact O-C 3.25Å; R2188-I2271 WeakPolarHBondContact O-CA 3.45Å; R2188-M2272 HydrophobicContact CB-CB 4.2Å; R2188-M2272 HydrophobicContact CB-CE 3.7Å; R2188-M2272 HydrophobicContact CG-CE 4.49Å; R2188-M2272 PolarHBondContact N-O 3.13Å; R2188-M2272 PolarHBondContact O-N 3.09Å; R2188-S2576 PolarHBondContact NH1-O 3.43Å
2189	I	84.8	Confident	81.5	Confident	0.2 Å²	0.2	48.8 Å²	48.8	0%	0.001	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	82.4	-169.7	-56.8	169.5	0	0	0	108.1	L2171 I2187 M2191 E2196 W2197 I2199 I2240 V2268 G2270 I2271	L2171-I2189 HydrophobicContact CD2-CG2 4.35Å; I2187-I2189 HydrophobicContact CG2-CD1 4.02Å; I2187-I2189 HydrophobicContact CG2-CG1 4.08Å; I2189-M2191 VanDerWaalsContact O-CG 3.28Å; I2189-M2191 WeakPolarHBondContact O-CG 3.37Å; I2189-E2196 WeakPolarHBondContact O-CA 3.38Å; I2189-W2197 WeakPolarHBondContact CA-O 3.32Å; I2189-W2197 HydrophobicContact CB-CB 4.32Å; I2189-W2197 HydrophobicContact CB-CE3 4.44Å; I2189-W2197 WeakPolarHBondContact CB-O 3.35Å; I2189-W2197 HydrophobicContact CD1-CD2 4.12Å; I2189-W2197 HydrophobicContact CD1-CE3 3.38Å; I2189-W2197 VanDerWaalsContact CD1-CE3 3.49Å; I2189-W2197 HydrophobicContact CD1-CH2 4.43Å; I2189-W2197 HydrophobicContact CD1-CZ3 3.65Å; I2189-W2197 HydrophobicContact CG1-CE3 4.45Å; I2189-W2197 HydrophobicContact CG2-CE3 4.47Å; I2189-W2197 PolarHBondContact N-O 3Å; I2189-W2197 PolarHBondContact O-N 3.06Å; I2189-I2199 HydrophobicContact CD1-CD1 3.98Å; I2189-I2240 HydrophobicContact CD1-CD1 4.14Å; I2189-I2240 HydrophobicContact CD1-CG2 3.77Å; I2189-V2268 HydrophobicContact CG2-CB 4.48Å; I2189-V2268 HydrophobicContact CG2-CG1 3.8Å; I2189-V2268 HydrophobicContact CG2-CG2 3.96Å; I2189-G2270 WeakPolarHBondContact CA-O 3.49Å; I2189-I2271 HydrophobicContact CG1-CG1 4.28Å; I2189-I2271 HydrophobicContact CG1-CG2 4.33Å; I2189-I2271 HydrophobicContact CG2-CG1 4.33Å
2190	P	78.7	Confident	81.9	Confident	21.4 Å²	21.4	46.5 Å²	46.5	14%	0.139	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	141.4	174.3	14.8	-22.4	0	0	0	111.4	R2188 K2269 G2270 M2272 Y2600	R2188-P2190 VanDerWaalsContact O-CD 3.3Å; R2188-P2190 WeakPolarHBondContact O-CD 3.35Å; P2190-K2269 HydrophobicContact CB-CB 4.32Å; P2190-K2269 HydrophobicContact CG-CB 4.33Å; P2190-K2269 WeakPolarHBondContact O-CB 3.26Å; P2190-K2269 PolarHBondContact O-N 3.18Å; P2190-G2270 VanDerWaalsContact CD-O 3.31Å; P2190-G2270 WeakPolarHBondContact CD-O 3.18Å; P2190-G2270 PolarHBondContact O-N 2.78Å; P2190-M2272 HydrophobicContact CG-CE 3.94Å; P2190-Y2600 HydrophobicContact CG-CE2 4.2Å
2191	M	79.3	Confident	82.5	Confident	2.2 Å²	2.2	41.6 Å²	41.6	1%	0.011	19%	0.194	C	C	.	.	B	Isolated β-bridge	trans	-129.7	-174.9	-173.4	-52.6	-164.1	83.4	0	0	111.5	I2189 T2195 W2197 V2242 L2263 P2264 G2265 S2267 V2268 K2269	I2189-M2191 VanDerWaalsContact O-CG 3.28Å; I2189-M2191 WeakPolarHBondContact O-CG 3.37Å; M2191-T2195 CarbonylContact C-O 3.59Å; M2191-T2195 WeakPolarHBondContact CA-O 3.22Å; M2191-T2195 WeakPolarHBondContact CB-O 3.3Å; M2191-T2195 WeakPolarHBondContact CB-OG1 3.35Å; M2191-T2195 PolarHBondContact N-O 3.05Å; M2191-W2197 HydrophobicContact SD-CB 4.45Å; M2191-V2242 HydrophobicContact CE-CG1 4.23Å; M2191-L2263 HydrophobicContact CE-CB 4.32Å; M2191-L2263 HydrophobicContact CE-CD1 4.1Å; M2191-L2263 HydrophobicContact SD-CB 4.18Å; M2191-L2263 HydrophobicContact SD-CD1 4.5Å; M2191-L2263 HydrophobicContact SD-CD2 4.42Å; M2191-P2264 HydrophobicContact SD-CG 4.22Å; M2191-G2265 VanDerWaalsContact CE-C 3.46Å; M2191-G2265 VanDerWaalsContact CE-O 3.28Å; M2191-G2265 WeakPolarHBondContact CE-O 3.33Å; M2191-G2265 PolarHBondContact SD-N 3.49Å; M2191-S2267 CarbonylContact C-O 3.56Å; M2191-S2267 VanDerWaalsContact CA-O 3.27Å; M2191-S2267 WeakPolarHBondContact CA-O 3.23Å; M2191-S2267 VanDerWaalsContact CB-O 3.25Å; M2191-S2267 WeakPolarHBondContact CB-O 3.31Å; M2191-V2268 HydrophobicContact CE-CG2 4.08Å; M2191-V2268 HydrophobicContact CG-CG2 4.46Å; M2191-K2269 VanDerWaalsContact O-CD 3.26Å; M2191-K2269 WeakPolarHBondContact O-CD 3.26Å; M2191-K2269 WeakPolarHBondContact O-CE 3.22Å; M2191-K2269 WeakPolarHBondContact O-CG 2.92Å; M2191-K2269 PolarHBondContact O-NZ 3.23Å
2192	E	69.5	Low	83.2	Confident	55.6 Å²	55.6	35.2 Å²	35.2	26%	0.26	16%	0.16	S	C	.	.	S	Bend	trans	-58.6	155.9	171.9	66.5	-167.5	-139.5	0	0	113.5	K1902 N2194 T2195 R2266 S2267	K1902-E2192 IonicContact NZ-OE1 2.94Å; K1902-E2192 PolarHBondContact NZ-OE1 2.77Å; E2192-N2194 VanDerWaalsContact C-N 3.29Å; E2192-N2194 PolarHBondContact O-N 3.17Å; E2192-N2194 VanDerWaalsContact O-N 3.1Å; E2192-T2195 WeakPolarHBondContact O-CB 3.39Å; E2192-T2195 PolarHBondContact O-N 3.22Å; E2192-T2195 VanDerWaalsContact O-N 3.14Å; E2192-T2195 PolarHBondContact O-OG1 3.04Å; E2192-T2195 VanDerWaalsContact O-OG1 3.08Å; E2192-R2266 VanDerWaalsContact CD-N 3.31Å; E2192-R2266 WeakPolarHBondContact OE1-CB 3.37Å; E2192-R2266 PolarHBondContact OE1-N 2.97Å; E2192-R2266 WeakPolarHBondContact OE2-CA 3.47Å; E2192-R2266 VanDerWaalsContact OE2-CB 3.24Å; E2192-R2266 WeakPolarHBondContact OE2-CB 3.34Å; E2192-R2266 PolarHBondContact OE2-N 3.23Å; E2192-S2267 PolarHBondContact N-O 2.91Å; E2192-S2267 VanDerWaalsContact N-O 3.13Å; E2192-S2267 WeakPolarHBondContact OE2-CB 3.12Å; E2192-S2267 PolarHBondContact OE2-N 3.07Å; E2192-S2267 VanDerWaalsContact OE2-N 3.16Å; E2192-S2267 PolarHBondContact OE2-OG 3.3Å
2193	K	68.2	Low	83.7	Confident	163.6 Å²	163.6	35.8 Å²	35.8	71%	0.711	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.9	42.6	172.5	-55	-177.2	176	-171.9	0	116.1	T2195	K2193-T2195 HydrophobicContact CB-CG2 4.5Å; K2193-T2195 WeakPolarHBondContact O-CG2 3.48Å; K2193-T2195 PolarHBondContact O-N 2.96Å; K2193-T2195 VanDerWaalsContact O-N 3.12Å
2194	N	68.9	Low	83.7	Confident	87 Å²	87	38.1 Å²	38.1	47%	0.465	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.2	33.8	179.1	-74.3	12.5	0	0	0	113.1	E2192 N2215 V2569 N2570	E2192-N2194 VanDerWaalsContact C-N 3.29Å; E2192-N2194 PolarHBondContact O-N 3.17Å; E2192-N2194 VanDerWaalsContact O-N 3.1Å; N2194-N2215 WeakPolarHBondContact O-CA 3.2Å; N2194-N2215 PolarHBondContact O-N 2.99Å; N2194-V2569 HydrophobicContact CB-CG1 3.77Å; N2194-N2570 PolarHBondContact ND2-OD1 2.84Å
2195	T	77.4	Confident	83.8	Confident	10.8 Å²	10.8	38.9 Å²	38.9	7%	0.066	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	152.9	171.2	69.1	0	0	0	0	110.7	M2191 E2192 K2193 M2213 I2214 P2264	M2191-T2195 CarbonylContact C-O 3.59Å; M2191-T2195 WeakPolarHBondContact CA-O 3.22Å; M2191-T2195 WeakPolarHBondContact CB-O 3.3Å; M2191-T2195 WeakPolarHBondContact CB-OG1 3.35Å; M2191-T2195 PolarHBondContact N-O 3.05Å; E2192-T2195 WeakPolarHBondContact O-CB 3.39Å; E2192-T2195 PolarHBondContact O-N 3.22Å; E2192-T2195 VanDerWaalsContact O-N 3.14Å; E2192-T2195 PolarHBondContact O-OG1 3.04Å; E2192-T2195 VanDerWaalsContact O-OG1 3.08Å; K2193-T2195 HydrophobicContact CB-CG2 4.5Å; K2193-T2195 WeakPolarHBondContact O-CG2 3.48Å; K2193-T2195 PolarHBondContact O-N 2.96Å; K2193-T2195 VanDerWaalsContact O-N 3.12Å; T2195-M2213 CarbonylContact C-O 3.57Å; T2195-M2213 VanDerWaalsContact CA-O 3.26Å; T2195-M2213 WeakPolarHBondContact CA-O 3.39Å; T2195-M2213 WeakPolarHBondContact CB-O 3.39Å; T2195-I2214 HydrophobicContact CG2-CB 4.29Å; T2195-I2214 HydrophobicContact CG2-CD1 4.34Å; T2195-I2214 HydrophobicContact CG2-CG1 3.91Å; T2195-I2214 HydrophobicContact CG2-CG2 4.1Å; T2195-P2264 HydrophobicContact CG2-CB 4.13Å; T2195-P2264 PolarHBondContact OG1-O 2.76Å; T2195-P2264 VanDerWaalsContact OG1-O 3.13Å
2196	E	83.6	Confident	83.8	Confident	14.8 Å²	14.8	39.8 Å²	39.8	7%	0.069	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	139.7	-179.4	166.2	172.8	-139.8	0	0	109.8	R2188 I2189 M2198 S2212 M2213	R2188-E2196 VanDerWaalsContact CB-OE1 3.24Å; R2188-E2196 WeakPolarHBondContact CB-OE1 3.38Å; R2188-E2196 WeakPolarHBondContact CG-OE1 3.28Å; R2188-E2196 IonicContact CZ-OE1 3.15Å; R2188-E2196 IonicContact CZ-OE2 2.93Å; R2188-E2196 IonicContact NE-OE1 3.64Å; R2188-E2196 PolarHBondContact NE-OE1 2.91Å; R2188-E2196 IonicContact NE-OE2 2.97Å; R2188-E2196 PolarHBondContact NE-OE2 3.35Å; R2188-E2196 IonicContact NH2-OE1 3.12Å; R2188-E2196 PolarHBondContact NH2-OE1 3.1Å; R2188-E2196 IonicContact NH2-OE2 3.07Å; R2188-E2196 PolarHBondContact NH2-OE2 2.97Å; I2189-E2196 WeakPolarHBondContact O-CA 3.38Å; E2196-M2198 HydrophobicContact CG-CG 4.01Å; E2196-S2212 CarbonylContact O-C 3.55Å; E2196-S2212 VanDerWaalsContact O-CA 3.31Å; E2196-S2212 WeakPolarHBondContact O-CA 3.19Å; E2196-M2213 HydrophobicContact CB-CB 4.04Å; E2196-M2213 HydrophobicContact CB-CG 4.4Å; E2196-M2213 HydrophobicContact CG-CB 4.4Å; E2196-M2213 HydrophobicContact CG-CG 4.47Å; E2196-M2213 PolarHBondContact N-O 3.05Å; E2196-M2213 PolarHBondContact O-N 3.06Å; E2196-M2213 WeakPolarHBondContact OE2-CE 3.37Å
2197	W	90.4	Very high	83.9	Confident	0.2 Å²	0.2	39.1 Å²	39.1	0%	0.001	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	122.2	167.1	176	34.2	0	0	0	108.4	I2189 M2191 I2199 C2210 I2240 V2242 G2247 Q2248 V2249 Y2261 L2263	I2189-W2197 WeakPolarHBondContact CA-O 3.32Å; I2189-W2197 HydrophobicContact CB-CB 4.32Å; I2189-W2197 HydrophobicContact CB-CE3 4.44Å; I2189-W2197 WeakPolarHBondContact CB-O 3.35Å; I2189-W2197 HydrophobicContact CD1-CD2 4.12Å; I2189-W2197 HydrophobicContact CD1-CE3 3.38Å; I2189-W2197 VanDerWaalsContact CD1-CE3 3.49Å; I2189-W2197 HydrophobicContact CD1-CH2 4.43Å; I2189-W2197 HydrophobicContact CD1-CZ3 3.65Å; I2189-W2197 HydrophobicContact CG1-CE3 4.45Å; I2189-W2197 HydrophobicContact CG2-CE3 4.47Å; I2189-W2197 PolarHBondContact N-O 3Å; I2189-W2197 PolarHBondContact O-N 3.06Å; M2191-W2197 HydrophobicContact SD-CB 4.45Å; W2197-I2199 HydrophobicContact CD2-CD1 4.03Å; W2197-I2199 HydrophobicContact CD2-CG1 4.33Å; W2197-I2199 HydrophobicContact CE3-CD1 4.2Å; W2197-I2199 HydrophobicContact CG-CD1 4.46Å; W2197-I2199 HydrophobicContact CH2-CD1 3.97Å; W2197-I2199 HydrophobicContact CH2-CG1 4.3Å; W2197-I2199 HydrophobicContact CZ2-CD1 3.64Å; W2197-I2199 VanDerWaalsContact CZ2-CD1 3.43Å; W2197-I2199 HydrophobicContact CZ2-CG1 3.83Å; W2197-I2199 HydrophobicContact CZ3-CD1 4.31Å; W2197-C2210 PolarHBondContact NE1-SG 3.14Å; W2197-C2210 VanDerWaalsContact NE1-SG 3.43Å; W2197-I2240 HydrophobicContact CH2-CG2 4.36Å; W2197-I2240 HydrophobicContact CZ3-CG2 3.96Å; W2197-V2242 HydrophobicContact CE3-CG2 4.07Å; W2197-V2242 HydrophobicContact CZ3-CG2 3.76Å; W2197-G2247 VanDerWaalsContact CH2-CA 3.48Å; W2197-Q2248 VanDerWaalsContact CH2-N 3.33Å; W2197-V2249 HydrophobicContact CH2-CG2 3.73Å; W2197-V2249 VanDerWaalsContact CH2-CG2 3.49Å; W2197-V2249 HydrophobicContact CZ2-CG2 4Å; W2197-V2249 HydrophobicContact CZ3-CG2 4.47Å; W2197-Y2261 AromaticContact CD1-CD1 3.61Å; W2197-Y2261 AromaticContact CD1-CE1 3.63Å; W2197-Y2261 HydrophobicContact CG-CD1 4.43Å; W2197-Y2261 HydrophobicContact CG-CE1 4.47Å; W2197-Y2261 AromaticContact NE1-CD1 3.33Å; W2197-Y2261 VanDerWaalsContact NE1-CD1 3.32Å; W2197-Y2261 AromaticContact NE1-CE1 3.8Å; W2197-Y2261 AromaticContact NE1-CG 3.87Å; W2197-L2263 HydrophobicContact CB-CD2 3.91Å; W2197-L2263 HydrophobicContact CD2-CD2 3.33Å; W2197-L2263 VanDerWaalsContact CD2-CD2 3.5Å; W2197-L2263 HydrophobicContact CE3-CD1 4.4Å; W2197-L2263 HydrophobicContact CE3-CD2 3.35Å; W2197-L2263 VanDerWaalsContact CE3-CD2 3.42Å; W2197-L2263 HydrophobicContact CG-CD2 3.59Å; W2197-L2263 VanDerWaalsContact CG-CD2 3.45Å; W2197-L2263 HydrophobicContact CH2-CD2 4.38Å; W2197-L2263 HydrophobicContact CZ2-CD2 4.47Å; W2197-L2263 HydrophobicContact CZ3-CD2 4.03Å
2198	M	89.2	Confident	84.1	Confident	22.6 Å²	22.6	39.1 Å²	39.1	11%	0.111	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	134.6	177.2	-135.7	179.2	89	0	0	109.6	Y2186 I2187 R2188 E2196 C2210 S2211 M2213 R2218	Y2186-M2198 HydrophobicContact CD1-CE 3.94Å; I2187-M2198 CarbonylContact O-C 3.43Å; I2187-M2198 WeakPolarHBondContact O-CA 3.27Å; R2188-M2198 HydrophobicContact CG-CB 4.33Å; R2188-M2198 HydrophobicContact CG-CE 4.08Å; R2188-M2198 HydrophobicContact CG-CG 4.1Å; R2188-M2198 HydrophobicContact CG-SD 4.28Å; E2196-M2198 HydrophobicContact CG-CG 4.01Å; M2198-C2210 CarbonylContact O-C 3.58Å; M2198-C2210 WeakPolarHBondContact O-CA 3.34Å; M2198-S2211 PolarHBondContact N-O 3.18Å; M2198-S2211 PolarHBondContact O-N 3.02Å; M2198-S2211 PolarHBondContact O-OG 2.86Å; M2198-M2213 HydrophobicContact CB-CG 4.42Å; M2198-M2213 HydrophobicContact CG-CG 3.89Å; M2198-M2213 HydrophobicContact SD-CE 3.61Å; M2198-M2213 HydrophobicContact SD-CG 3.51Å; M2198-M2213 VanDerWaalsContact SD-CG 3.51Å; M2198-M2213 HydrophobicContact SD-SD 4.13Å; M2198-R2218 VanDerWaalsContact CE-CZ 3.5Å
2199	I	91.1	Very high	84.3	Confident	0.8 Å²	0.8	36.6 Å²	36.6	0%	0.004	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	132.4	171.6	-42.2	125.3	0	0	0	108	I2187 I2189 W2197 W2208 T2209 V2249 T2258	I2187-I2199 HydrophobicContact CB-CB 4.17Å; I2187-I2199 HydrophobicContact CB-CD1 4.1Å; I2187-I2199 HydrophobicContact CB-CG1 4.41Å; I2187-I2199 HydrophobicContact CD1-CB 4.36Å; I2187-I2199 HydrophobicContact CD1-CD1 4.38Å; I2187-I2199 HydrophobicContact CG2-CD1 4.05Å; I2187-I2199 PolarHBondContact N-O 3.15Å; I2187-I2199 PolarHBondContact O-N 3.04Å; I2189-I2199 HydrophobicContact CD1-CD1 3.98Å; W2197-I2199 HydrophobicContact CD2-CD1 4.03Å; W2197-I2199 HydrophobicContact CD2-CG1 4.33Å; W2197-I2199 HydrophobicContact CE3-CD1 4.2Å; W2197-I2199 HydrophobicContact CG-CD1 4.46Å; W2197-I2199 HydrophobicContact CH2-CD1 3.97Å; W2197-I2199 HydrophobicContact CH2-CG1 4.3Å; W2197-I2199 HydrophobicContact CZ2-CD1 3.64Å; W2197-I2199 VanDerWaalsContact CZ2-CD1 3.43Å; W2197-I2199 HydrophobicContact CZ2-CG1 3.83Å; W2197-I2199 HydrophobicContact CZ3-CD1 4.31Å; I2199-W2208 HydrophobicContact CG2-CE3 4.09Å; I2199-T2209 CarbonylContact C-O 3.55Å; I2199-T2209 VanDerWaalsContact CA-O 3.31Å; I2199-T2209 WeakPolarHBondContact CA-O 3.4Å; I2199-V2249 HydrophobicContact CD1-CB 4.26Å; I2199-V2249 HydrophobicContact CD1-CG2 3.71Å; I2199-V2249 VanDerWaalsContact CD1-CG2 3.49Å; I2199-V2249 HydrophobicContact CG1-CG2 4.1Å; I2199-T2258 HydrophobicContact CG2-CG2 4.36Å
2200	T	90.9	Very high	84.6	Confident	22.4 Å²	22.4	36.6 Å²	36.6	14%	0.137	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	133.6	171.6	-55.6	0	0	0	0	108.7	I2185 Y2186 W2208 T2209	I2185-T2200 CarbonylContact O-C 3.5Å; I2185-T2200 VanDerWaalsContact O-CA 3.3Å; I2185-T2200 WeakPolarHBondContact O-CA 3.32Å; Y2186-T2200 HydrophobicContact CD1-CG2 3.78Å; Y2186-T2200 HydrophobicContact CE1-CG2 3.59Å; T2200-W2208 CarbonylContact O-C 3.52Å; T2200-W2208 WeakPolarHBondContact O-CA 3.37Å; T2200-T2209 PolarHBondContact N-O 2.91Å; T2200-T2209 PolarHBondContact O-N 3.05Å
2201	A	90	Very high	85.1	Confident	1 Å²	1	35.5 Å²	35.5	1%	0.008	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	126.3	169.9	0	0	0	0	0	109.8	H2184 I2185 E2207 W2208 L2230	H2184-A2201 CarbonylContact C-O 3.5Å; H2184-A2201 VanDerWaalsContact CA-O 3.31Å; H2184-A2201 WeakPolarHBondContact CA-O 3.33Å; I2185-A2201 HydrophobicContact CB-CB 4.12Å; I2185-A2201 HydrophobicContact CD1-CB 4.42Å; I2185-A2201 HydrophobicContact CG1-CB 4.25Å; I2185-A2201 PolarHBondContact N-O 3.16Å; I2185-A2201 PolarHBondContact O-N 2.88Å; A2201-E2207 VanDerWaalsContact CA-O 3.31Å; A2201-E2207 WeakPolarHBondContact CA-O 3.41Å; A2201-W2208 HydrophobicContact CB-CD2 3.58Å; A2201-W2208 HydrophobicContact CB-CE3 3.81Å; A2201-W2208 HydrophobicContact CB-CG 4.11Å; A2201-W2208 HydrophobicContact CB-CH2 4.07Å; A2201-W2208 HydrophobicContact CB-CZ2 3.87Å; A2201-W2208 HydrophobicContact CB-CZ3 4.04Å; A2201-L2230 HydrophobicContact CB-CD1 4.38Å
2202	D	90.2	Very high	85.4	Confident	16.75 Å²	16.75	35.8 Å²	35.8	9%	0.09	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	113.7	169.1	-176.7	-25.2	0	0	0	109.1	R2183 H2184 K2204 T2205 N2206 E2207	R2183-D2202 VanDerWaalsContact CG-OD1 3.27Å; R2183-D2202 WeakPolarHBondContact CG-OD1 3.28Å; R2183-D2202 IonicContact CZ-OD2 2.72Å; R2183-D2202 IonicContact NE-OD1 3.17Å; R2183-D2202 PolarHBondContact NE-OD1 2.98Å; R2183-D2202 IonicContact NE-OD2 3.3Å; R2183-D2202 PolarHBondContact NE-OD2 2.95Å; R2183-D2202 IonicContact NH2-OD2 3.12Å; R2183-D2202 PolarHBondContact NH2-OD2 3.05Å; R2183-D2202 CarbonylContact O-C 3.55Å; R2183-D2202 WeakPolarHBondContact O-CA 3.24Å; H2184-D2202 IonicContact CD2-OD2 3.4Å; H2184-D2202 IonicContact NE2-OD2 3.36Å; D2202-K2204 VanDerWaalsContact C-N 3.26Å; D2202-K2204 PolarHBondContact O-N 3.11Å; D2202-K2204 WeakPolarHBondContact OD1-CA 3.31Å; D2202-K2204 VanDerWaalsContact OD1-CB 3.25Å; D2202-K2204 WeakPolarHBondContact OD1-CB 3.35Å; D2202-K2204 PolarHBondContact OD1-N 3.18Å; D2202-T2205 WeakPolarHBondContact CB-OG1 3.45Å; D2202-T2205 PolarHBondContact O-N 3.03Å; D2202-T2205 PolarHBondContact O-OG1 2.8Å; D2202-T2205 PolarHBondContact OD1-N 2.8Å; D2202-N2206 VanDerWaalsContact O-CA 3.26Å; D2202-N2206 WeakPolarHBondContact O-CA 3.34Å; D2202-N2206 PolarHBondContact O-N 3.06Å; D2202-E2207 PolarHBondContact N-O 2.99Å; D2202-E2207 PolarHBondContact O-N 2.8Å
2203	A	85	Confident	85.8	Confident	14.75 Å²	14.75	34.7 Å²	34.7	12%	0.122	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-15.8	-177.7	0	0	0	0	0	113.9	L2178 R2183 L2230	L2178-A2203 HydrophobicContact CD1-CB 4.3Å; L2178-A2203 HydrophobicContact CD2-CB 3.46Å; L2178-A2203 VanDerWaalsContact CD2-CB 3.45Å; L2178-A2203 HydrophobicContact CG-CB 4.47Å; R2183-A2203 PolarHBondContact O-N 3.07Å; A2203-L2230 HydrophobicContact CB-CB 4.32Å; A2203-L2230 HydrophobicContact CB-CD1 4.12Å
2204	K	84.6	Confident	86	Confident	169.75 Å²	169.75	29.6 Å²	29.6	74%	0.738	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-39.6	175.6	-174	-173.9	174.9	-174.4	0	111.9	R2183 D2202	R2183-K2204 HydrophobicContact CG-CB 4.5Å; D2202-K2204 VanDerWaalsContact C-N 3.26Å; D2202-K2204 PolarHBondContact O-N 3.11Å; D2202-K2204 WeakPolarHBondContact OD1-CA 3.31Å; D2202-K2204 VanDerWaalsContact OD1-CB 3.25Å; D2202-K2204 WeakPolarHBondContact OD1-CB 3.35Å; D2202-K2204 PolarHBondContact OD1-N 3.18Å
2205	T	88	Confident	85.6	Confident	60.25 Å²	60.25	30 Å²	30	37%	0.37	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-17.2	177.3	58	0	0	0	0	112.8	D2202 E2207 Q2225	D2202-T2205 WeakPolarHBondContact CB-OG1 3.45Å; D2202-T2205 PolarHBondContact O-N 3.03Å; D2202-T2205 PolarHBondContact O-OG1 2.8Å; D2202-T2205 PolarHBondContact OD1-N 2.8Å; T2205-E2207 PolarHBondContact O-N 2.85Å; T2205-E2207 WeakPolarHBondContact OG1-CB 3.3Å; T2205-E2207 PolarHBondContact OG1-N 3.13Å; T2205-Q2225 PolarHBondContact O-NE2 3.02Å
2206	N	88	Confident	84.6	Confident	19.25 Å²	19.25	31.3 Å²	31.3	10%	0.103	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	31.5	-169.5	-161.8	35.2	0	0	0	113.3	D2202 S2226 H2228 P2229	D2202-N2206 VanDerWaalsContact O-CA 3.26Å; D2202-N2206 WeakPolarHBondContact O-CA 3.34Å; D2202-N2206 PolarHBondContact O-N 3.06Å; N2206-S2226 VanDerWaalsContact ND2-CB 3.31Å; N2206-S2226 WeakPolarHBondContact ND2-CB 3.32Å; N2206-S2226 PolarHBondContact ND2-O 3.29Å; N2206-S2226 PolarHBondContact ND2-OG 3.31Å; N2206-S2226 WeakPolarHBondContact O-CB 3.5Å; N2206-S2226 PolarHBondContact O-N 3.28Å; N2206-S2226 VanDerWaalsContact O-N 3.1Å; N2206-S2226 WeakPolarHBondContact OD1-CB 3.4Å; N2206-H2228 VanDerWaalsContact ND2-C 3.32Å; N2206-H2228 PolarHBondContact ND2-O 2.84Å; N2206-H2228 VanDerWaalsContact ND2-O 3.09Å; N2206-H2228 PolarHBondContact OD1-O 2.97Å; N2206-P2229 WeakPolarHBondContact ND2-CA 3.36Å; N2206-P2229 WeakPolarHBondContact OD1-CA 3.29Å
2207	E	89.9	Confident	83.4	Confident	65.75 Å²	65.75	36.5 Å²	36.5	31%	0.307	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	132.1	-179	-171.9	-178	177.5	0	0	110	A2201 D2202 T2205 S2223	A2201-E2207 VanDerWaalsContact CA-O 3.31Å; A2201-E2207 WeakPolarHBondContact CA-O 3.41Å; D2202-E2207 PolarHBondContact N-O 2.99Å; D2202-E2207 PolarHBondContact O-N 2.8Å; T2205-E2207 PolarHBondContact O-N 2.85Å; T2205-E2207 WeakPolarHBondContact OG1-CB 3.3Å; T2205-E2207 PolarHBondContact OG1-N 3.13Å; E2207-S2223 WeakPolarHBondContact OE1-CB 3.4Å; E2207-S2223 PolarHBondContact OE1-OG 2.89Å
2208	W	91.9	Very high	82.6	Confident	0.75 Å²	0.75	42.1 Å²	42.1	0%	0.003	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	107.7	177.7	-72.1	69.4	0	0	0	109.9	I2187 I2199 T2200 A2201 S2223 Y2224 L2230 L2238 V2249 Y2257 T2258	I2187-W2208 HydrophobicContact CD1-CZ3 4.05Å; I2199-W2208 HydrophobicContact CG2-CE3 4.09Å; T2200-W2208 CarbonylContact O-C 3.52Å; T2200-W2208 WeakPolarHBondContact O-CA 3.37Å; A2201-W2208 HydrophobicContact CB-CD2 3.58Å; A2201-W2208 HydrophobicContact CB-CE3 3.81Å; A2201-W2208 HydrophobicContact CB-CG 4.11Å; A2201-W2208 HydrophobicContact CB-CH2 4.07Å; A2201-W2208 HydrophobicContact CB-CZ2 3.87Å; A2201-W2208 HydrophobicContact CB-CZ3 4.04Å; W2208-S2223 CarbonylContact O-C 3.51Å; W2208-S2223 WeakPolarHBondContact O-CA 3.19Å; W2208-Y2224 PolarHBondContact N-O 2.82Å; W2208-Y2224 WeakPolarHBondContact O-CD2 3.28Å; W2208-Y2224 PolarHBondContact O-N 3.16Å; W2208-L2230 HydrophobicContact CZ2-CD1 4.15Å; W2208-L2230 HydrophobicContact CZ2-CD2 4.19Å; W2208-L2230 HydrophobicContact CZ2-CG 4.36Å; W2208-L2238 HydrophobicContact CH2-CD1 3.75Å; W2208-L2238 HydrophobicContact CZ3-CD1 3.94Å; W2208-V2249 HydrophobicContact CE3-CG1 4.02Å; W2208-V2249 HydrophobicContact CH2-CG1 4.43Å; W2208-V2249 HydrophobicContact CZ3-CG1 3.98Å; W2208-Y2257 HydrophobicContact CD2-CD2 4.42Å; W2208-Y2257 HydrophobicContact CD2-CG 4.23Å; W2208-Y2257 AromaticContact CE2-CG 3.8Å; W2208-Y2257 HydrophobicContact CE3-CD2 4.34Å; W2208-Y2257 HydrophobicContact CE3-CG 4.47Å; W2208-Y2257 AromaticContact CH2-CD2 3.54Å; W2208-Y2257 HydrophobicContact CH2-CD2 3.54Å; W2208-Y2257 VanDerWaalsContact CH2-CD2 3.48Å; W2208-Y2257 AromaticContact CH2-CE2 3.9Å; W2208-Y2257 HydrophobicContact CH2-CE2 3.96Å; W2208-Y2257 AromaticContact CH2-CG 3.95Å; W2208-Y2257 HydrophobicContact CH2-CG 4.09Å; W2208-Y2257 HydrophobicContact CZ2-CD1 4.21Å; W2208-Y2257 AromaticContact CZ2-CD2 3.6Å; W2208-Y2257 HydrophobicContact CZ2-CD2 3.6Å; W2208-Y2257 HydrophobicContact CZ2-CE1 4.45Å; W2208-Y2257 AromaticContact CZ2-CE2 3.88Å; W2208-Y2257 HydrophobicContact CZ2-CE2 4.02Å; W2208-Y2257 AromaticContact CZ2-CG 3.72Å; W2208-Y2257 HydrophobicContact CZ2-CG 3.72Å; W2208-Y2257 AromaticContact CZ3-CD2 3.94Å; W2208-Y2257 HydrophobicContact CZ3-CD2 3.99Å; W2208-Y2257 HydrophobicContact CZ3-CG 4.46Å; W2208-T2258 HydrophobicContact CB-CG2 3.96Å; W2208-T2258 HydrophobicContact CE3-CG2 4.36Å; W2208-T2258 HydrophobicContact CG-CG2 4.39Å
2209	T	91	Very high	81.8	Confident	18 Å²	18	45.3 Å²	45.3	11%	0.11	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	112.4	-173	-51.2	0	0	0	0	111.3	I2199 T2200 E2221 S2223	I2199-T2209 CarbonylContact C-O 3.55Å; I2199-T2209 VanDerWaalsContact CA-O 3.31Å; I2199-T2209 WeakPolarHBondContact CA-O 3.4Å; T2200-T2209 PolarHBondContact N-O 2.91Å; T2200-T2209 PolarHBondContact O-N 3.05Å; T2209-E2221 HydrophobicContact CG2-CB 3.8Å; T2209-E2221 HydrophobicContact CG2-CG 3.89Å; T2209-E2221 WeakPolarHBondContact CG2-OE1 3.49Å; T2209-S2223 VanDerWaalsContact CG2-OG 3.29Å; T2209-S2223 WeakPolarHBondContact CG2-OG 3.35Å; T2209-S2223 PolarHBondContact OG1-OG 2.85Å
2210	C	91.5	Very high	80.7	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	136.6	171.9	-75.5	0	0	0	0	111.1	W2197 M2198 E2221 V2222 Y2224 Y2261	W2197-C2210 PolarHBondContact NE1-SG 3.14Å; W2197-C2210 VanDerWaalsContact NE1-SG 3.43Å; M2198-C2210 CarbonylContact O-C 3.58Å; M2198-C2210 WeakPolarHBondContact O-CA 3.34Å; C2210-E2221 CarbonylContact O-C 3.58Å; C2210-E2221 WeakPolarHBondContact O-CA 3.33Å; C2210-V2222 PolarHBondContact N-O 3.1Å; C2210-V2222 PolarHBondContact O-N 2.94Å; C2210-Y2224 HydrophobicContact CB-CE2 4.04Å; C2210-Y2261 HydrophobicContact CB-CD1 4.14Å; C2210-Y2261 HydrophobicContact CB-CD2 3.34Å; C2210-Y2261 HydrophobicContact CB-CE1 4.39Å; C2210-Y2261 HydrophobicContact CB-CE2 3.63Å; C2210-Y2261 HydrophobicContact CB-CG 3.63Å
2211	S	89.3	Confident	80.4	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	158.7	174.2	56.5	0	0	0	0	111.9	M2198 R2218 R2220 E2221 Y2261	M2198-S2211 PolarHBondContact N-O 3.18Å; M2198-S2211 PolarHBondContact O-N 3.02Å; M2198-S2211 PolarHBondContact O-OG 2.86Å; S2211-R2218 PolarHBondContact OG-NE 3.09Å; S2211-R2218 VanDerWaalsContact OG-NE 3.12Å; S2211-R2218 PolarHBondContact OG-NH2 2.86Å; S2211-R2220 CarbonylContact C-O 3.47Å; S2211-R2220 WeakPolarHBondContact CA-O 3.34Å; S2211-R2220 VanDerWaalsContact CB-O 3.27Å; S2211-R2220 WeakPolarHBondContact CB-O 3.44Å; S2211-E2221 WeakPolarHBondContact CB-OE1 3.14Å; S2211-E2221 PolarHBondContact OG-OE1 2.79Å; S2211-Y2261 VanDerWaalsContact C-OH 3.28Å; S2211-Y2261 WeakPolarHBondContact CA-OH 3.35Å
2212	S	84.7	Confident	80.2	Confident	7 Å²	7	59.5 Å²	59.5	5%	0.049	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	125.6	178.2	-66.8	0	0	0	0	109.9	E2196 L2219 R2220 Y2261	E2196-S2212 CarbonylContact O-C 3.55Å; E2196-S2212 VanDerWaalsContact O-CA 3.31Å; E2196-S2212 WeakPolarHBondContact O-CA 3.19Å; S2212-L2219 VanDerWaalsContact O-CB 3.3Å; S2212-L2219 WeakPolarHBondContact O-CB 3.42Å; S2212-L2219 WeakPolarHBondContact O-CG 3.3Å; S2212-L2219 PolarHBondContact O-N 3.27Å; S2212-R2220 PolarHBondContact N-O 2.8Å; S2212-Y2261 WeakPolarHBondContact CB-OH 3.27Å; S2212-Y2261 PolarHBondContact N-OH 2.85Å; S2212-Y2261 VanDerWaalsContact N-OH 3.11Å; S2212-Y2261 VanDerWaalsContact OG-CE1 3.29Å; S2212-Y2261 WeakPolarHBondContact OG-CE1 3.4Å; S2212-Y2261 PolarHBondContact OG-OH 3.19Å
2213	M	77.3	Confident	80.1	Confident	33.25 Å²	33.25	61.4 Å²	61.4	16%	0.164	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	132.7	166.4	-77.7	-98.2	-77	0	0	108.6	T2195 E2196 M2198 G2216 E2217 R2218 I2574	T2195-M2213 CarbonylContact C-O 3.57Å; T2195-M2213 VanDerWaalsContact CA-O 3.26Å; T2195-M2213 WeakPolarHBondContact CA-O 3.39Å; T2195-M2213 WeakPolarHBondContact CB-O 3.39Å; E2196-M2213 HydrophobicContact CB-CB 4.04Å; E2196-M2213 HydrophobicContact CB-CG 4.4Å; E2196-M2213 HydrophobicContact CG-CB 4.4Å; E2196-M2213 HydrophobicContact CG-CG 4.47Å; E2196-M2213 PolarHBondContact N-O 3.05Å; E2196-M2213 PolarHBondContact O-N 3.06Å; E2196-M2213 WeakPolarHBondContact OE2-CE 3.37Å; M2198-M2213 HydrophobicContact CB-CG 4.42Å; M2198-M2213 HydrophobicContact CG-CG 3.89Å; M2198-M2213 HydrophobicContact SD-CE 3.61Å; M2198-M2213 HydrophobicContact SD-CG 3.51Å; M2198-M2213 VanDerWaalsContact SD-CG 3.51Å; M2198-M2213 HydrophobicContact SD-SD 4.13Å; M2213-G2216 WeakPolarHBondContact CE-O 3.26Å; M2213-E2217 CarbonylContact C-O 3.56Å; M2213-E2217 VanDerWaalsContact CA-O 3.3Å; M2213-E2217 WeakPolarHBondContact CA-O 3.31Å; M2213-R2218 HydrophobicContact CE-CB 4.41Å; M2213-R2218 HydrophobicContact SD-CB 3.69Å; M2213-R2218 HydrophobicContact SD-CG 3.97Å; M2213-I2574 HydrophobicContact CE-CG2 4.13Å
2214	I	72.7	Confident	80.2	Confident	57.25 Å²	57.25	62.5 Å²	62.5	29%	0.294	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	120.6	171.1	-60.7	-166.1	0	0	0	107.8	T2195 G2216 E2217 L2219 P2264	T2195-I2214 HydrophobicContact CG2-CB 4.29Å; T2195-I2214 HydrophobicContact CG2-CD1 4.34Å; T2195-I2214 HydrophobicContact CG2-CG1 3.91Å; T2195-I2214 HydrophobicContact CG2-CG2 4.1Å; I2214-G2216 PolarHBondContact O-N 3.01Å; I2214-G2216 VanDerWaalsContact O-N 3.09Å; I2214-E2217 PolarHBondContact N-O 2.88Å; I2214-E2217 PolarHBondContact O-N 3.03Å; I2214-L2219 HydrophobicContact CB-CD1 4.11Å; I2214-L2219 HydrophobicContact CB-CG 4.3Å; I2214-L2219 HydrophobicContact CD1-CD1 3.77Å; I2214-L2219 HydrophobicContact CG1-CD1 3.95Å; I2214-L2219 HydrophobicContact CG1-CG 4.44Å; I2214-L2219 HydrophobicContact CG2-CD1 4.23Å; I2214-P2264 HydrophobicContact CD1-CB 3.92Å; I2214-P2264 HydrophobicContact CG1-CB 3.93Å
2215	N	60.9	Low	80.3	Confident	95.25 Å²	95.25	60.5 Å²	60.5	51%	0.509	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	30.9	-176.5	-56	-32.2	0	0	0	113.6	N2194 E2217 V2569 N2570	N2194-N2215 WeakPolarHBondContact O-CA 3.2Å; N2194-N2215 PolarHBondContact O-N 2.99Å; N2215-E2217 VanDerWaalsContact C-N 3.29Å; N2215-E2217 PolarHBondContact O-N 3.2Å; N2215-V2569 VanDerWaalsContact CA-CG1 3.49Å; N2215-V2569 HydrophobicContact CB-CG1 4.06Å; N2215-V2569 WeakPolarHBondContact O-CB 3.29Å; N2215-N2570 HydrophobicContact CB-CB 3.85Å; N2215-N2570 VanDerWaalsContact CG-CG 3.46Å; N2215-N2570 PolarHBondContact ND2-ND2 3.06Å; N2215-N2570 PolarHBondContact OD1-ND2 3.34Å
2216	G	57.2	Low	80	Confident	38 Å²	38	58 Å²	58	39%	0.392	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.2	-20	-174.8	0	0	0	0	0	115	M2213 I2214	M2213-G2216 WeakPolarHBondContact CE-O 3.26Å; I2214-G2216 PolarHBondContact O-N 3.01Å; I2214-G2216 VanDerWaalsContact O-N 3.09Å
2217	E	57.2	Low	79.5	Confident	123.5 Å²	123.5	64.2 Å²	64.2	58%	0.577	32%	0.32	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	132.5	179.2	-63.6	-169.1	152.6	0	0	112	M2213 I2214 N2215 L2219 R2572 I2574	M2213-E2217 CarbonylContact C-O 3.56Å; M2213-E2217 VanDerWaalsContact CA-O 3.3Å; M2213-E2217 WeakPolarHBondContact CA-O 3.31Å; I2214-E2217 PolarHBondContact N-O 2.88Å; I2214-E2217 PolarHBondContact O-N 3.03Å; N2215-E2217 VanDerWaalsContact C-N 3.29Å; N2215-E2217 PolarHBondContact O-N 3.2Å; E2217-L2219 HydrophobicContact CB-CD2 4.24Å; E2217-L2219 PolarHBondContact O-N 3.05Å; E2217-R2572 WeakPolarHBondContact OE1-CD 3.36Å; E2217-R2572 IonicContact OE1-CZ 2.98Å; E2217-R2572 IonicContact OE1-NE 3.94Å; E2217-R2572 IonicContact OE1-NH1 2.68Å; E2217-R2572 PolarHBondContact OE1-NH1 3.27Å; E2217-R2572 IonicContact OE2-NH1 2.68Å; E2217-R2572 PolarHBondContact OE2-NH1 3.32Å; E2217-I2574 HydrophobicContact CG-CD1 4.41Å
2218	R	73.9	Confident	79	Confident	118 Å²	118	64.7 Å²	64.7	45%	0.445	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	103.6	-179.4	-167.7	168.7	179.7	162.6	-8.1	110.5	M2198 S2211 M2213 R2220 E2221	M2198-R2218 VanDerWaalsContact CE-CZ 3.5Å; S2211-R2218 PolarHBondContact OG-NE 3.09Å; S2211-R2218 VanDerWaalsContact OG-NE 3.12Å; S2211-R2218 PolarHBondContact OG-NH2 2.86Å; M2213-R2218 HydrophobicContact CE-CB 4.41Å; M2213-R2218 HydrophobicContact SD-CB 3.69Å; M2213-R2218 HydrophobicContact SD-CG 3.97Å; R2218-R2220 PolarHBondContact O-N 2.81Å; R2218-E2221 IonicContact CZ-OE1 3.29Å; R2218-E2221 IonicContact CZ-OE2 3.7Å; R2218-E2221 IonicContact NE-OE1 3.04Å; R2218-E2221 PolarHBondContact NE-OE1 3.05Å; R2218-E2221 IonicContact NH1-OE1 3.41Å; R2218-E2221 PolarHBondContact NH1-OE1 2.85Å; R2218-E2221 IonicContact NH1-OE2 3.81Å; R2218-E2221 PolarHBondContact NH1-OE2 2.83Å; R2218-E2221 VanDerWaalsContact NH2-CD 3.31Å; R2218-E2221 IonicContact NH2-OE1 2.72Å; R2218-E2221 PolarHBondContact NH2-OE1 3Å; R2218-E2221 IonicContact NH2-OE2 2.95Å
2219	L	71.7	Confident	78.3	Confident	89.75 Å²	89.75	68.7 Å²	68.7	47%	0.47	35%	0.348	S	S	.	.			trans	-75.7	172.7	-179.9	-61.2	-176.2	0	0	0	113.1	S2212 I2214 E2217 E2221	S2212-L2219 VanDerWaalsContact O-CB 3.3Å; S2212-L2219 WeakPolarHBondContact O-CB 3.42Å; S2212-L2219 WeakPolarHBondContact O-CG 3.3Å; S2212-L2219 PolarHBondContact O-N 3.27Å; I2214-L2219 HydrophobicContact CB-CD1 4.11Å; I2214-L2219 HydrophobicContact CB-CG 4.3Å; I2214-L2219 HydrophobicContact CD1-CD1 3.77Å; I2214-L2219 HydrophobicContact CG1-CD1 3.95Å; I2214-L2219 HydrophobicContact CG1-CG 4.44Å; I2214-L2219 HydrophobicContact CG2-CD1 4.23Å; E2217-L2219 HydrophobicContact CB-CD2 4.24Å; E2217-L2219 PolarHBondContact O-N 3.05Å; L2219-E2221 PolarHBondContact O-N 2.93Å
2220	R	69.4	Low	77.8	Confident	187.75 Å²	187.75	68.5 Å²	68.5	71%	0.708	35%	0.346	S	S	*	.			trans	-64.1	130.8	179.5	-178.5	176.5	-179.5	178.3	3.4	112.2	D2013 S2211 S2212 R2218 V2222 Y2261	D2013-R2220 IonicContact OD1-NH1 2.75Å; S2211-R2220 CarbonylContact C-O 3.47Å; S2211-R2220 WeakPolarHBondContact CA-O 3.34Å; S2211-R2220 VanDerWaalsContact CB-O 3.27Å; S2211-R2220 WeakPolarHBondContact CB-O 3.44Å; S2212-R2220 PolarHBondContact N-O 2.8Å; R2218-R2220 PolarHBondContact O-N 2.81Å; R2220-V2222 HydrophobicContact CG-CG2 4.36Å; R2220-Y2261 PolarHBondContact O-OH 3.22Å
2221	E	83.8	Confident	77.1	Confident	90.5 Å²	90.5	73.3 Å²	73.3	42%	0.423	37%	0.369	S	S	.	.			trans	-93.5	150.7	176.9	-59.5	-167.6	141.4	0	0	111.2	T2209 C2210 S2211 R2218 L2219	T2209-E2221 HydrophobicContact CG2-CB 3.8Å; T2209-E2221 HydrophobicContact CG2-CG 3.89Å; T2209-E2221 WeakPolarHBondContact CG2-OE1 3.49Å; C2210-E2221 CarbonylContact O-C 3.58Å; C2210-E2221 WeakPolarHBondContact O-CA 3.33Å; S2211-E2221 WeakPolarHBondContact CB-OE1 3.14Å; S2211-E2221 PolarHBondContact OG-OE1 2.79Å; R2218-E2221 IonicContact CZ-OE1 3.29Å; R2218-E2221 IonicContact CZ-OE2 3.7Å; R2218-E2221 IonicContact NE-OE1 3.04Å; R2218-E2221 PolarHBondContact NE-OE1 3.05Å; R2218-E2221 IonicContact NH1-OE1 3.41Å; R2218-E2221 PolarHBondContact NH1-OE1 2.85Å; R2218-E2221 IonicContact NH1-OE2 3.81Å; R2218-E2221 PolarHBondContact NH1-OE2 2.83Å; R2218-E2221 VanDerWaalsContact NH2-CD 3.31Å; R2218-E2221 IonicContact NH2-OE1 2.72Å; R2218-E2221 PolarHBondContact NH2-OE1 3Å; R2218-E2221 IonicContact NH2-OE2 2.95Å; L2219-E2221 PolarHBondContact O-N 2.93Å
2222	V	85.4	Confident	76.7	Confident	44.25 Å²	44.25	78.8 Å²	78.8	27%	0.268	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	111.4	173.9	-174.6	0	0	0	0	108.4	C2210 R2220 Y2224 Y2261	C2210-V2222 PolarHBondContact N-O 3.1Å; C2210-V2222 PolarHBondContact O-N 2.94Å; R2220-V2222 HydrophobicContact CG-CG2 4.36Å; V2222-Y2224 HydrophobicContact CB-CE2 4.42Å; V2222-Y2224 HydrophobicContact CG1-CD1 4.33Å; V2222-Y2224 HydrophobicContact CG1-CE1 3.7Å; V2222-Y2224 HydrophobicContact CG1-CE2 4.15Å; V2222-Y2224 VanDerWaalsContact CG1-CZ 3.48Å; V2222-Y2224 WeakPolarHBondContact CG1-OH 3.42Å; V2222-Y2224 WeakPolarHBondContact O-CE2 3.46Å; V2222-Y2261 HydrophobicContact CB-CD2 4.33Å; V2222-Y2261 HydrophobicContact CB-CE2 4.21Å; V2222-Y2261 HydrophobicContact CG2-CD2 4.35Å; V2222-Y2261 HydrophobicContact CG2-CE2 4Å
2223	S	88.7	Confident	76.3	Confident	56.25 Å²	56.25	81 Å²	81	39%	0.393	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	145.1	172.9	-65.5	0	0	0	0	112.3	E2207 W2208 T2209	E2207-S2223 WeakPolarHBondContact OE1-CB 3.4Å; E2207-S2223 PolarHBondContact OE1-OG 2.89Å; W2208-S2223 CarbonylContact O-C 3.51Å; W2208-S2223 WeakPolarHBondContact O-CA 3.19Å; T2209-S2223 VanDerWaalsContact CG2-OG 3.29Å; T2209-S2223 WeakPolarHBondContact CG2-OG 3.35Å; T2209-S2223 PolarHBondContact OG1-OG 2.85Å
2224	Y	87.2	Confident	76.5	Confident	39 Å²	39	85.1 Å²	85.1	15%	0.153	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	129.7	174.6	-54.3	-73.4	0	0	0	109.3	W2208 C2210 V2222 S2226 T2258 D2259	W2208-Y2224 PolarHBondContact N-O 2.82Å; W2208-Y2224 WeakPolarHBondContact O-CD2 3.28Å; W2208-Y2224 PolarHBondContact O-N 3.16Å; C2210-Y2224 HydrophobicContact CB-CE2 4.04Å; V2222-Y2224 HydrophobicContact CB-CE2 4.42Å; V2222-Y2224 HydrophobicContact CG1-CD1 4.33Å; V2222-Y2224 HydrophobicContact CG1-CE1 3.7Å; V2222-Y2224 HydrophobicContact CG1-CE2 4.15Å; V2222-Y2224 VanDerWaalsContact CG1-CZ 3.48Å; V2222-Y2224 WeakPolarHBondContact CG1-OH 3.42Å; V2222-Y2224 WeakPolarHBondContact O-CE2 3.46Å; Y2224-S2226 PolarHBondContact O-N 3.12Å; Y2224-T2258 VanDerWaalsContact CD2-CB 3.46Å; Y2224-T2258 HydrophobicContact CD2-CG2 3.88Å; Y2224-T2258 HydrophobicContact CE2-CG2 4.3Å; Y2224-D2259 HydrophobicContact CD1-CB 3.77Å; Y2224-D2259 HydrophobicContact CE1-CB 3.41Å; Y2224-D2259 PolarHBondContact OH-O 2.81Å
2225	Q	87.4	Confident	77	Confident	126.5 Å²	126.5	87.5 Å²	87.5	59%	0.591	44%	0.438	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.9	117.4	173.6	-167.2	64.4	25.2	0	0	108.9	T2205	T2205-Q2225 PolarHBondContact O-NE2 3.02Å
2226	S	81.3	Confident	78.2	Confident	8.25 Å²	8.25	84 Å²	84	6%	0.058	42%	0.419	C	S	.	.			trans	-78.4	136.5	-179.7	170.2	0	0	0	0	111.3	N2206 Y2224 H2228	N2206-S2226 VanDerWaalsContact ND2-CB 3.31Å; N2206-S2226 WeakPolarHBondContact ND2-CB 3.32Å; N2206-S2226 PolarHBondContact ND2-O 3.29Å; N2206-S2226 PolarHBondContact ND2-OG 3.31Å; N2206-S2226 WeakPolarHBondContact O-CB 3.5Å; N2206-S2226 PolarHBondContact O-N 3.28Å; N2206-S2226 VanDerWaalsContact O-N 3.1Å; N2206-S2226 WeakPolarHBondContact OD1-CB 3.4Å; Y2224-S2226 PolarHBondContact O-N 3.12Å; S2226-H2228 VanDerWaalsContact C-N 3.28Å; S2226-H2228 PolarHBondContact O-N 2.75Å; S2226-H2228 WeakPolarHBondContact OG-CA 3.17Å; S2226-H2228 PolarHBondContact OG-N 3.05Å; S2226-H2228 PolarHBondContact OG-O 3.1Å
2227	N	77.7	Confident	79.6	Confident	150 Å²	150	85 Å²	85	80%	0.802	42%	0.419	S	S	*	.	S	Bend	trans	-79.4	-0.5	168.6	-71.1	-26.9	0	0	0	112.9
2228	H	78	Confident	81	Confident	75.75 Å²	75.75	79.2 Å²	79.2	35%	0.351	39%	0.391	S	S	.	.	S	Bend	trans	-124.3	94.1	-175.6	-64.7	-6.9	0	0	0	109.3	N2206 S2226 K2255 Y2257	N2206-H2228 VanDerWaalsContact ND2-C 3.32Å; N2206-H2228 PolarHBondContact ND2-O 2.84Å; N2206-H2228 VanDerWaalsContact ND2-O 3.09Å; N2206-H2228 PolarHBondContact OD1-O 2.97Å; S2226-H2228 VanDerWaalsContact C-N 3.28Å; S2226-H2228 PolarHBondContact O-N 2.75Å; S2226-H2228 WeakPolarHBondContact OG-CA 3.17Å; S2226-H2228 PolarHBondContact OG-N 3.05Å; S2226-H2228 PolarHBondContact OG-O 3.1Å; H2228-K2255 PolarHBondContact CD2-O 2.79Å; H2228-K2255 WeakPolarHBondContact NE2-CB 3.45Å; H2228-Y2257 HydrophobicContact CB-CD1 4.29Å; H2228-Y2257 HydrophobicContact CB-CE1 3.92Å
2229	P	77.8	Confident	81.7	Confident	83.5 Å²	83.5	75.1 Å²	75.1	54%	0.542	38%	0.378	S	S	.	.			trans	-70.2	135.7	-177.7	27.5	-33.8	0	0	0	112.1	N2206 Q2231	N2206-P2229 WeakPolarHBondContact ND2-CA 3.36Å; N2206-P2229 WeakPolarHBondContact OD1-CA 3.29Å; P2229-Q2231 PolarHBondContact O-N 2.82Å
2230	L	80.2	Confident	82.4	Confident	15.5 Å²	15.5	70.9 Å²	70.9	8%	0.081	36%	0.356	C	S	.	.			trans	-65.8	130.7	175	-67	172.5	0	0	0	110.5	L2178 I2185 A2201 A2203 W2208 F2236	L2178-L2230 HydrophobicContact CD2-CB 4.18Å; I2185-L2230 HydrophobicContact CD1-CD1 3.67Å; I2185-L2230 HydrophobicContact CD1-CD2 4.36Å; I2185-L2230 HydrophobicContact CG1-CD1 4.42Å; A2201-L2230 HydrophobicContact CB-CD1 4.38Å; A2203-L2230 HydrophobicContact CB-CB 4.32Å; A2203-L2230 HydrophobicContact CB-CD1 4.12Å; W2208-L2230 HydrophobicContact CZ2-CD1 4.15Å; W2208-L2230 HydrophobicContact CZ2-CD2 4.19Å; W2208-L2230 HydrophobicContact CZ2-CG 4.36Å; L2230-F2236 HydrophobicContact CD2-CD1 4.25Å; L2230-F2236 HydrophobicContact CD2-CD2 4.03Å; L2230-F2236 HydrophobicContact CD2-CE1 3.87Å; L2230-F2236 HydrophobicContact CD2-CE2 3.63Å; L2230-F2236 HydrophobicContact CD2-CG 4.33Å; L2230-F2236 HydrophobicContact CD2-CZ 3.54Å; L2230-F2236 VanDerWaalsContact CD2-CZ 3.47Å
2231	Q	77.8	Confident	83.1	Confident	100.75 Å²	100.75	63.5 Å²	63.5	47%	0.471	33%	0.329	S	S	.	.			trans	-108.6	119.3	-178.4	-63.6	-175.1	20	0	0	110.5	P2229 G2233 K2234	P2229-Q2231 PolarHBondContact O-N 2.82Å; Q2231-G2233 PolarHBondContact O-N 2.86Å; Q2231-K2234 HydrophobicContact CB-CB 4.28Å; Q2231-K2234 HydrophobicContact CB-CD 4.08Å; Q2231-K2234 HydrophobicContact CB-CG 4.35Å; Q2231-K2234 PolarHBondContact O-N 3.01Å; Q2231-K2234 VanDerWaalsContact O-N 3.15Å
2232	Y	81.6	Confident	82.9	Confident	115.75 Å²	115.75	59.6 Å²	59.6	45%	0.454	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.8	133.8	176.2	-63.4	-80.3	0	0	0	112.1	L2178 R2179 G2182 K2234	L2178-Y2232 HydrophobicContact CD2-CD1 3.71Å; L2178-Y2232 HydrophobicContact CD2-CE1 3.67Å; L2178-Y2232 VanDerWaalsContact CD2-CE1 3.48Å; L2178-Y2232 HydrophobicContact CD2-CG 4.3Å; L2178-Y2232 HydrophobicContact CG-CD1 4.17Å; L2178-Y2232 HydrophobicContact CG-CE1 4.34Å; R2179-Y2232 WeakPolarHBondContact O-CD1 3.37Å; G2182-Y2232 VanDerWaalsContact O-CE1 3.25Å; G2182-Y2232 WeakPolarHBondContact O-CE1 3.35Å; G2182-Y2232 PolarHBondContact O-OH 2.84Å; Y2232-K2234 PolarHBondContact O-N 2.84Å; Y2232-K2234 VanDerWaalsContact O-N 3.14Å
2233	G	75.7	Confident	82.3	Confident	51.25 Å²	51.25	62.1 Å²	62.1	53%	0.528	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.1	-1.9	176.7	0	0	0	0	0	116	L2178 Q2231	L2178-G2233 PolarHBondContact O-N 2.89Å; Q2231-G2233 PolarHBondContact O-N 2.86Å
2234	K	81	Confident	81.3	Confident	121.25 Å²	121.25	62 Å²	62	53%	0.527	32%	0.322	S	S	.	.			trans	-97.6	145.7	175.1	-67.5	-169.3	-174.7	171.9	0	112.3	T2177 Q2231 Y2232	T2177-K2234 WeakPolarHBondContact CA-O 3.3Å; T2177-K2234 PolarHBondContact OG1-O 3.04Å; Q2231-K2234 HydrophobicContact CB-CB 4.28Å; Q2231-K2234 HydrophobicContact CB-CD 4.08Å; Q2231-K2234 HydrophobicContact CB-CG 4.35Å; Q2231-K2234 PolarHBondContact O-N 3.01Å; Q2231-K2234 VanDerWaalsContact O-N 3.15Å; Y2232-K2234 PolarHBondContact O-N 2.84Å; Y2232-K2234 VanDerWaalsContact O-N 3.14Å
2235	K	83.6	Confident	80.5	Confident	106.5 Å²	106.5	61.2 Å²	61.2	46%	0.463	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	137.3	167.3	-75.8	170.6	168.3	-108.1	0	110.5	E2175 L2176 T2177 H2280	E2175-K2235 HydrophobicContact CG-CB 4.06Å; E2175-K2235 HydrophobicContact CG-CD 4.45Å; E2175-K2235 HydrophobicContact CG-CG 4.19Å; E2175-K2235 WeakPolarHBondContact OE1-CD 3.46Å; E2175-K2235 IonicContact OE1-NZ 3.26Å; E2175-K2235 WeakPolarHBondContact OE2-CD 3.41Å; E2175-K2235 WeakPolarHBondContact OE2-CE 3.41Å; E2175-K2235 IonicContact OE2-NZ 3.23Å; E2175-K2235 PolarHBondContact OE2-NZ 2.98Å; L2176-K2235 CarbonylContact O-C 3.53Å; L2176-K2235 VanDerWaalsContact O-CA 3.26Å; L2176-K2235 WeakPolarHBondContact O-CA 3.38Å; T2177-K2235 WeakPolarHBondContact OG1-CA 3.43Å; T2177-K2235 WeakPolarHBondContact OG1-CG 3.29Å; K2235-H2280 VanDerWaalsContact CE-CE1 3.4Å; K2235-H2280 WeakPolarHBondContact CE-CE1 3.34Å; K2235-H2280 WeakPolarHBondContact CE-ND1 3.48Å; K2235-H2280 PolarHBondContact NZ-CD2 3.37Å; K2235-H2280 PolarHBondContact NZ-CE1 2.99Å; K2235-H2280 VanDerWaalsContact NZ-CE1 3.28Å; K2235-H2280 PolarHBondContact NZ-ND1 2.99Å
2236	F	85.1	Confident	80.2	Confident	21.25 Å²	21.25	57.5 Å²	57.5	9%	0.093	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	144.6	171.6	64.9	-85.9	0	0	0	111.1	E2175 L2176 L2178 I2185 L2230 Y2257	E2175-F2236 WeakPolarHBondContact CA-O 3.31Å; L2176-F2236 HydrophobicContact CB-CD1 4.34Å; L2176-F2236 HydrophobicContact CB-CD2 4.4Å; L2176-F2236 HydrophobicContact CB-CE1 3.77Å; L2176-F2236 HydrophobicContact CB-CE2 3.88Å; L2176-F2236 HydrophobicContact CB-CZ 3.51Å; L2176-F2236 VanDerWaalsContact CB-CZ 3.49Å; L2176-F2236 HydrophobicContact CD1-CE2 4Å; L2176-F2236 HydrophobicContact CD1-CZ 3.93Å; L2176-F2236 HydrophobicContact CG-CE2 4.37Å; L2176-F2236 HydrophobicContact CG-CZ 4.3Å; L2176-F2236 PolarHBondContact N-O 3.08Å; L2176-F2236 VanDerWaalsContact O-CD1 3.29Å; L2176-F2236 WeakPolarHBondContact O-CD1 3.28Å; L2176-F2236 PolarHBondContact O-N 3Å; L2178-F2236 HydrophobicContact CB-CE1 4.45Å; I2185-F2236 HydrophobicContact CD1-CE2 4.44Å; I2185-F2236 HydrophobicContact CD1-CZ 3.77Å; L2230-F2236 HydrophobicContact CD2-CD1 4.25Å; L2230-F2236 HydrophobicContact CD2-CD2 4.03Å; L2230-F2236 HydrophobicContact CD2-CE1 3.87Å; L2230-F2236 HydrophobicContact CD2-CE2 3.63Å; L2230-F2236 HydrophobicContact CD2-CG 4.33Å; L2230-F2236 HydrophobicContact CD2-CZ 3.54Å; L2230-F2236 VanDerWaalsContact CD2-CZ 3.47Å; F2236-Y2257 HydrophobicContact CD2-CE2 4.48Å
2237	P	86.4	Confident	80.4	Confident	60.5 Å²	60.5	57.1 Å²	57.1	39%	0.393	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	148.1	175.4	31.4	-33.7	0	0	0	111.8	A2174 P2251 Y2257	A2174-P2237 CarbonylContact O-C 3.53Å; A2174-P2237 WeakPolarHBondContact O-CA 3.4Å; P2237-P2251 HydrophobicContact CG-CB 3.91Å; P2237-Y2257 PolarHBondContact O-OH 2.84Å
2238	L	88.1	Confident	80.9	Confident	0.75 Å²	0.75	50.8 Å²	50.8	0%	0.004	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	95.1	175.8	-174.7	88.6	0	0	0	109.5	D2173 A2174 L2176 I2187 W2208 I2240 V2249 G2250 Y2257 I2273	D2173-L2238 CarbonylContact C-O 3.56Å; D2173-L2238 WeakPolarHBondContact CA-O 3.42Å; A2174-L2238 HydrophobicContact CB-CB 4.4Å; A2174-L2238 PolarHBondContact N-O 3.2Å; A2174-L2238 PolarHBondContact O-N 2.82Å; L2176-L2238 HydrophobicContact CD1-CB 4.18Å; L2176-L2238 HydrophobicContact CD1-CD1 3.92Å; L2176-L2238 HydrophobicContact CD1-CD2 3.86Å; L2176-L2238 HydrophobicContact CD1-CG 4.41Å; L2176-L2238 HydrophobicContact CG-CB 4.33Å; L2176-L2238 HydrophobicContact CG-CD2 4.39Å; I2187-L2238 HydrophobicContact CD1-CD1 4.18Å; I2187-L2238 HydrophobicContact CD1-CD2 3.73Å; I2187-L2238 HydrophobicContact CD1-CG 4.46Å; I2187-L2238 HydrophobicContact CG1-CD2 4.3Å; W2208-L2238 HydrophobicContact CH2-CD1 3.75Å; W2208-L2238 HydrophobicContact CZ3-CD1 3.94Å; L2238-I2240 HydrophobicContact CD2-CD1 4.22Å; L2238-I2240 HydrophobicContact CD2-CG1 4.26Å; L2238-I2240 HydrophobicContact CG-CG1 4.36Å; L2238-V2249 HydrophobicContact CD1-CG1 3.49Å; L2238-V2249 HydrophobicContact CD2-CG1 4.24Å; L2238-V2249 HydrophobicContact CG-CG1 3.93Å; L2238-G2250 CarbonylContact C-O 3.56Å; L2238-G2250 WeakPolarHBondContact CA-O 3.34Å; L2238-Y2257 HydrophobicContact CD1-CD2 4.09Å; L2238-Y2257 HydrophobicContact CD1-CE2 4.03Å; L2238-I2273 HydrophobicContact CD2-CD1 3.95Å
2239	L	87.1	Confident	81.4	Confident	32.25 Å²	32.25	47.3 Å²	47.3	17%	0.169	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	124.7	170.3	-90.1	146.1	0	0	0	109.8	T2170 L2171 A2172 D2173 F2241 V2249 G2250 P2251 M2253	T2170-L2239 HydrophobicContact CG2-CD2 3.67Å; L2171-L2239 HydrophobicContact CD1-CD1 3.88Å; L2171-L2239 HydrophobicContact CD1-CD2 4.06Å; L2171-L2239 HydrophobicContact CD1-CG 3.95Å; L2171-L2239 HydrophobicContact CD2-CD2 4.32Å; L2171-L2239 HydrophobicContact CG-CD1 4.26Å; L2171-L2239 HydrophobicContact CG-CD2 4.15Å; A2172-L2239 CarbonylContact O-C 3.59Å; A2172-L2239 WeakPolarHBondContact O-CA 3.34Å; D2173-L2239 HydrophobicContact CB-CD1 3.92Å; D2173-L2239 HydrophobicContact CB-CD2 3.62Å; D2173-L2239 VanDerWaalsContact OD1-CD2 3.23Å; D2173-L2239 WeakPolarHBondContact OD1-CD2 3.28Å; L2239-F2241 HydrophobicContact CB-CD2 4.26Å; L2239-F2241 HydrophobicContact CB-CE1 3.99Å; L2239-F2241 HydrophobicContact CB-CE2 3.53Å; L2239-F2241 HydrophobicContact CB-CZ 3.39Å; L2239-F2241 HydrophobicContact CD1-CE1 4.13Å; L2239-F2241 HydrophobicContact CD1-CE2 4.28Å; L2239-F2241 HydrophobicContact CD1-CZ 3.47Å; L2239-F2241 VanDerWaalsContact CD1-CZ 3.47Å; L2239-F2241 HydrophobicContact CG-CZ 4.04Å; L2239-V2249 VanDerWaalsContact O-CA 3.32Å; L2239-V2249 WeakPolarHBondContact O-CA 3.25Å; L2239-G2250 WeakPolarHBondContact CA-O 3.24Å; L2239-G2250 WeakPolarHBondContact CB-O 3.5Å; L2239-G2250 PolarHBondContact N-O 3Å; L2239-G2250 PolarHBondContact O-N 2.96Å; L2239-G2250 VanDerWaalsContact O-N 3.07Å; L2239-P2251 WeakPolarHBondContact CD1-O 3.33Å; L2239-M2253 HydrophobicContact CD2-CG 3.88Å; L2239-M2253 HydrophobicContact CD2-SD 4.17Å
2240	I	87.5	Confident	81.9	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.005	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	116	174.2	-56.8	171.2	0	0	0	107.6	T2170 L2171 A2172 I2187 I2189 W2197 L2238 V2249 I2271 I2273	T2170-I2240 CarbonylContact C-O 3.58Å; L2171-I2240 WeakPolarHBondContact CA-O 3.18Å; L2171-I2240 HydrophobicContact CB-CG2 4.38Å; L2171-I2240 WeakPolarHBondContact CB-O 3.48Å; L2171-I2240 HydrophobicContact CD2-CG2 4.06Å; L2171-I2240 PolarHBondContact N-O 3.32Å; A2172-I2240 HydrophobicContact CB-CB 4.3Å; A2172-I2240 HydrophobicContact CB-CD1 4.13Å; A2172-I2240 HydrophobicContact CB-CG1 4.27Å; A2172-I2240 PolarHBondContact N-O 2.87Å; A2172-I2240 PolarHBondContact O-N 3.09Å; I2187-I2240 HydrophobicContact CG2-CD1 3.85Å; I2187-I2240 HydrophobicContact CG2-CG1 4.45Å; I2189-I2240 HydrophobicContact CD1-CD1 4.14Å; I2189-I2240 HydrophobicContact CD1-CG2 3.77Å; W2197-I2240 HydrophobicContact CH2-CG2 4.36Å; W2197-I2240 HydrophobicContact CZ3-CG2 3.96Å; L2238-I2240 HydrophobicContact CD2-CD1 4.22Å; L2238-I2240 HydrophobicContact CD2-CG1 4.26Å; L2238-I2240 HydrophobicContact CG-CG1 4.36Å; I2240-V2249 HydrophobicContact CB-CG2 4.23Å; I2240-V2249 HydrophobicContact CG1-CG1 4.3Å; I2240-V2249 HydrophobicContact CG1-CG2 4.18Å; I2240-V2249 HydrophobicContact CG2-CG2 4.18Å; I2240-I2271 HydrophobicContact CD1-CD1 4.14Å; I2240-I2271 HydrophobicContact CD1-CG2 3.91Å; I2240-I2273 HydrophobicContact CD1-CD1 4.49Å
2241	F	84.7	Confident	82	Confident	31.75 Å²	31.75	43.9 Å²	43.9	14%	0.139	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	118.2	-176	-159.1	-97	0	0	0	111.3	P2168 Y2169 L2171 L2239 K2243 G2247 Q2248 D2252 M2253	P2168-F2241 HydrophobicContact CB-CB 4.38Å; P2168-F2241 HydrophobicContact CB-CD1 4.13Å; P2168-F2241 HydrophobicContact CG-CD1 4.35Å; Y2169-F2241 HydrophobicContact CD2-CD2 4.4Å; Y2169-F2241 AromaticContact CD2-CE2 3.7Å; Y2169-F2241 HydrophobicContact CD2-CE2 3.7Å; Y2169-F2241 HydrophobicContact CD2-CZ 4.42Å; Y2169-F2241 HydrophobicContact CE2-CE2 4.14Å; Y2169-F2241 CarbonylContact O-C 3.53Å; Y2169-F2241 WeakPolarHBondContact O-CA 3.29Å; L2171-F2241 HydrophobicContact CD1-CB 4.46Å; L2171-F2241 HydrophobicContact CD1-CD2 3.9Å; L2239-F2241 HydrophobicContact CB-CD2 4.26Å; L2239-F2241 HydrophobicContact CB-CE1 3.99Å; L2239-F2241 HydrophobicContact CB-CE2 3.53Å; L2239-F2241 HydrophobicContact CB-CZ 3.39Å; L2239-F2241 HydrophobicContact CD1-CE1 4.13Å; L2239-F2241 HydrophobicContact CD1-CE2 4.28Å; L2239-F2241 HydrophobicContact CD1-CZ 3.47Å; L2239-F2241 VanDerWaalsContact CD1-CZ 3.47Å; L2239-F2241 HydrophobicContact CG-CZ 4.04Å; F2241-K2243 HydrophobicContact CD1-CB 4.23Å; F2241-K2243 HydrophobicContact CE1-CB 3.61Å; F2241-K2243 HydrophobicContact CE1-CD 3.79Å; F2241-K2243 HydrophobicContact CE1-CG 4.37Å; F2241-K2243 HydrophobicContact CE2-CB 4.47Å; F2241-K2243 HydrophobicContact CE2-CD 4.24Å; F2241-K2243 HydrophobicContact CZ-CB 3.81Å; F2241-K2243 HydrophobicContact CZ-CD 3.33Å; F2241-K2243 VanDerWaalsContact CZ-CD 3.41Å; F2241-K2243 HydrophobicContact CZ-CG 4.24Å; F2241-G2247 CarbonylContact O-C 3.54Å; F2241-G2247 VanDerWaalsContact O-CA 3.29Å; F2241-G2247 WeakPolarHBondContact O-CA 3.38Å; F2241-Q2248 HydrophobicContact CD1-CB 4.49Å; F2241-Q2248 PolarHBondContact N-O 3.12Å; F2241-Q2248 PolarHBondContact O-N 3.16Å; F2241-D2252 VanDerWaalsContact CE2-C 3.48Å; F2241-M2253 HydrophobicContact CB-CE 4.17Å; F2241-M2253 HydrophobicContact CB-SD 3.7Å; F2241-M2253 VanDerWaalsContact CB-SD 3.57Å; F2241-M2253 HydrophobicContact CD1-CE 3.59Å; F2241-M2253 HydrophobicContact CD1-CG 3.66Å; F2241-M2253 HydrophobicContact CD1-SD 4.12Å; F2241-M2253 HydrophobicContact CD2-CE 4.09Å; F2241-M2253 HydrophobicContact CD2-CG 3.82Å; F2241-M2253 HydrophobicContact CD2-SD 3.8Å; F2241-M2253 VanDerWaalsContact CD2-SD 3.59Å; F2241-M2253 HydrophobicContact CE1-CE 3.77Å; F2241-M2253 HydrophobicContact CE1-CG 3.65Å; F2241-M2253 HydrophobicContact CE1-SD 4.47Å; F2241-M2253 HydrophobicContact CE2-CB 4.47Å; F2241-M2253 HydrophobicContact CE2-CE 4.05Å; F2241-M2253 HydrophobicContact CE2-CG 3.8Å; F2241-M2253 HydrophobicContact CE2-SD 4.3Å; F2241-M2253 HydrophobicContact CG-CE 3.72Å; F2241-M2253 HydrophobicContact CG-CG 3.73Å; F2241-M2253 HydrophobicContact CG-SD 3.63Å; F2241-M2253 VanDerWaalsContact CG-SD 3.56Å; F2241-M2253 HydrophobicContact CZ-CB 4.42Å; F2241-M2253 HydrophobicContact CZ-CE 4.07Å; F2241-M2253 HydrophobicContact CZ-CG 3.69Å
2242	V	78.6	Confident	82	Confident	9.5 Å²	9.5	41.4 Å²	41.4	6%	0.058	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	119.4	173.1	172.3	0	0	0	0	109.6	Y2169 T2170 L2171 M2191 W2197 V2246 L2263 V2268	Y2169-V2242 CarbonylContact C-O 3.52Å; Y2169-V2242 WeakPolarHBondContact CA-O 3.34Å; Y2169-V2242 VanDerWaalsContact CB-O 3.25Å; Y2169-V2242 WeakPolarHBondContact CB-O 3.33Å; Y2169-V2242 PolarHBondContact N-O 2.82Å; Y2169-V2242 PolarHBondContact O-N 2.85Å; T2170-V2242 PolarHBondContact N-O 3.22Å; T2170-V2242 VanDerWaalsContact N-O 3.09Å; T2170-V2242 PolarHBondContact O-N 3.01Å; L2171-V2242 HydrophobicContact CB-CG2 3.9Å; L2171-V2242 HydrophobicContact CD2-CG2 3.9Å; L2171-V2242 HydrophobicContact CG-CG2 4.41Å; M2191-V2242 HydrophobicContact CE-CG1 4.23Å; W2197-V2242 HydrophobicContact CE3-CG2 4.07Å; W2197-V2242 HydrophobicContact CZ3-CG2 3.76Å; V2242-V2246 WeakPolarHBondContact CA-O 3.34Å; V2242-L2263 HydrophobicContact CB-CD1 4.25Å; V2242-L2263 HydrophobicContact CG1-CD1 3.56Å; V2242-L2263 VanDerWaalsContact CG1-CD1 3.49Å; V2242-L2263 HydrophobicContact CG2-CD1 3.94Å; V2242-V2268 HydrophobicContact CB-CG2 3.98Å; V2242-V2268 HydrophobicContact CG1-CG2 3.82Å; V2242-V2268 HydrophobicContact CG2-CG2 3.86Å
2243	K	72.4	Confident	81.4	Confident	96.25 Å²	96.25	39.6 Å²	39.6	42%	0.418	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	121.2	179.4	-174.7	170.8	179.3	178.7	0	111.4	Y2140 Y2169 F2241 G2245 V2246	Y2140-K2243 PolarHBondContact O-NZ 3Å; Y2169-K2243 HydrophobicContact CG-CD 4.46Å; F2241-K2243 HydrophobicContact CD1-CB 4.23Å; F2241-K2243 HydrophobicContact CE1-CB 3.61Å; F2241-K2243 HydrophobicContact CE1-CD 3.79Å; F2241-K2243 HydrophobicContact CE1-CG 4.37Å; F2241-K2243 HydrophobicContact CE2-CB 4.47Å; F2241-K2243 HydrophobicContact CE2-CD 4.24Å; F2241-K2243 HydrophobicContact CZ-CB 3.81Å; F2241-K2243 HydrophobicContact CZ-CD 3.33Å; F2241-K2243 VanDerWaalsContact CZ-CD 3.41Å; F2241-K2243 HydrophobicContact CZ-CG 4.24Å; K2243-G2245 VanDerWaalsContact C-N 3.28Å; K2243-G2245 PolarHBondContact O-N 2.89Å; K2243-G2245 VanDerWaalsContact O-N 3.16Å; K2243-V2246 PolarHBondContact N-O 2.87Å; K2243-V2246 WeakPolarHBondContact O-CB 3.3Å; K2243-V2246 PolarHBondContact O-N 2.97Å
2244	A	67.5	Low	81.1	Confident	54.75 Å²	54.75	45.8 Å²	45.8	45%	0.452	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	57	23.3	171.4	0	0	0	0	0	116.6	R2167 P2168	R2167-A2244 HydrophobicContact CB-CB 4.23Å; P2168-A2244 PolarHBondContact O-N 2.87Å
2245	G	70.7	Confident	80.7	Confident	22.25 Å²	22.25	45.5 Å²	45.5	23%	0.229	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.9	12.2	-174.8	0	0	0	0	0	114.4	K2243 L2263	K2243-G2245 VanDerWaalsContact C-N 3.28Å; K2243-G2245 PolarHBondContact O-N 2.89Å; K2243-G2245 VanDerWaalsContact O-N 3.16Å; G2245-L2263 WeakPolarHBondContact O-CB 3.39Å; G2245-L2263 PolarHBondContact O-N 2.95Å
2246	V	80.6	Confident	80.5	Confident	49.25 Å²	49.25	41.8 Å²	41.8	30%	0.298	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	136	172.8	178.4	0	0	0	0	109.2	V2242 K2243 K2260 Y2261 L2263	V2242-V2246 WeakPolarHBondContact CA-O 3.34Å; K2243-V2246 PolarHBondContact N-O 2.87Å; K2243-V2246 WeakPolarHBondContact O-CB 3.3Å; K2243-V2246 PolarHBondContact O-N 2.97Å; V2246-K2260 HydrophobicContact CG1-CB 3.64Å; V2246-K2260 VanDerWaalsContact CG1-CB 3.45Å; V2246-K2260 HydrophobicContact CG1-CD 4.46Å; V2246-K2260 HydrophobicContact CG1-CG 3.95Å; V2246-Y2261 CarbonylContact C-O 3.5Å; V2246-Y2261 VanDerWaalsContact CA-O 3.31Å; V2246-Y2261 WeakPolarHBondContact CA-O 3.45Å; V2246-Y2261 WeakPolarHBondContact CG1-O 3.43Å; V2246-L2263 VanDerWaalsContact C-CD1 3.44Å; V2246-L2263 WeakPolarHBondContact O-CD1 3.31Å
2247	G	86	Confident	80.5	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	146.5	175.3	0	0	0	0	0	111.5	W2197 F2241 Y2261	W2197-G2247 VanDerWaalsContact CH2-CA 3.48Å; F2241-G2247 CarbonylContact O-C 3.54Å; F2241-G2247 VanDerWaalsContact O-CA 3.29Å; F2241-G2247 WeakPolarHBondContact O-CA 3.38Å; G2247-Y2261 PolarHBondContact N-O 3.06Å; G2247-Y2261 PolarHBondContact O-N 3.09Å
2248	Q	88.2	Confident	80.3	Confident	17.75 Å²	17.75	38.8 Å²	38.8	8%	0.083	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	147.4	170	-147.2	168.7	0.6	0	0	109.8	W2197 F2241 A2256 T2258 K2260	W2197-Q2248 VanDerWaalsContact CH2-N 3.33Å; F2241-Q2248 HydrophobicContact CD1-CB 4.49Å; F2241-Q2248 PolarHBondContact N-O 3.12Å; F2241-Q2248 PolarHBondContact O-N 3.16Å; Q2248-A2256 HydrophobicContact CG-CB 3.76Å; Q2248-A2256 VanDerWaalsContact NE2-CB 3.25Å; Q2248-T2258 VanDerWaalsContact CG-O 3.3Å; Q2248-T2258 WeakPolarHBondContact CG-O 3.33Å; Q2248-T2258 PolarHBondContact NE2-O 2.91Å; Q2248-K2260 HydrophobicContact CG-CG 3.9Å; Q2248-K2260 VanDerWaalsContact OE1-CE 3.29Å; Q2248-K2260 VanDerWaalsContact OE1-CG 3.25Å
2249	V	89.3	Confident	80	Confident	0.75 Å²	0.75	43.6 Å²	43.6	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	137.1	178.9	177.7	0	0	0	0	110.2	I2187 W2197 I2199 W2208 L2238 L2239 I2240 A2256 Y2257 T2258	I2187-V2249 HydrophobicContact CD1-CG1 4.29Å; W2197-V2249 HydrophobicContact CH2-CG2 3.73Å; W2197-V2249 VanDerWaalsContact CH2-CG2 3.49Å; W2197-V2249 HydrophobicContact CZ2-CG2 4Å; W2197-V2249 HydrophobicContact CZ3-CG2 4.47Å; I2199-V2249 HydrophobicContact CD1-CB 4.26Å; I2199-V2249 HydrophobicContact CD1-CG2 3.71Å; I2199-V2249 VanDerWaalsContact CD1-CG2 3.49Å; I2199-V2249 HydrophobicContact CG1-CG2 4.1Å; W2208-V2249 HydrophobicContact CE3-CG1 4.02Å; W2208-V2249 HydrophobicContact CH2-CG1 4.43Å; W2208-V2249 HydrophobicContact CZ3-CG1 3.98Å; L2238-V2249 HydrophobicContact CD1-CG1 3.49Å; L2238-V2249 HydrophobicContact CD2-CG1 4.24Å; L2238-V2249 HydrophobicContact CG-CG1 3.93Å; L2239-V2249 VanDerWaalsContact O-CA 3.32Å; L2239-V2249 WeakPolarHBondContact O-CA 3.25Å; I2240-V2249 HydrophobicContact CB-CG2 4.23Å; I2240-V2249 HydrophobicContact CG1-CG1 4.3Å; I2240-V2249 HydrophobicContact CG1-CG2 4.18Å; I2240-V2249 HydrophobicContact CG2-CG2 4.18Å; V2249-A2256 CarbonylContact O-C 3.56Å; V2249-A2256 WeakPolarHBondContact O-CB 3.38Å; V2249-Y2257 HydrophobicContact CG1-CD2 4.33Å; V2249-Y2257 PolarHBondContact O-N 2.97Å; V2249-T2258 HydrophobicContact CB-CG2 4.16Å; V2249-T2258 HydrophobicContact CG2-CG2 4.49Å; V2249-T2258 PolarHBondContact N-OG1 2.91Å; V2249-T2258 VanDerWaalsContact N-OG1 3.09Å; V2249-T2258 PolarHBondContact O-N 2.81Å; V2249-T2258 VanDerWaalsContact O-N 3.11Å
2250	G	87.9	Confident	79.9	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.01	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.7	175.8	-174.3	0	0	0	0	0	114.5	L2238 L2239 D2252 Y2257	L2238-G2250 CarbonylContact C-O 3.56Å; L2238-G2250 WeakPolarHBondContact CA-O 3.34Å; L2239-G2250 WeakPolarHBondContact CA-O 3.24Å; L2239-G2250 WeakPolarHBondContact CB-O 3.5Å; L2239-G2250 PolarHBondContact N-O 3Å; L2239-G2250 PolarHBondContact O-N 2.96Å; L2239-G2250 VanDerWaalsContact O-N 3.07Å; G2250-D2252 VanDerWaalsContact C-N 3.31Å; G2250-Y2257 VanDerWaalsContact C-CE2 3.45Å; G2250-Y2257 VanDerWaalsContact CA-CD2 3.44Å
2251	P	81.6	Confident	79.8	Confident	27 Å²	27	48.9 Å²	48.9	18%	0.175	25%	0.254	C	S	.	.	S	Bend	trans	-74.4	-27.4	163.6	32.6	-31.8	0	0	0	111.5	P2237 L2239 K2255 Y2257	P2237-P2251 HydrophobicContact CG-CB 3.91Å; L2239-P2251 WeakPolarHBondContact CD1-O 3.33Å; P2251-K2255 WeakPolarHBondContact CD-O 3.47Å; P2251-K2255 HydrophobicContact CG-CB 4.16Å; P2251-Y2257 HydrophobicContact CG-CE1 4.31Å
2252	D	78.5	Confident	79.7	Confident	49.5 Å²	49.5	50.2 Å²	50.2	27%	0.265	27%	0.271	S	S	.	.	S	Bend	trans	-152.2	-177.6	174	66.2	56.5	0	0	0	109.8	F2241 G2250 E2254 K2255	F2241-D2252 VanDerWaalsContact CE2-C 3.48Å; G2250-D2252 VanDerWaalsContact C-N 3.31Å; D2252-E2254 VanDerWaalsContact C-N 3.34Å; D2252-E2254 WeakPolarHBondContact OD1-CA 3.43Å; D2252-E2254 WeakPolarHBondContact OD1-CB 3.32Å; D2252-E2254 PolarHBondContact OD1-N 3.03Å; D2252-K2255 WeakPolarHBondContact OD1-CB 3.44Å; D2252-K2255 PolarHBondContact OD1-N 2.99Å; D2252-K2255 WeakPolarHBondContact OD2-CD 3.17Å; D2252-K2255 IonicContact OD2-NZ 2.79Å; D2252-K2255 PolarHBondContact OD2-NZ 2.78Å
2253	M	68.1	Low	80	Confident	77 Å²	77	50.8 Å²	50.8	38%	0.379	27%	0.274	S	S	.	.	S	Bend	trans	-82.3	-8.8	-177.2	-77.4	-65.5	-47.1	0	0	115.1	P2168 L2239 F2241	P2168-M2253 HydrophobicContact CB-CE 3.96Å; P2168-M2253 HydrophobicContact CB-CG 4.03Å; P2168-M2253 HydrophobicContact CB-SD 3.46Å; P2168-M2253 WeakPolarHBondContact CB-SD 3.39Å; P2168-M2253 HydrophobicContact CG-CE 3.9Å; P2168-M2253 HydrophobicContact CG-CG 3.52Å; P2168-M2253 HydrophobicContact CG-SD 3.6Å; L2239-M2253 HydrophobicContact CD2-CG 3.88Å; L2239-M2253 HydrophobicContact CD2-SD 4.17Å; F2241-M2253 HydrophobicContact CB-CE 4.17Å; F2241-M2253 HydrophobicContact CB-SD 3.7Å; F2241-M2253 VanDerWaalsContact CB-SD 3.57Å; F2241-M2253 HydrophobicContact CD1-CE 3.59Å; F2241-M2253 HydrophobicContact CD1-CG 3.66Å; F2241-M2253 HydrophobicContact CD1-SD 4.12Å; F2241-M2253 HydrophobicContact CD2-CE 4.09Å; F2241-M2253 HydrophobicContact CD2-CG 3.82Å; F2241-M2253 HydrophobicContact CD2-SD 3.8Å; F2241-M2253 VanDerWaalsContact CD2-SD 3.59Å; F2241-M2253 HydrophobicContact CE1-CE 3.77Å; F2241-M2253 HydrophobicContact CE1-CG 3.65Å; F2241-M2253 HydrophobicContact CE1-SD 4.47Å; F2241-M2253 HydrophobicContact CE2-CB 4.47Å; F2241-M2253 HydrophobicContact CE2-CE 4.05Å; F2241-M2253 HydrophobicContact CE2-CG 3.8Å; F2241-M2253 HydrophobicContact CE2-SD 4.3Å; F2241-M2253 HydrophobicContact CG-CE 3.72Å; F2241-M2253 HydrophobicContact CG-CG 3.73Å; F2241-M2253 HydrophobicContact CG-SD 3.63Å; F2241-M2253 VanDerWaalsContact CG-SD 3.56Å; F2241-M2253 HydrophobicContact CZ-CB 4.42Å; F2241-M2253 HydrophobicContact CZ-CE 4.07Å; F2241-M2253 HydrophobicContact CZ-CG 3.69Å
2254	E	70.5	Confident	80.2	Confident	182 Å²	182	48 Å²	48	85%	0.85	27%	0.265	S	S	*	.	S	Bend	trans	-104.9	-32.2	-177.8	-58.7	-173.5	163.9	0	0	111.5	D2252	D2252-E2254 VanDerWaalsContact C-N 3.34Å; D2252-E2254 WeakPolarHBondContact OD1-CA 3.43Å; D2252-E2254 WeakPolarHBondContact OD1-CB 3.32Å; D2252-E2254 PolarHBondContact OD1-N 3.03Å
2255	K	73.2	Confident	80.3	Confident	114.75 Å²	114.75	45.6 Å²	45.6	50%	0.499	25%	0.246	S	C	.	.	S	Bend	trans	-110.4	36.7	-175.2	-61.8	-179.4	-168.9	149.6	0	113.4	H2228 P2251 D2252 Y2257	H2228-K2255 PolarHBondContact CD2-O 2.79Å; H2228-K2255 WeakPolarHBondContact NE2-CB 3.45Å; P2251-K2255 WeakPolarHBondContact CD-O 3.47Å; P2251-K2255 HydrophobicContact CG-CB 4.16Å; D2252-K2255 WeakPolarHBondContact OD1-CB 3.44Å; D2252-K2255 PolarHBondContact OD1-N 2.99Å; D2252-K2255 WeakPolarHBondContact OD2-CD 3.17Å; D2252-K2255 IonicContact OD2-NZ 2.79Å; D2252-K2255 PolarHBondContact OD2-NZ 2.78Å; K2255-Y2257 PolarHBondContact O-N 2.88Å
2256	A	78.7	Confident	80	Confident	28.5 Å²	28.5	51.5 Å²	51.5	24%	0.236	26%	0.262	C	S	.	.			trans	-57.1	142.1	-172.2	0	0	0	0	0	113.8	Q2248 V2249 T2258	Q2248-A2256 HydrophobicContact CG-CB 3.76Å; Q2248-A2256 VanDerWaalsContact NE2-CB 3.25Å; V2249-A2256 CarbonylContact O-C 3.56Å; V2249-A2256 WeakPolarHBondContact O-CB 3.38Å; A2256-T2258 VanDerWaalsContact C-N 3.27Å; A2256-T2258 VanDerWaalsContact CB-O 3.26Å; A2256-T2258 WeakPolarHBondContact CB-O 3.4Å; A2256-T2258 PolarHBondContact O-N 2.94Å
2257	Y	84.4	Confident	79.1	Confident	15.25 Å²	15.25	51.8 Å²	51.8	6%	0.06	27%	0.266	C	S	.	.	S	Bend	trans	-70.5	-27.8	171.1	-54.4	-55	0	0	0	111.4	W2208 H2228 F2236 P2237 L2238 V2249 G2250 P2251 K2255	W2208-Y2257 HydrophobicContact CD2-CD2 4.42Å; W2208-Y2257 HydrophobicContact CD2-CG 4.23Å; W2208-Y2257 AromaticContact CE2-CG 3.8Å; W2208-Y2257 HydrophobicContact CE3-CD2 4.34Å; W2208-Y2257 HydrophobicContact CE3-CG 4.47Å; W2208-Y2257 AromaticContact CH2-CD2 3.54Å; W2208-Y2257 HydrophobicContact CH2-CD2 3.54Å; W2208-Y2257 VanDerWaalsContact CH2-CD2 3.48Å; W2208-Y2257 AromaticContact CH2-CE2 3.9Å; W2208-Y2257 HydrophobicContact CH2-CE2 3.96Å; W2208-Y2257 AromaticContact CH2-CG 3.95Å; W2208-Y2257 HydrophobicContact CH2-CG 4.09Å; W2208-Y2257 HydrophobicContact CZ2-CD1 4.21Å; W2208-Y2257 AromaticContact CZ2-CD2 3.6Å; W2208-Y2257 HydrophobicContact CZ2-CD2 3.6Å; W2208-Y2257 HydrophobicContact CZ2-CE1 4.45Å; W2208-Y2257 AromaticContact CZ2-CE2 3.88Å; W2208-Y2257 HydrophobicContact CZ2-CE2 4.02Å; W2208-Y2257 AromaticContact CZ2-CG 3.72Å; W2208-Y2257 HydrophobicContact CZ2-CG 3.72Å; W2208-Y2257 AromaticContact CZ3-CD2 3.94Å; W2208-Y2257 HydrophobicContact CZ3-CD2 3.99Å; W2208-Y2257 HydrophobicContact CZ3-CG 4.46Å; H2228-Y2257 HydrophobicContact CB-CD1 4.29Å; H2228-Y2257 HydrophobicContact CB-CE1 3.92Å; F2236-Y2257 HydrophobicContact CD2-CE2 4.48Å; P2237-Y2257 PolarHBondContact O-OH 2.84Å; L2238-Y2257 HydrophobicContact CD1-CD2 4.09Å; L2238-Y2257 HydrophobicContact CD1-CE2 4.03Å; V2249-Y2257 HydrophobicContact CG1-CD2 4.33Å; V2249-Y2257 PolarHBondContact O-N 2.97Å; G2250-Y2257 VanDerWaalsContact C-CE2 3.45Å; G2250-Y2257 VanDerWaalsContact CA-CD2 3.44Å; P2251-Y2257 HydrophobicContact CG-CE1 4.31Å; K2255-Y2257 PolarHBondContact O-N 2.88Å
2258	T	83	Confident	78.2	Confident	3.25 Å²	3.25	52.7 Å²	52.7	2%	0.02	27%	0.271	C	S	.	.	S	Bend	trans	-119.7	146.9	176.2	73.4	0	0	0	0	111.4	I2199 W2208 Y2224 Q2248 V2249 A2256	I2199-T2258 HydrophobicContact CG2-CG2 4.36Å; W2208-T2258 HydrophobicContact CB-CG2 3.96Å; W2208-T2258 HydrophobicContact CE3-CG2 4.36Å; W2208-T2258 HydrophobicContact CG-CG2 4.39Å; Y2224-T2258 VanDerWaalsContact CD2-CB 3.46Å; Y2224-T2258 HydrophobicContact CD2-CG2 3.88Å; Y2224-T2258 HydrophobicContact CE2-CG2 4.3Å; Q2248-T2258 VanDerWaalsContact CG-O 3.3Å; Q2248-T2258 WeakPolarHBondContact CG-O 3.33Å; Q2248-T2258 PolarHBondContact NE2-O 2.91Å; V2249-T2258 HydrophobicContact CB-CG2 4.16Å; V2249-T2258 HydrophobicContact CG2-CG2 4.49Å; V2249-T2258 PolarHBondContact N-OG1 2.91Å; V2249-T2258 VanDerWaalsContact N-OG1 3.09Å; V2249-T2258 PolarHBondContact O-N 2.81Å; V2249-T2258 VanDerWaalsContact O-N 3.11Å; A2256-T2258 VanDerWaalsContact C-N 3.27Å; A2256-T2258 VanDerWaalsContact CB-O 3.26Å; A2256-T2258 WeakPolarHBondContact CB-O 3.4Å; A2256-T2258 PolarHBondContact O-N 2.94Å
2259	D	82.7	Confident	76.9	Confident	101 Å²	101	56.2 Å²	56.2	54%	0.54	29%	0.286	S	S	.	.			trans	-73.6	176.5	164	-141.6	-20.7	0	0	0	110.8	Y2224 Y2261	Y2224-D2259 HydrophobicContact CD1-CB 3.77Å; Y2224-D2259 HydrophobicContact CE1-CB 3.41Å; Y2224-D2259 PolarHBondContact OH-O 2.81Å; D2259-Y2261 PolarHBondContact O-N 2.87Å
2260	K	84	Confident	75.6	Confident	129.75 Å²	129.75	56.9 Å²	56.9	56%	0.564	29%	0.294	S	S	*	.			trans	-67	99.7	-176.9	-75.3	170.6	-173.8	121.3	0	112.4	Y2015 V2246 Q2248	Y2015-K2260 WeakPolarHBondContact CE2-O 3.32Å; Y2015-K2260 WeakPolarHBondContact OH-CB 3.45Å; Y2015-K2260 PolarHBondContact OH-O 3.47Å; V2246-K2260 HydrophobicContact CG1-CB 3.64Å; V2246-K2260 VanDerWaalsContact CG1-CB 3.45Å; V2246-K2260 HydrophobicContact CG1-CD 4.46Å; V2246-K2260 HydrophobicContact CG1-CG 3.95Å; Q2248-K2260 HydrophobicContact CG-CG 3.9Å; Q2248-K2260 VanDerWaalsContact OE1-CE 3.29Å; Q2248-K2260 VanDerWaalsContact OE1-CG 3.25Å
2261	Y	86.3	Confident	74.9	Confident	15.25 Å²	15.25	57.4 Å²	57.4	6%	0.06	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	141	179.2	-171.3	-97.4	0	0	0	111.8	W2197 C2210 S2211 S2212 R2220 V2222 V2246 G2247 D2259 L2263	W2197-Y2261 AromaticContact CD1-CD1 3.61Å; W2197-Y2261 AromaticContact CD1-CE1 3.63Å; W2197-Y2261 HydrophobicContact CG-CD1 4.43Å; W2197-Y2261 HydrophobicContact CG-CE1 4.47Å; W2197-Y2261 AromaticContact NE1-CD1 3.33Å; W2197-Y2261 VanDerWaalsContact NE1-CD1 3.32Å; W2197-Y2261 AromaticContact NE1-CE1 3.8Å; W2197-Y2261 AromaticContact NE1-CG 3.87Å; C2210-Y2261 HydrophobicContact CB-CD1 4.14Å; C2210-Y2261 HydrophobicContact CB-CD2 3.34Å; C2210-Y2261 HydrophobicContact CB-CE1 4.39Å; C2210-Y2261 HydrophobicContact CB-CE2 3.63Å; C2210-Y2261 HydrophobicContact CB-CG 3.63Å; S2211-Y2261 VanDerWaalsContact C-OH 3.28Å; S2211-Y2261 WeakPolarHBondContact CA-OH 3.35Å; S2212-Y2261 WeakPolarHBondContact CB-OH 3.27Å; S2212-Y2261 PolarHBondContact N-OH 2.85Å; S2212-Y2261 VanDerWaalsContact N-OH 3.11Å; S2212-Y2261 VanDerWaalsContact OG-CE1 3.29Å; S2212-Y2261 WeakPolarHBondContact OG-CE1 3.4Å; S2212-Y2261 PolarHBondContact OG-OH 3.19Å; R2220-Y2261 PolarHBondContact O-OH 3.22Å; V2222-Y2261 HydrophobicContact CB-CD2 4.33Å; V2222-Y2261 HydrophobicContact CB-CE2 4.21Å; V2222-Y2261 HydrophobicContact CG2-CD2 4.35Å; V2222-Y2261 HydrophobicContact CG2-CE2 4Å; V2246-Y2261 CarbonylContact C-O 3.5Å; V2246-Y2261 VanDerWaalsContact CA-O 3.31Å; V2246-Y2261 WeakPolarHBondContact CA-O 3.45Å; V2246-Y2261 WeakPolarHBondContact CG1-O 3.43Å; G2247-Y2261 PolarHBondContact N-O 3.06Å; G2247-Y2261 PolarHBondContact O-N 3.09Å; D2259-Y2261 PolarHBondContact O-N 2.87Å; Y2261-L2263 HydrophobicContact CD1-CD2 4.23Å; Y2261-L2263 HydrophobicContact CE1-CD2 4.48Å
2262	A	82.5	Confident	74.3	Confident	59.25 Å²	59.25	58.1 Å²	58.1	49%	0.49	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	123.3	179.8	0	0	0	0	0	111.1	Y2015	Y2015-A2262 VanDerWaalsContact O-CB 3.32Å; Y2015-A2262 WeakPolarHBondContact O-CB 3.24Å
2263	L	83.8	Confident	74.3	Confident	22.5 Å²	22.5	56.3 Å²	56.3	12%	0.118	29%	0.287	C	S	.	.	P	Polyproline II helix	trans	-85.7	144.1	-173.4	-60.2	175.7	0	0	0	112.4	M2191 W2197 V2242 G2245 V2246 Y2261 G2265	M2191-L2263 HydrophobicContact CE-CB 4.32Å; M2191-L2263 HydrophobicContact CE-CD1 4.1Å; M2191-L2263 HydrophobicContact SD-CB 4.18Å; M2191-L2263 HydrophobicContact SD-CD1 4.5Å; M2191-L2263 HydrophobicContact SD-CD2 4.42Å; W2197-L2263 HydrophobicContact CB-CD2 3.91Å; W2197-L2263 HydrophobicContact CD2-CD2 3.33Å; W2197-L2263 VanDerWaalsContact CD2-CD2 3.5Å; W2197-L2263 HydrophobicContact CE3-CD1 4.4Å; W2197-L2263 HydrophobicContact CE3-CD2 3.35Å; W2197-L2263 VanDerWaalsContact CE3-CD2 3.42Å; W2197-L2263 HydrophobicContact CG-CD2 3.59Å; W2197-L2263 VanDerWaalsContact CG-CD2 3.45Å; W2197-L2263 HydrophobicContact CH2-CD2 4.38Å; W2197-L2263 HydrophobicContact CZ2-CD2 4.47Å; W2197-L2263 HydrophobicContact CZ3-CD2 4.03Å; V2242-L2263 HydrophobicContact CB-CD1 4.25Å; V2242-L2263 HydrophobicContact CG1-CD1 3.56Å; V2242-L2263 VanDerWaalsContact CG1-CD1 3.49Å; V2242-L2263 HydrophobicContact CG2-CD1 3.94Å; G2245-L2263 WeakPolarHBondContact O-CB 3.39Å; G2245-L2263 PolarHBondContact O-N 2.95Å; V2246-L2263 VanDerWaalsContact C-CD1 3.44Å; V2246-L2263 WeakPolarHBondContact O-CD1 3.31Å; Y2261-L2263 HydrophobicContact CD1-CD2 4.23Å; Y2261-L2263 HydrophobicContact CE1-CD2 4.48Å; L2263-G2265 VanDerWaalsContact C-N 3.31Å; L2263-G2265 WeakPolarHBondContact CB-O 3.37Å; L2263-G2265 PolarHBondContact O-N 3.37Å
2264	P	76	Confident	74.7	Confident	36.5 Å²	36.5	54.9 Å²	54.9	24%	0.237	28%	0.284	C	S	.	.	S	Bend	trans	-77.9	-16.4	178.8	33.8	-36.9	0	0	0	113.3	M2191 T2195 I2214	M2191-P2264 HydrophobicContact SD-CG 4.22Å; T2195-P2264 HydrophobicContact CG2-CB 4.13Å; T2195-P2264 PolarHBondContact OG1-O 2.76Å; T2195-P2264 VanDerWaalsContact OG1-O 3.13Å; I2214-P2264 HydrophobicContact CD1-CB 3.92Å; I2214-P2264 HydrophobicContact CG1-CB 3.93Å
2265	G	70.6	Confident	75.1	Confident	5.5 Å²	5.5	47.3 Å²	47.3	6%	0.057	25%	0.254	C	S	.	.			trans	-129.2	175.5	176.6	0	0	0	0	0	113.3	M2191 L2263	M2191-G2265 VanDerWaalsContact CE-C 3.46Å; M2191-G2265 VanDerWaalsContact CE-O 3.28Å; M2191-G2265 WeakPolarHBondContact CE-O 3.33Å; M2191-G2265 PolarHBondContact SD-N 3.49Å; L2263-G2265 VanDerWaalsContact C-N 3.31Å; L2263-G2265 WeakPolarHBondContact CB-O 3.37Å; L2263-G2265 PolarHBondContact O-N 3.37Å
2266	R	64.1	Low	75.6	Confident	146.75 Å²	146.75	44.2 Å²	44.2	55%	0.554	24%	0.243	S	C	*	.	S	Bend	trans	-112.4	-28.3	177.5	-59.6	176.7	176.5	179.8	-0.3	113.8	E2192	E2192-R2266 VanDerWaalsContact CD-N 3.31Å; E2192-R2266 WeakPolarHBondContact OE1-CB 3.37Å; E2192-R2266 PolarHBondContact OE1-N 2.97Å; E2192-R2266 WeakPolarHBondContact OE2-CA 3.47Å; E2192-R2266 VanDerWaalsContact OE2-CB 3.24Å; E2192-R2266 WeakPolarHBondContact OE2-CB 3.34Å; E2192-R2266 PolarHBondContact OE2-N 3.23Å
2267	S	61.9	Low	75.7	Confident	55.5 Å²	55.5	43.2 Å²	43.2	39%	0.388	23%	0.233	S	C	.	.	S	Bend	trans	-106.7	133.1	173.8	-148.6	0	0	0	0	110.4	M2191 E2192	M2191-S2267 CarbonylContact C-O 3.56Å; M2191-S2267 VanDerWaalsContact CA-O 3.27Å; M2191-S2267 WeakPolarHBondContact CA-O 3.23Å; M2191-S2267 VanDerWaalsContact CB-O 3.25Å; M2191-S2267 WeakPolarHBondContact CB-O 3.31Å; E2192-S2267 PolarHBondContact N-O 2.91Å; E2192-S2267 VanDerWaalsContact N-O 3.13Å; E2192-S2267 WeakPolarHBondContact OE2-CB 3.12Å; E2192-S2267 PolarHBondContact OE2-N 3.07Å; E2192-S2267 VanDerWaalsContact OE2-N 3.16Å; E2192-S2267 PolarHBondContact OE2-OG 3.3Å
2268	V	66.8	Low	75.2	Confident	17.5 Å²	17.5	44.5 Å²	44.5	11%	0.106	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-83.4	132.2	170	175.7	0	0	0	0	108.6	T2170 L2171 I2189 M2191 V2242 G2270 I2271	T2170-V2268 HydrophobicContact CG2-CB 4.41Å; T2170-V2268 HydrophobicContact CG2-CG1 4.5Å; T2170-V2268 HydrophobicContact CG2-CG2 4.36Å; T2170-V2268 WeakPolarHBondContact OG1-CB 3.12Å; T2170-V2268 VanDerWaalsContact OG1-CG2 3.29Å; T2170-V2268 WeakPolarHBondContact OG1-CG2 3.18Å; L2171-V2268 HydrophobicContact CD1-CB 4.29Å; L2171-V2268 HydrophobicContact CD1-CG1 4.48Å; L2171-V2268 HydrophobicContact CD1-CG2 3.98Å; L2171-V2268 HydrophobicContact CD2-CG2 3.94Å; I2189-V2268 HydrophobicContact CG2-CB 4.48Å; I2189-V2268 HydrophobicContact CG2-CG1 3.8Å; I2189-V2268 HydrophobicContact CG2-CG2 3.96Å; M2191-V2268 HydrophobicContact CE-CG2 4.08Å; M2191-V2268 HydrophobicContact CG-CG2 4.46Å; V2242-V2268 HydrophobicContact CB-CG2 3.98Å; V2242-V2268 HydrophobicContact CG1-CG2 3.82Å; V2242-V2268 HydrophobicContact CG2-CG2 3.86Å; V2268-G2270 VanDerWaalsContact CG1-O 3.25Å; V2268-G2270 WeakPolarHBondContact CG1-O 3.28Å; V2268-I2271 HydrophobicContact CG1-CD1 4.44Å; V2268-I2271 HydrophobicContact CG1-CG1 4.05Å
2269	K	61.4	Low	74.6	Confident	92.25 Å²	92.25	45.2 Å²	45.2	40%	0.401	25%	0.246	S	C	.	.			trans	-90.1	-30.8	171.2	-72.6	-173.3	178.9	-177.7	0	112.4	P2190 M2191 W2300 Y2600	P2190-K2269 HydrophobicContact CB-CB 4.32Å; P2190-K2269 HydrophobicContact CG-CB 4.33Å; P2190-K2269 WeakPolarHBondContact O-CB 3.26Å; P2190-K2269 PolarHBondContact O-N 3.18Å; M2191-K2269 VanDerWaalsContact O-CD 3.26Å; M2191-K2269 WeakPolarHBondContact O-CD 3.26Å; M2191-K2269 WeakPolarHBondContact O-CE 3.22Å; M2191-K2269 WeakPolarHBondContact O-CG 2.92Å; M2191-K2269 PolarHBondContact O-NZ 3.23Å; K2269-W2300 VanDerWaalsContact O-CE2 3.29Å; K2269-W2300 WeakPolarHBondContact O-CZ2 3.47Å; K2269-W2300 PolarHBondContact O-NE1 3.09Å; K2269-W2300 VanDerWaalsContact O-NE1 3.08Å; K2269-Y2600 HydrophobicContact CB-CE2 4.18Å; K2269-Y2600 HydrophobicContact CD-CE1 4.33Å; K2269-Y2600 WeakPolarHBondContact O-CE2 3.13Å
2270	G	62.1	Low	73.9	Confident	15.5 Å²	15.5	43.2 Å²	43.2	16%	0.16	23%	0.233	C	C	.	.			trans	-172.9	173.1	-178.1	0	0	0	0	0	112.3	I2189 P2190 V2268	I2189-G2270 WeakPolarHBondContact CA-O 3.49Å; P2190-G2270 VanDerWaalsContact CD-O 3.31Å; P2190-G2270 WeakPolarHBondContact CD-O 3.18Å; P2190-G2270 PolarHBondContact O-N 2.78Å; V2268-G2270 VanDerWaalsContact CG1-O 3.25Å; V2268-G2270 WeakPolarHBondContact CG1-O 3.28Å
2271	I	72.4	Confident	73.2	Confident	11.75 Å²	11.75	41.1 Å²	41.1	6%	0.06	22%	0.222	C	C	.	.			trans	-139.2	125	176.9	-58.3	176.4	0	0	0	107.1	T2170 L2171 A2172 I2187 R2188 I2189 I2240 V2268 I2273 L2282 A2284 W2300	T2170-I2271 HydrophobicContact CG2-CD1 3.85Å; L2171-I2271 HydrophobicContact CD1-CD1 4.47Å; L2171-I2271 HydrophobicContact CD2-CD1 4.17Å; L2171-I2271 HydrophobicContact CG-CD1 3.85Å; A2172-I2271 HydrophobicContact CB-CD1 3.38Å; I2187-I2271 HydrophobicContact CG2-CG2 4.41Å; R2188-I2271 CarbonylContact O-C 3.25Å; R2188-I2271 WeakPolarHBondContact O-CA 3.45Å; I2189-I2271 HydrophobicContact CG1-CG1 4.28Å; I2189-I2271 HydrophobicContact CG1-CG2 4.33Å; I2189-I2271 HydrophobicContact CG2-CG1 4.33Å; I2240-I2271 HydrophobicContact CD1-CD1 4.14Å; I2240-I2271 HydrophobicContact CD1-CG2 3.91Å; V2268-I2271 HydrophobicContact CG1-CD1 4.44Å; V2268-I2271 HydrophobicContact CG1-CG1 4.05Å; I2271-I2273 HydrophobicContact CG2-CG1 4.39Å; I2271-L2282 HydrophobicContact CB-CD2 4.38Å; I2271-L2282 HydrophobicContact CG2-CD1 4.47Å; I2271-L2282 HydrophobicContact CG2-CD2 4.25Å; I2271-A2284 HydrophobicContact CD1-CB 4.33Å; I2271-W2300 HydrophobicContact CB-CZ3 4.39Å; I2271-W2300 VanDerWaalsContact N-CH2 3.26Å; I2271-W2300 WeakPolarHBondContact O-CH2 3.37Å; I2271-W2300 WeakPolarHBondContact O-CZ3 3.44Å
2272	M	69.4	Low	72	Confident	40.75 Å²	40.75	41.1 Å²	41.1	20%	0.201	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	134	176.9	-60.5	173.7	-70.3	0	0	108.2	I2187 R2188 P2190 Y2600	I2187-M2272 CarbonylContact C-O 3.5Å; I2187-M2272 WeakPolarHBondContact CA-O 3.31Å; R2188-M2272 HydrophobicContact CB-CB 4.2Å; R2188-M2272 HydrophobicContact CB-CE 3.7Å; R2188-M2272 HydrophobicContact CG-CE 4.49Å; R2188-M2272 PolarHBondContact N-O 3.13Å; R2188-M2272 PolarHBondContact O-N 3.09Å; P2190-M2272 HydrophobicContact CG-CE 3.94Å; M2272-Y2600 HydrophobicContact CE-CD2 4.13Å; M2272-Y2600 HydrophobicContact SD-CD2 4.35Å
2273	I	77.5	Confident	70.9	Confident	11.25 Å²	11.25	40.5 Å²	40.5	6%	0.058	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	125.2	173.3	-56.4	177.7	0	0	0	106.9	A2174 L2176 I2185 Y2186 I2187 L2238 I2240 I2271 V2277 V2279 L2282 H2305	A2174-I2273 HydrophobicContact CB-CD1 4.15Å; L2176-I2273 HydrophobicContact CD1-CD1 4.5Å; L2176-I2273 HydrophobicContact CD1-CG2 4.2Å; L2176-I2273 HydrophobicContact CD2-CD1 4.29Å; L2176-I2273 HydrophobicContact CD2-CG2 4.17Å; I2185-I2273 HydrophobicContact CG2-CG2 4.25Å; Y2186-I2273 CarbonylContact O-C 3.58Å; Y2186-I2273 WeakPolarHBondContact O-CA 3.26Å; I2187-I2273 HydrophobicContact CG1-CG1 4.45Å; I2187-I2273 HydrophobicContact CG2-CG1 4.38Å; L2238-I2273 HydrophobicContact CD2-CD1 3.95Å; I2240-I2273 HydrophobicContact CD1-CD1 4.49Å; I2271-I2273 HydrophobicContact CG2-CG1 4.39Å; I2273-V2277 HydrophobicContact CG2-CG2 4Å; I2273-V2279 HydrophobicContact CB-CG2 4.27Å; I2273-V2279 HydrophobicContact CG2-CG2 4.21Å; I2273-L2282 HydrophobicContact CD1-CD1 4.18Å; I2273-L2282 HydrophobicContact CD1-CD2 4.15Å; I2273-L2282 HydrophobicContact CG1-CD2 4.19Å; I2273-H2305 WeakPolarHBondContact O-CB 3.16Å
2274	T	78.1	Confident	69.7	Low	48.75 Å²	48.75	40.6 Å²	40.6	30%	0.299	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	178.2	-174.7	59	0	0	0	0	110.7	Y2186 H2305	Y2186-T2274 PolarHBondContact N-O 3.17Å; Y2186-T2274 PolarHBondContact O-N 2.86Å; Y2186-T2274 PolarHBondContact O-OG1 3.04Å; T2274-H2305 HydrophobicContact CG2-CB 4.04Å
2275	G	78.5	Confident	68.6	Low	21.75 Å²	21.75	41.2 Å²	41.2	22%	0.224	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	98.9	-151.5	-173.8	0	0	0	0	0	112	R2179 H2184 V2277	R2179-G2275 PolarHBondContact NH1-O 2.73Å; R2179-G2275 VanDerWaalsContact NH1-O 3.13Å; H2184-G2275 CarbonylContact O-C 3.57Å; H2184-G2275 WeakPolarHBondContact O-CA 3.31Å; G2275-V2277 PolarHBondContact O-N 2.98Å; G2275-V2277 VanDerWaalsContact O-N 3.17Å
2276	D	83.4	Confident	67.7	Low	49 Å²	49	44 Å²	44	26%	0.262	24%	0.236	S	C	.	.	S	Bend	trans	-86.1	40.6	-168.5	-53.5	-50.1	0	0	0	113.3	R2179 R2183 H2184	R2179-D2276 VanDerWaalsContact CB-O 3.29Å; R2179-D2276 WeakPolarHBondContact CB-O 3.37Å; R2179-D2276 WeakPolarHBondContact CG-O 3.31Å; R2179-D2276 PolarHBondContact N-O 2.92Å; R2183-D2276 PolarHBondContact N-OD2 3.16Å; H2184-D2276 PolarHBondContact N-OD2 3.04Å; H2184-D2276 VanDerWaalsContact N-OD2 3.11Å; H2184-D2276 PolarHBondContact O-N 2.97Å
2277	V	80.7	Confident	66.7	Low	7.25 Å²	7.25	42.3 Å²	42.3	4%	0.044	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	149.1	-176.9	-68.4	0	0	0	0	113	T2177 L2178 R2179 I2185 I2273 G2275 V2279	T2177-V2277 CarbonylContact O-C 3.54Å; T2177-V2277 VanDerWaalsContact O-CA 3.28Å; T2177-V2277 WeakPolarHBondContact O-CA 3.32Å; L2178-V2277 HydrophobicContact CD1-CG1 4.13Å; R2179-V2277 PolarHBondContact NH1-O 2.98Å; R2179-V2277 PolarHBondContact NH2-O 2.78Å; I2185-V2277 HydrophobicContact CB-CG1 4.36Å; I2185-V2277 HydrophobicContact CD1-CG1 3.77Å; I2185-V2277 HydrophobicContact CG1-CG1 3.66Å; I2185-V2277 HydrophobicContact CG2-CG1 4.04Å; I2185-V2277 HydrophobicContact CG2-CG2 4.17Å; I2273-V2277 HydrophobicContact CG2-CG2 4Å; G2275-V2277 PolarHBondContact O-N 2.98Å; G2275-V2277 VanDerWaalsContact O-N 3.17Å; V2277-V2279 HydrophobicContact CG2-CG2 4.34Å
2278	D	73.1	Confident	65.5	Low	43 Å²	43	44.4 Å²	44.4	23%	0.23	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	131	161.6	-59.7	-52.8	0	0	0	109	L2176 T2177 R2179	L2176-D2278 CarbonylContact C-O 3.57Å; L2176-D2278 WeakPolarHBondContact CA-O 3.35Å; T2177-D2278 PolarHBondContact N-O 3.02Å; T2177-D2278 PolarHBondContact O-N 3.02Å; R2179-D2278 VanDerWaalsContact CG-OD2 3.23Å; R2179-D2278 WeakPolarHBondContact CG-OD2 3.35Å; R2179-D2278 IonicContact CZ-OD1 3.16Å; R2179-D2278 VanDerWaalsContact CZ-OD1 3.23Å; R2179-D2278 IonicContact CZ-OD2 2.73Å; R2179-D2278 IonicContact NE-OD1 3.48Å; R2179-D2278 PolarHBondContact NE-OD1 2.78Å; R2179-D2278 IonicContact NE-OD2 3.5Å; R2179-D2278 PolarHBondContact NE-OD2 2.81Å; R2179-D2278 IonicContact NH2-OD1 3.27Å; R2179-D2278 PolarHBondContact NH2-OD1 3.09Å; R2179-D2278 IonicContact NH2-OD2 2.63Å
2279	V	70.3	Confident	64.1	Low	18.25 Å²	18.25	50.8 Å²	50.8	11%	0.111	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	108.3	-178.4	-171.9	0	0	0	0	108.4	L2176 I2273 V2277 Y2281 L2282 I2304 T2306 I2309	L2176-V2279 HydrophobicContact CD2-CB 4.04Å; L2176-V2279 HydrophobicContact CD2-CG1 3.85Å; L2176-V2279 HydrophobicContact CD2-CG2 3.79Å; I2273-V2279 HydrophobicContact CB-CG2 4.27Å; I2273-V2279 HydrophobicContact CG2-CG2 4.21Å; V2277-V2279 HydrophobicContact CG2-CG2 4.34Å; V2279-Y2281 WeakPolarHBondContact CG1-O 3.37Å; V2279-L2282 HydrophobicContact CG1-CB 4.27Å; V2279-I2304 HydrophobicContact CB-CD1 4.33Å; V2279-I2304 HydrophobicContact CB-CG1 4.49Å; V2279-I2304 HydrophobicContact CB-CG2 4.24Å; V2279-I2304 HydrophobicContact CG1-CD1 4.23Å; V2279-I2304 HydrophobicContact CG1-CG1 4.39Å; V2279-I2304 HydrophobicContact CG1-CG2 3.77Å; V2279-I2304 HydrophobicContact CG2-CG2 4.42Å; V2279-T2306 HydrophobicContact CB-CG2 3.91Å; V2279-T2306 HydrophobicContact CG1-CG2 3.85Å; V2279-T2306 WeakPolarHBondContact O-CB 3.32Å; V2279-T2306 WeakPolarHBondContact O-CG2 3.28Å; V2279-I2309 VanDerWaalsContact O-CG1 3.3Å; V2279-I2309 WeakPolarHBondContact O-CG1 3.44Å
2280	H	70	Confident	62.7	Low	59 Å²	59	52.2 Å²	52.2	27%	0.273	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	-32.2	-178	-65.4	-82.5	0	0	0	112.7	E2175 T2177 K2235 I2309	E2175-H2280 HydrophobicContact CB-CB 4.18Å; E2175-H2280 HydrophobicContact CG-CB 4.25Å; E2175-H2280 WeakPolarHBondContact O-CA 3.29Å; E2175-H2280 WeakPolarHBondContact O-CB 3.38Å; E2175-H2280 PolarHBondContact O-N 3.1Å; E2175-H2280 WeakPolarHBondContact OE2-CB 3.29Å; E2175-H2280 IonicContact OE2-CD2 3.29Å; E2175-H2280 IonicContact OE2-CG 3.44Å; T2177-H2280 WeakPolarHBondContact CB-NE2 3.29Å; T2177-H2280 PolarHBondContact OG1-CD2 2.87Å; T2177-H2280 VanDerWaalsContact OG1-CD2 3.26Å; T2177-H2280 PolarHBondContact OG1-NE2 3.09Å; K2235-H2280 VanDerWaalsContact CE-CE1 3.4Å; K2235-H2280 WeakPolarHBondContact CE-CE1 3.34Å; K2235-H2280 WeakPolarHBondContact CE-ND1 3.48Å; K2235-H2280 PolarHBondContact NZ-CD2 3.37Å; K2235-H2280 PolarHBondContact NZ-CE1 2.99Å; K2235-H2280 VanDerWaalsContact NZ-CE1 3.28Å; K2235-H2280 PolarHBondContact NZ-ND1 2.99Å; H2280-I2309 WeakPolarHBondContact O-CD1 3.48Å; H2280-I2309 WeakPolarHBondContact O-CG1 3.27Å; H2280-I2309 WeakPolarHBondContact O-CG2 3.36Å
2281	Y	67.8	Low	61.3	Low	85.5 Å²	85.5	56.1 Å²	56.1	34%	0.335	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	162	161.1	70.8	-94.8	0	0	0	110.6	D2173 A2174 E2175 V2279	D2173-Y2281 HydrophobicContact CB-CE2 4.28Å; D2173-Y2281 VanDerWaalsContact CG-OH 3.24Å; D2173-Y2281 WeakPolarHBondContact O-CD2 3.4Å; D2173-Y2281 VanDerWaalsContact O-CE2 3.24Å; D2173-Y2281 WeakPolarHBondContact O-CE2 3.35Å; D2173-Y2281 PolarHBondContact OD1-OH 3.23Å; D2173-Y2281 VanDerWaalsContact OD2-CE2 3.29Å; D2173-Y2281 WeakPolarHBondContact OD2-CE2 3.26Å; D2173-Y2281 PolarHBondContact OD2-OH 3.24Å; A2174-Y2281 WeakPolarHBondContact CA-O 3.35Å; A2174-Y2281 VanDerWaalsContact CB-O 3.26Å; A2174-Y2281 WeakPolarHBondContact CB-O 3.28Å; E2175-Y2281 HydrophobicContact CB-CD1 3.65Å; E2175-Y2281 VanDerWaalsContact CB-CD1 3.48Å; E2175-Y2281 HydrophobicContact CB-CE1 3.39Å; E2175-Y2281 VanDerWaalsContact CB-CE1 3.4Å; E2175-Y2281 HydrophobicContact CB-CG 4.38Å; E2175-Y2281 HydrophobicContact CG-CE1 4.41Å; E2175-Y2281 PolarHBondContact N-O 3.07Å; E2175-Y2281 VanDerWaalsContact N-O 3.1Å; E2175-Y2281 PolarHBondContact O-N 3.31Å; V2279-Y2281 WeakPolarHBondContact CG1-O 3.37Å
2282	L	62.3	Low	59.3	Low	15.25 Å²	15.25	63.1 Å²	63.1	8%	0.08	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	109.7	166.4	171.8	62.2	0	0	0	108.8	A2172 D2173 A2174 I2271 I2273 V2279 P2302 I2304 T2306	A2172-L2282 HydrophobicContact CB-CD1 4.1Å; D2173-L2282 CarbonylContact O-C 3.52Å; D2173-L2282 WeakPolarHBondContact O-CA 3.42Å; A2174-L2282 HydrophobicContact CB-CB 4.22Å; A2174-L2282 HydrophobicContact CB-CD1 3.86Å; A2174-L2282 HydrophobicContact CB-CG 4.39Å; I2271-L2282 HydrophobicContact CB-CD2 4.38Å; I2271-L2282 HydrophobicContact CG2-CD1 4.47Å; I2271-L2282 HydrophobicContact CG2-CD2 4.25Å; I2273-L2282 HydrophobicContact CD1-CD1 4.18Å; I2273-L2282 HydrophobicContact CD1-CD2 4.15Å; I2273-L2282 HydrophobicContact CG1-CD2 4.19Å; V2279-L2282 HydrophobicContact CG1-CB 4.27Å; L2282-P2302 HydrophobicContact CB-CG 3.89Å; L2282-P2302 HydrophobicContact CD2-CB 3.69Å; L2282-P2302 HydrophobicContact CD2-CG 3.39Å; L2282-P2302 HydrophobicContact CG-CB 4.29Å; L2282-P2302 HydrophobicContact CG-CG 3.41Å; L2282-P2302 VanDerWaalsContact CG-CG 3.41Å; L2282-I2304 HydrophobicContact CB-CB 4.26Å; L2282-I2304 HydrophobicContact CB-CD1 4.09Å; L2282-I2304 HydrophobicContact CB-CG1 3.9Å; L2282-I2304 HydrophobicContact CB-CG2 3.57Å; L2282-I2304 HydrophobicContact CD2-CB 4.41Å; L2282-I2304 HydrophobicContact CD2-CG1 4.32Å; L2282-I2304 HydrophobicContact CD2-CG2 4.16Å; L2282-I2304 HydrophobicContact CG-CG1 4.42Å; L2282-I2304 HydrophobicContact CG-CG2 4.48Å; L2282-I2304 VanDerWaalsContact O-CD1 3.24Å; L2282-I2304 WeakPolarHBondContact O-CD1 3.4Å; L2282-T2306 HydrophobicContact CB-CG2 4.16Å
2283	S	58.4	Low	57.3	Low	46.5 Å²	46.5	66.8 Å²	66.8	33%	0.325	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	115.8	176.5	178.1	0	0	0	0	109.2	A2172 D2173	A2172-S2283 CarbonylContact C-O 3.52Å; A2172-S2283 VanDerWaalsContact CA-O 3.29Å; A2172-S2283 WeakPolarHBondContact CA-O 3.28Å; A2172-S2283 WeakPolarHBondContact CB-O 3.35Å; D2173-S2283 PolarHBondContact N-O 3.09Å; D2173-S2283 PolarHBondContact O-N 2.98Å; D2173-S2283 WeakPolarHBondContact OD1-CB 3.48Å; D2173-S2283 PolarHBondContact OD1-OG 2.82Å
2284	A	59	Low	54.9	Low	24.5 Å²	24.5	70.2 Å²	70.2	20%	0.202	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	113.3	175.1	0	0	0	0	0	110.1	A2172 I2271 N2286 W2300 P2302	A2172-A2284 HydrophobicContact CB-CB 3.91Å; I2271-A2284 HydrophobicContact CD1-CB 4.33Å; A2284-N2286 PolarHBondContact O-N 2.87Å; A2284-W2300 HydrophobicContact CB-CZ3 4.45Å; A2284-P2302 HydrophobicContact CB-CB 4.19Å
2285	V	53.6	Low	52.4	Low	50.5 Å²	50.5	72.5 Å²	72.5	31%	0.306	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	100.8	-178.8	-168.1	0	0	0	0	109.8	T2170 L2171 Y2287	T2170-V2285 HydrophobicContact CG2-CG2 4.41Å; T2170-V2285 WeakPolarHBondContact O-CB 3.32Å; T2170-V2285 WeakPolarHBondContact O-CG2 3.44Å; L2171-V2285 PolarHBondContact N-O 3.18Å; L2171-V2285 VanDerWaalsContact N-O 3.17Å; L2171-V2285 PolarHBondContact O-N 2.87Å; L2171-V2285 VanDerWaalsContact O-O 3.13Å; V2285-Y2287 HydrophobicContact CB-CD2 4.19Å; V2285-Y2287 HydrophobicContact CB-CE1 4.44Å; V2285-Y2287 HydrophobicContact CB-CE2 3.86Å; V2285-Y2287 HydrophobicContact CG1-CD1 3.96Å; V2285-Y2287 HydrophobicContact CG1-CD2 3.86Å; V2285-Y2287 HydrophobicContact CG1-CE1 3.71Å; V2285-Y2287 HydrophobicContact CG1-CE2 3.52Å; V2285-Y2287 HydrophobicContact CG1-CG 4.03Å; V2285-Y2287 VanDerWaalsContact CG1-CZ 3.48Å; V2285-Y2287 HydrophobicContact CG2-CE2 4.46Å; V2285-Y2287 WeakPolarHBondContact O-CD2 3.38Å; V2285-Y2287 PolarHBondContact O-N 3.37Å; V2285-Y2287 VanDerWaalsContact O-N 3.13Å
2286	N	50	Low	50	Low	63.25 Å²	63.25	76.5 Å²	76.5	34%	0.338	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	105.5	166.8	-127.4	-12.1	0	0	0	108.8	P2168 Y2169 T2170 A2284 P2288 W2300	P2168-N2286 VanDerWaalsContact CB-OD1 3.24Å; P2168-N2286 WeakPolarHBondContact CB-OD1 3.46Å; Y2169-N2286 PolarHBondContact O-OD1 3.39Å; T2170-N2286 WeakPolarHBondContact CB-OD1 3.37Å; T2170-N2286 HydrophobicContact CG2-CB 4.37Å; T2170-N2286 WeakPolarHBondContact CG2-OD1 3.23Å; T2170-N2286 PolarHBondContact OG1-OD1 2.81Å; A2284-N2286 PolarHBondContact O-N 2.87Å; N2286-P2288 WeakPolarHBondContact O-CD 3.34Å; N2286-P2288 WeakPolarHBondContact O-CG 3.33Å; N2286-P2288 VanDerWaalsContact O-N 3.14Å; N2286-W2300 HydrophobicContact CB-CZ3 4.3Å; N2286-W2300 VanDerWaalsContact ND2-CE3 3.33Å; N2286-W2300 WeakPolarHBondContact ND2-CH2 3.09Å
2287	Y	43.4	Very low	47.3	Very low	110.5 Å²	110.5	79.2 Å²	79.2	43%	0.433	43%	0.429	S	S	.	.			trans	-84	105.2	179.3	-74.4	-82.3	0	0	0	111.2	Y2169 L2171 V2285	Y2169-Y2287 AromaticContact CD1-CD2 3.88Å; Y2169-Y2287 HydrophobicContact CD1-CD2 4.14Å; Y2169-Y2287 HydrophobicContact CD1-CE2 4.01Å; Y2169-Y2287 HydrophobicContact CD1-CG 4.25Å; Y2169-Y2287 AromaticContact CD2-CD2 3.99Å; Y2169-Y2287 HydrophobicContact CD2-CD2 4.14Å; Y2169-Y2287 HydrophobicContact CD2-CE2 4.49Å; Y2169-Y2287 AromaticContact CE1-CD2 3.66Å; Y2169-Y2287 HydrophobicContact CE1-CD2 4.11Å; Y2169-Y2287 HydrophobicContact CE1-CE2 4.43Å; Y2169-Y2287 AromaticContact CE1-CG 3.95Å; Y2169-Y2287 HydrophobicContact CE1-CG 4.23Å; Y2169-Y2287 WeakPolarHBondContact CE1-O 3.22Å; Y2169-Y2287 AromaticContact CE2-CD2 3.47Å; Y2169-Y2287 HydrophobicContact CE2-CD2 3.47Å; Y2169-Y2287 AromaticContact CE2-CE2 3.55Å; Y2169-Y2287 HydrophobicContact CE2-CE2 3.92Å; Y2169-Y2287 AromaticContact CE2-CG 3.71Å; Y2169-Y2287 HydrophobicContact CE2-CG 3.96Å; Y2169-Y2287 AromaticContact CZ-CD2 3.53Å; Y2169-Y2287 AromaticContact CZ-CE2 3.53Å; Y2169-Y2287 AromaticContact CZ-CG 3.73Å; Y2169-Y2287 PolarHBondContact O-N 3.12Å; Y2169-Y2287 WeakPolarHBondContact OH-CB 3.47Å; Y2169-Y2287 VanDerWaalsContact OH-CD2 3.26Å; Y2169-Y2287 WeakPolarHBondContact OH-CD2 3.45Å; Y2169-Y2287 VanDerWaalsContact OH-CE2 3.32Å; Y2169-Y2287 WeakPolarHBondContact OH-CE2 3.43Å; L2171-Y2287 HydrophobicContact CB-CE2 4.29Å; L2171-Y2287 HydrophobicContact CD2-CE2 4.46Å; V2285-Y2287 HydrophobicContact CB-CD2 4.19Å; V2285-Y2287 HydrophobicContact CB-CE1 4.44Å; V2285-Y2287 HydrophobicContact CB-CE2 3.86Å; V2285-Y2287 HydrophobicContact CG1-CD1 3.96Å; V2285-Y2287 HydrophobicContact CG1-CD2 3.86Å; V2285-Y2287 HydrophobicContact CG1-CE1 3.71Å; V2285-Y2287 HydrophobicContact CG1-CE2 3.52Å; V2285-Y2287 HydrophobicContact CG1-CG 4.03Å; V2285-Y2287 VanDerWaalsContact CG1-CZ 3.48Å; V2285-Y2287 HydrophobicContact CG2-CE2 4.46Å; V2285-Y2287 WeakPolarHBondContact O-CD2 3.38Å; V2285-Y2287 PolarHBondContact O-N 3.37Å; V2285-Y2287 VanDerWaalsContact O-N 3.13Å
2288	P	36.8	Very low	44.7	Very low	101 Å²	101	83.7 Å²	83.7	66%	0.656	46%	0.459	S	S	*	.			trans	-70.2	163.9	170.9	20.3	-19.8	0	0	0	111	N2286 D2290	N2286-P2288 WeakPolarHBondContact O-CD 3.34Å; N2286-P2288 WeakPolarHBondContact O-CG 3.33Å; N2286-P2288 VanDerWaalsContact O-N 3.14Å; P2288-D2290 PolarHBondContact O-N 2.82Å
2289	R	37.5	Very low	42.5	Very low	151.25 Å²	151.25	85.8 Å²	85.8	57%	0.571	48%	0.477	S	S	*	.			trans	-118.3	103.7	-176.8	-172	-178.3	176.5	-152.2	0.1	111.4	E1879 Y2140 K2164 S2291 D2293	E1879-R2289 IonicContact OE1-CZ 2.67Å; E1879-R2289 IonicContact OE1-NE 2.59Å; E1879-R2289 PolarHBondContact OE1-NE 2.83Å; E1879-R2289 IonicContact OE1-NH2 2.74Å; E1879-R2289 PolarHBondContact OE1-NH2 2.7Å; E1879-R2289 IonicContact OE2-CZ 3.6Å; E1879-R2289 IonicContact OE2-NE 2.61Å; E1879-R2289 IonicContact OE2-NH2 3.82Å; Y2140-R2289 VanDerWaalsContact CE1-CD 3.42Å; Y2140-R2289 HydrophobicContact CE1-CG 3.95Å; Y2140-R2289 HydrophobicContact CE2-CB 4.03Å; Y2140-R2289 HydrophobicContact CE2-CG 4.08Å; K2164-R2289 PolarHBondContact NZ-O 3.19Å; R2289-S2291 VanDerWaalsContact C-N 3.3Å; R2289-S2291 PolarHBondContact O-N 3.01Å; R2289-S2291 VanDerWaalsContact O-N 3.12Å; R2289-D2293 IonicContact CZ-OD2 2.7Å; R2289-D2293 IonicContact NH1-OD2 3.18Å; R2289-D2293 PolarHBondContact NH1-OD2 3.49Å
2290	D	32.8	Very low	40.5	Very low	121.5 Å²	121.5	91.5 Å²	91.5	65%	0.65	50%	0.496	S	S	*	.			trans	34.9	127.5	176.2	-51.9	-33.9	0	0	0	116.2	E1879 Y2140 K2164 P2288 M2292 D2293	E1879-D2290 HydrophobicContact CG-CB 4.49Å; Y2140-D2290 WeakPolarHBondContact CE1-OD2 3.26Å; Y2140-D2290 WeakPolarHBondContact OH-CB 3.35Å; Y2140-D2290 PolarHBondContact OH-OD2 2.89Å; K2164-D2290 PolarHBondContact NZ-O 3.36Å; P2288-D2290 PolarHBondContact O-N 2.82Å; D2290-M2292 PolarHBondContact O-N 2.97Å; D2290-D2293 PolarHBondContact O-N 2.75Å
2291	S	32.8	Very low	38.4	Very low	96.75 Å²	96.75	96.3 Å²	96.3	68%	0.677	52%	0.516	S	S	*	.			trans	-145.1	122.8	160.3	61.6	0	0	0	0	114.5	R2289	R2289-S2291 VanDerWaalsContact C-N 3.3Å; R2289-S2291 PolarHBondContact O-N 3.01Å; R2289-S2291 VanDerWaalsContact O-N 3.12Å
2292	M	29	Very low	36.5	Very low	159.75 Å²	159.75	94.5 Å²	94.5	79%	0.787	52%	0.515	S	S	*	.			trans	149.5	89.5	170.1	-70.8	179.1	68	0	0	115.3	D2290 S2294	D2290-M2292 PolarHBondContact O-N 2.97Å; M2292-S2294 PolarHBondContact O-N 2.87Å
2293	D	29	Very low	34.9	Very low	117.25 Å²	117.25	97 Å²	97	63%	0.627	53%	0.531	S	S	*	.			trans	-128.1	59.7	162	-81.5	-6.4	0	0	0	113.1	R2289 D2290 V2295	R2289-D2293 IonicContact CZ-OD2 2.7Å; R2289-D2293 IonicContact NH1-OD2 3.18Å; R2289-D2293 PolarHBondContact NH1-OD2 3.49Å; D2290-D2293 PolarHBondContact O-N 2.75Å; D2293-V2295 PolarHBondContact O-N 3.31Å
2294	S	25.3	Very low	33.5	Very low	84 Å²	84	98.6 Å²	98.6	59%	0.587	54%	0.535	S	S	*	.			trans	-79.4	102.4	172.5	52.1	0	0	0	0	114.7	M2292 V2296	M2292-S2294 PolarHBondContact O-N 2.87Å; S2294-V2296 PolarHBondContact O-N 3.46Å
2295	V	26.5	Very low	32	Very low	96.75 Å²	96.75	101 Å²	101	59%	0.586	54%	0.542	S	S	*	.			trans	-113.9	102.2	157.1	-179.4	0	0	0	0	107.8	D2293 L2297 M2338	D2293-V2295 PolarHBondContact O-N 3.31Å; V2295-L2297 HydrophobicContact CG1-CD1 4.11Å; V2295-L2297 HydrophobicContact CG1-CD2 3.94Å; V2295-L2297 HydrophobicContact CG1-CG 4.31Å; V2295-L2297 PolarHBondContact O-N 3Å; V2295-L2297 VanDerWaalsContact O-N 3.15Å; V2295-M2338 HydrophobicContact CB-CE 4.21Å; V2295-M2338 HydrophobicContact CB-SD 4.15Å; V2295-M2338 HydrophobicContact CG1-CE 4.48Å; V2295-M2338 HydrophobicContact CG2-CE 4.4Å; V2295-M2338 HydrophobicContact CG2-CG 4.4Å; V2295-M2338 HydrophobicContact CG2-SD 4.02Å
2296	V	27.9	Very low	30.8	Very low	106.25 Å²	106.25	101.1 Å²	101.1	64%	0.644	54%	0.543	S	S	*	.			trans	-82.5	105.8	175.2	-179.1	0	0	0	0	108.6	S2294 E2648	S2294-V2296 PolarHBondContact O-N 3.46Å; V2296-E2648 WeakPolarHBondContact CG2-OE2 3Å
2297	L	27.2	Very low	29.8	Very low	104.25 Å²	104.25	104.1 Å²	104.1	55%	0.546	56%	0.555	S	S	.	*			trans	-89	141	165.3	-67	178.3	0	0	0	108.1	V2295 S2299 Y2333 I2334	V2295-L2297 HydrophobicContact CG1-CD1 4.11Å; V2295-L2297 HydrophobicContact CG1-CD2 3.94Å; V2295-L2297 HydrophobicContact CG1-CG 4.31Å; V2295-L2297 PolarHBondContact O-N 3Å; V2295-L2297 VanDerWaalsContact O-N 3.15Å; L2297-S2299 PolarHBondContact O-N 2.9Å; L2297-Y2333 HydrophobicContact CD2-CE1 3.77Å; L2297-I2334 HydrophobicContact CD1-CD1 4.45Å; L2297-I2334 HydrophobicContact CD1-CG1 4.43Å
2298	P	25.5	Very low	29.1	Very low	103.5 Å²	103.5	102.4 Å²	102.4	67%	0.672	55%	0.553	S	S	*	*			trans	-63.3	145.5	-163.3	24.2	-34.3	0	0	0	112.5	W2300	P2298-W2300 PolarHBondContact O-N 2.84Å
2299	S	27.1	Very low	28.9	Very low	86.75 Å²	86.75	98.8 Å²	98.8	61%	0.607	53%	0.528	S	S	*	.			trans	-62.6	112.4	-179.9	46.6	0	0	0	0	111.4	L2297 K2301	L2297-S2299 PolarHBondContact O-N 2.9Å; S2299-K2301 PolarHBondContact O-N 2.97Å; S2299-K2301 VanDerWaalsContact O-N 3.14Å
2300	W	28	Very low	28.5	Very low	137.75 Å²	137.75	95.8 Å²	95.8	52%	0.522	53%	0.527	S	S	.	.			trans	-87	118.6	-179.3	-121.6	65.6	0	0	0	109.7	K2269 I2271 A2284 N2286 P2298 P2302	K2269-W2300 VanDerWaalsContact O-CE2 3.29Å; K2269-W2300 WeakPolarHBondContact O-CZ2 3.47Å; K2269-W2300 PolarHBondContact O-NE1 3.09Å; K2269-W2300 VanDerWaalsContact O-NE1 3.08Å; I2271-W2300 HydrophobicContact CB-CZ3 4.39Å; I2271-W2300 VanDerWaalsContact N-CH2 3.26Å; I2271-W2300 WeakPolarHBondContact O-CH2 3.37Å; I2271-W2300 WeakPolarHBondContact O-CZ3 3.44Å; A2284-W2300 HydrophobicContact CB-CZ3 4.45Å; N2286-W2300 HydrophobicContact CB-CZ3 4.3Å; N2286-W2300 VanDerWaalsContact ND2-CE3 3.33Å; N2286-W2300 WeakPolarHBondContact ND2-CH2 3.09Å; P2298-W2300 PolarHBondContact O-N 2.84Å; W2300-P2302 HydrophobicContact CE3-CB 4.29Å; W2300-P2302 HydrophobicContact CE3-CG 4.39Å; W2300-P2302 HydrophobicContact CH2-CB 4.25Å; W2300-P2302 HydrophobicContact CZ3-CB 3.76Å; W2300-P2302 HydrophobicContact CZ3-CG 4.09Å; W2300-P2302 WeakPolarHBondContact O-CD 3.25Å
2301	K	26.9	Very low	28.6	Very low	159.75 Å²	159.75	93.4 Å²	93.4	70%	0.695	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-79.1	126.6	171.6	-72.9	-168.8	172.2	-167.2	0	109.5	S2299 T2303 T2311 E2312 S2494	S2299-K2301 PolarHBondContact O-N 2.97Å; S2299-K2301 VanDerWaalsContact O-N 3.14Å; K2301-T2303 PolarHBondContact O-N 2.9Å; K2301-T2311 PolarHBondContact NZ-O 2.84Å; K2301-E2312 WeakPolarHBondContact CE-O 3.16Å; K2301-E2312 PolarHBondContact NZ-O 3.46Å; K2301-S2494 PolarHBondContact NZ-O 3.36Å
2302	P	27.9	Very low	28.7	Very low	47.25 Å²	47.25	91.8 Å²	91.8	31%	0.307	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-69.1	133.6	169.3	11.3	-6.8	0	0	0	110.1	L2282 A2284 W2300 I2304	L2282-P2302 HydrophobicContact CB-CG 3.89Å; L2282-P2302 HydrophobicContact CD2-CB 3.69Å; L2282-P2302 HydrophobicContact CD2-CG 3.39Å; L2282-P2302 HydrophobicContact CG-CB 4.29Å; L2282-P2302 HydrophobicContact CG-CG 3.41Å; L2282-P2302 VanDerWaalsContact CG-CG 3.41Å; A2284-P2302 HydrophobicContact CB-CB 4.19Å; W2300-P2302 HydrophobicContact CE3-CB 4.29Å; W2300-P2302 HydrophobicContact CE3-CG 4.39Å; W2300-P2302 HydrophobicContact CH2-CB 4.25Å; W2300-P2302 HydrophobicContact CZ3-CB 3.76Å; W2300-P2302 HydrophobicContact CZ3-CG 4.09Å; W2300-P2302 WeakPolarHBondContact O-CD 3.25Å; P2302-I2304 HydrophobicContact CB-CG1 4.31Å; P2302-I2304 HydrophobicContact CG-CG1 4.5Å; P2302-I2304 PolarHBondContact O-N 3.31Å; P2302-I2304 VanDerWaalsContact O-N 3.1Å
2303	T	28.1	Very low	28.9	Very low	67.5 Å²	67.5	86.9 Å²	86.9	41%	0.414	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-81.1	104.2	170.1	-44.1	0	0	0	0	109	K2301 H2305 D2598 I2599	K2301-T2303 PolarHBondContact O-N 2.9Å; T2303-H2305 VanDerWaalsContact C-N 3.32Å; T2303-H2305 VanDerWaalsContact CG2-NE2 3.25Å; T2303-H2305 WeakPolarHBondContact CG2-NE2 3.41Å; T2303-H2305 PolarHBondContact O-N 2.83Å; T2303-H2305 VanDerWaalsContact O-N 3.13Å; T2303-D2598 WeakPolarHBondContact CG2-OD1 3.4Å; T2303-I2599 HydrophobicContact CG2-CB 4.11Å; T2303-I2599 HydrophobicContact CG2-CD1 4.18Å; T2303-I2599 HydrophobicContact CG2-CG1 4.25Å; T2303-I2599 WeakPolarHBondContact OG1-CB 3.21Å
2304	I	28.1	Very low	29.2	Very low	81 Å²	81	87.4 Å²	87.4	42%	0.415	47%	0.471	S	S	.	.	P	Polyproline II helix	trans	-78.3	110.9	176.3	-52.5	176.6	0	0	0	108.1	V2279 L2282 P2302 T2306	V2279-I2304 HydrophobicContact CB-CD1 4.33Å; V2279-I2304 HydrophobicContact CB-CG1 4.49Å; V2279-I2304 HydrophobicContact CB-CG2 4.24Å; V2279-I2304 HydrophobicContact CG1-CD1 4.23Å; V2279-I2304 HydrophobicContact CG1-CG1 4.39Å; V2279-I2304 HydrophobicContact CG1-CG2 3.77Å; V2279-I2304 HydrophobicContact CG2-CG2 4.42Å; L2282-I2304 HydrophobicContact CB-CB 4.26Å; L2282-I2304 HydrophobicContact CB-CD1 4.09Å; L2282-I2304 HydrophobicContact CB-CG1 3.9Å; L2282-I2304 HydrophobicContact CB-CG2 3.57Å; L2282-I2304 HydrophobicContact CD2-CB 4.41Å; L2282-I2304 HydrophobicContact CD2-CG1 4.32Å; L2282-I2304 HydrophobicContact CD2-CG2 4.16Å; L2282-I2304 HydrophobicContact CG-CG1 4.42Å; L2282-I2304 HydrophobicContact CG-CG2 4.48Å; L2282-I2304 VanDerWaalsContact O-CD1 3.24Å; L2282-I2304 WeakPolarHBondContact O-CD1 3.4Å; P2302-I2304 HydrophobicContact CB-CG1 4.31Å; P2302-I2304 HydrophobicContact CG-CG1 4.5Å; P2302-I2304 PolarHBondContact O-N 3.31Å; P2302-I2304 VanDerWaalsContact O-N 3.1Å; I2304-T2306 VanDerWaalsContact C-N 3.33Å; I2304-T2306 WeakPolarHBondContact CB-OG1 3.18Å; I2304-T2306 HydrophobicContact CG2-CG2 3.87Å; I2304-T2306 WeakPolarHBondContact CG2-OG1 3.31Å; I2304-T2306 PolarHBondContact O-N 3.14Å; I2304-T2306 VanDerWaalsContact O-N 3.07Å; I2304-T2306 PolarHBondContact O-OG1 2.95Å
2305	H	28.3	Very low	29.8	Very low	73.75 Å²	73.75	88.2 Å²	88.2	34%	0.341	47%	0.469	S	S	.	.			trans	-98.6	82.5	171.1	-79.3	-72.3	0	0	0	110.6	I2273 T2274 T2303 N2354 G2450 V2452 D2598	I2273-H2305 WeakPolarHBondContact O-CB 3.16Å; T2274-H2305 HydrophobicContact CG2-CB 4.04Å; T2303-H2305 VanDerWaalsContact C-N 3.32Å; T2303-H2305 VanDerWaalsContact CG2-NE2 3.25Å; T2303-H2305 WeakPolarHBondContact CG2-NE2 3.41Å; T2303-H2305 PolarHBondContact O-N 2.83Å; T2303-H2305 VanDerWaalsContact O-N 3.13Å; H2305-N2354 PolarHBondContact CE1-ND2 2.83Å; H2305-G2450 PolarHBondContact ND1-O 3.03Å; H2305-V2452 PolarHBondContact CE1-O 2.83Å; H2305-D2598 IonicContact CD2-OD1 2.77Å; H2305-D2598 IonicContact CE1-OD1 3.52Å; H2305-D2598 IonicContact CE1-OD2 3.6Å; H2305-D2598 PolarHBondContact CE1-OD2 2.71Å; H2305-D2598 IonicContact NE2-OD1 3.76Å; H2305-D2598 PolarHBondContact NE2-OD1 2.69Å; H2305-D2598 IonicContact NE2-OD2 2.73Å; H2305-D2598 PolarHBondContact NE2-OD2 3.03Å
2306	T	28.3	Very low	30.3	Very low	53 Å²	53	89 Å²	89	33%	0.325	47%	0.466	S	S	.	.			trans	-95.9	109.6	169.5	43.8	0	0	0	0	109.4	V2279 L2282 I2304 D2308 I2309 E2312	V2279-T2306 HydrophobicContact CB-CG2 3.91Å; V2279-T2306 HydrophobicContact CG1-CG2 3.85Å; V2279-T2306 WeakPolarHBondContact O-CB 3.32Å; V2279-T2306 WeakPolarHBondContact O-CG2 3.28Å; L2282-T2306 HydrophobicContact CB-CG2 4.16Å; I2304-T2306 VanDerWaalsContact C-N 3.33Å; I2304-T2306 WeakPolarHBondContact CB-OG1 3.18Å; I2304-T2306 HydrophobicContact CG2-CG2 3.87Å; I2304-T2306 WeakPolarHBondContact CG2-OG1 3.31Å; I2304-T2306 PolarHBondContact O-N 3.14Å; I2304-T2306 VanDerWaalsContact O-N 3.07Å; I2304-T2306 PolarHBondContact O-OG1 2.95Å; T2306-D2308 VanDerWaalsContact C-N 3.34Å; T2306-D2308 PolarHBondContact O-N 3.03Å; T2306-D2308 VanDerWaalsContact O-N 3.08Å; T2306-I2309 HydrophobicContact CG2-CD1 3.83Å; T2306-I2309 HydrophobicContact CG2-CG1 4.37Å; T2306-I2309 WeakPolarHBondContact OG1-CD1 3.29Å; T2306-E2312 PolarHBondContact OG1-OE2 3.47Å; T2306-E2312 VanDerWaalsContact OG1-OE2 3.08Å
2307	E	28.2	Very low	30.7	Very low	126 Å²	126	90.2 Å²	90.2	59%	0.589	46%	0.459	S	S	*	.	S	Bend	trans	-88.5	102	165.8	-78.2	169.1	168.2	0	0	109.7	I2309 K2718 L2721	E2307-I2309 VanDerWaalsContact C-N 3.35Å; E2307-I2309 PolarHBondContact O-N 2.96Å; E2307-I2309 VanDerWaalsContact O-N 3.16Å; E2307-K2718 IonicContact OE1-NZ 2.61Å; E2307-L2721 HydrophobicContact CG-CD1 4.4Å; E2307-L2721 WeakPolarHBondContact OE2-CA 3.39Å; E2307-L2721 WeakPolarHBondContact OE2-CG 3.41Å; E2307-L2721 PolarHBondContact OE2-N 3.31Å
2308	D	30.3	Very low	31.1	Very low	75.5 Å²	75.5	92.1 Å²	92.1	40%	0.404	47%	0.465	S	S	.	.			trans	53.8	84.7	169.7	-83.9	-31.7	0	0	0	117.4	R2179 T2306 V2310 T2311 E2312 R2407 R2674	R2179-D2308 IonicContact CZ-OD2 3.15Å; R2179-D2308 IonicContact NH1-OD2 2.99Å; R2179-D2308 PolarHBondContact NH1-OD2 2.84Å; R2179-D2308 IonicContact NH2-OD2 3.02Å; T2306-D2308 VanDerWaalsContact C-N 3.34Å; T2306-D2308 PolarHBondContact O-N 3.03Å; T2306-D2308 VanDerWaalsContact O-N 3.08Å; D2308-V2310 PolarHBondContact O-N 2.92Å; D2308-T2311 WeakPolarHBondContact CB-OG1 3.45Å; D2308-T2311 PolarHBondContact O-N 2.96Å; D2308-T2311 PolarHBondContact O-OG1 3.21Å; D2308-E2312 WeakPolarHBondContact O-CB 3.47Å; D2308-E2312 PolarHBondContact O-N 3.26Å; D2308-R2407 IonicContact OD1-CZ 3.39Å; D2308-R2407 IonicContact OD1-NH1 2.69Å; D2308-R2407 PolarHBondContact OD1-NH1 3.24Å; D2308-R2407 IonicContact OD1-NH2 2.75Å; D2308-R2407 PolarHBondContact OD1-NH2 3.07Å; D2308-R2407 IonicContact OD2-CZ 2.81Å; D2308-R2407 IonicContact OD2-NH1 3.03Å; D2308-R2407 IonicContact OD2-NH2 3.67Å; D2308-R2407 PolarHBondContact OD2-NH2 3.32Å; D2308-R2674 PolarHBondContact O-NH1 2.86Å; D2308-R2674 PolarHBondContact O-NH2 2.77Å; D2308-R2674 IonicContact OD1-CZ 3.54Å; D2308-R2674 VanDerWaalsContact OD1-CZ 3.22Å; D2308-R2674 IonicContact OD1-NE 3.54Å; D2308-R2674 IonicContact OD1-NH1 3.3Å; D2308-R2674 PolarHBondContact OD1-NH1 2.75Å; D2308-R2674 IonicContact OD1-NH2 3.98Å; D2308-R2674 IonicContact OD2-CZ 2.68Å; D2308-R2674 IonicContact OD2-NE 2.72Å; D2308-R2674 PolarHBondContact OD2-NE 2.84Å; D2308-R2674 IonicContact OD2-NH1 2.77Å; D2308-R2674 PolarHBondContact OD2-NH1 2.81Å; D2308-R2674 IonicContact OD2-NH2 2.64Å; D2308-R2674 PolarHBondContact OD2-NH2 2.92Å
2309	I	32.2	Very low	31.7	Very low	24.75 Å²	24.75	93.2 Å²	93.2	13%	0.127	46%	0.461	C	S	.	.	H	α-helix	trans	-94.6	63.8	167.1	-68.8	178.9	0	0	0	113.1	V2279 H2280 T2306 E2307 E2312 I2313 K2359 H2361 K2411 L2449 R2674 Q2677	V2279-I2309 VanDerWaalsContact O-CG1 3.3Å; V2279-I2309 WeakPolarHBondContact O-CG1 3.44Å; H2280-I2309 WeakPolarHBondContact O-CD1 3.48Å; H2280-I2309 WeakPolarHBondContact O-CG1 3.27Å; H2280-I2309 WeakPolarHBondContact O-CG2 3.36Å; T2306-I2309 HydrophobicContact CG2-CD1 3.83Å; T2306-I2309 HydrophobicContact CG2-CG1 4.37Å; T2306-I2309 WeakPolarHBondContact OG1-CD1 3.29Å; E2307-I2309 VanDerWaalsContact C-N 3.35Å; E2307-I2309 PolarHBondContact O-N 2.96Å; E2307-I2309 VanDerWaalsContact O-N 3.16Å; I2309-E2312 WeakPolarHBondContact CA-OE2 3.42Å; I2309-I2313 HydrophobicContact CG2-CD1 3.99Å; I2309-I2313 HydrophobicContact CG2-CG1 4.1Å; I2309-I2313 WeakPolarHBondContact O-CG1 3.45Å; I2309-I2313 PolarHBondContact O-N 3.15Å; I2309-I2313 VanDerWaalsContact O-N 3.15Å; I2309-K2359 HydrophobicContact CD1-CD 4.17Å; I2309-K2359 VanDerWaalsContact CD1-CE 3.43Å; I2309-K2359 HydrophobicContact CD1-CG 4.47Å; I2309-H2361 WeakPolarHBondContact CG2-NE2 3.49Å; I2309-K2411 PolarHBondContact O-NZ 2.79Å; I2309-L2449 HydrophobicContact CG2-CB 4.28Å; I2309-L2449 HydrophobicContact CG2-CD1 4.42Å; I2309-R2674 HydrophobicContact CG1-CB 4.3Å; I2309-R2674 HydrophobicContact CG1-CG 4.45Å; I2309-Q2677 HydrophobicContact CD1-CG 3.81Å; I2309-Q2677 HydrophobicContact CG2-CB 3.65Å; I2309-Q2677 HydrophobicContact CG2-CG 3.8Å; I2309-Q2677 VanDerWaalsContact CG2-OE1 3.27Å
2310	V	29.9	Very low	32	Very low	88.75 Å²	88.75	92.8 Å²	92.8	54%	0.538	46%	0.459	S	S	.	.	H	α-helix	trans	-94.2	-108.7	-177.8	-177.4	0	0	0	0	111.8	D2308 D2409 Q2677	D2308-V2310 PolarHBondContact O-N 2.92Å; V2310-D2409 HydrophobicContact CB-CB 4.41Å; V2310-D2409 HydrophobicContact CG1-CB 3.67Å; V2310-D2409 HydrophobicContact CG2-CB 3.81Å; V2310-D2409 VanDerWaalsContact CG2-OD2 3.24Å; V2310-D2409 WeakPolarHBondContact CG2-OD2 3.42Å; V2310-Q2677 PolarHBondContact O-N 2.92Å
2311	T	33.8	Very low	32.5	Very low	70.5 Å²	70.5	91 Å²	91	43%	0.433	46%	0.459	S	S	.	.	H	α-helix	trans	-94.6	-58	152.4	-3.2	0	0	0	0	114.4	K2301 D2308 I2313 K2314 D2315 K2676	K2301-T2311 PolarHBondContact NZ-O 2.84Å; D2308-T2311 WeakPolarHBondContact CB-OG1 3.45Å; D2308-T2311 PolarHBondContact O-N 2.96Å; D2308-T2311 PolarHBondContact O-OG1 3.21Å; T2311-I2313 VanDerWaalsContact C-N 3.34Å; T2311-I2313 PolarHBondContact O-N 2.84Å; T2311-I2313 VanDerWaalsContact O-N 3.15Å; T2311-K2314 CarbonylContact O-C 3.54Å; T2311-K2314 WeakPolarHBondContact O-CA 3.31Å; T2311-K2314 WeakPolarHBondContact O-CB 3.37Å; T2311-K2314 PolarHBondContact O-N 3.13Å; T2311-D2315 VanDerWaalsContact C-OD2 3.29Å; T2311-D2315 WeakPolarHBondContact CB-OD2 3.46Å; T2311-D2315 VanDerWaalsContact CG2-OD2 3.3Å; T2311-D2315 WeakPolarHBondContact CG2-OD2 3.31Å; T2311-D2315 WeakPolarHBondContact O-CB 3.45Å; T2311-D2315 PolarHBondContact O-N 2.92Å; T2311-K2676 HydrophobicContact CG2-CB 4.4Å; T2311-K2676 HydrophobicContact CG2-CD 3.9Å; T2311-K2676 HydrophobicContact CG2-CG 3.75Å; T2311-K2676 WeakPolarHBondContact OG1-CA 3.26Å; T2311-K2676 WeakPolarHBondContact OG1-CB 3.12Å; T2311-K2676 WeakPolarHBondContact OG1-CG 3.35Å
2312	E	34.5	Very low	33.2	Very low	63.5 Å²	63.5	89.4 Å²	89.4	30%	0.297	46%	0.458	S	S	.	.	H	α-helix	trans	1.9	-11.4	165.2	-142.4	179.8	172.6	0	0	117.2	K2301 T2306 D2308 I2309 K2314 D2315 H2316 K2352 E2453 E2678	K2301-E2312 WeakPolarHBondContact CE-O 3.16Å; K2301-E2312 PolarHBondContact NZ-O 3.46Å; T2306-E2312 PolarHBondContact OG1-OE2 3.47Å; T2306-E2312 VanDerWaalsContact OG1-OE2 3.08Å; D2308-E2312 WeakPolarHBondContact O-CB 3.47Å; D2308-E2312 PolarHBondContact O-N 3.26Å; I2309-E2312 WeakPolarHBondContact CA-OE2 3.42Å; E2312-K2314 PolarHBondContact O-N 2.98Å; E2312-D2315 PolarHBondContact O-N 2.75Å; E2312-H2316 WeakPolarHBondContact O-CB 3.24Å; E2312-H2316 PolarHBondContact O-N 2.71Å; E2312-K2352 IonicContact OE1-NZ 3.17Å; E2312-K2352 IonicContact OE2-NZ 3.45Å; E2312-K2352 PolarHBondContact OE2-NZ 2.9Å; E2312-E2453 WeakPolarHBondContact CA-OE2 3.32Å; E2312-E2453 WeakPolarHBondContact CB-OE2 3.36Å; E2312-E2453 VanDerWaalsContact CD-OE2 3.24Å; E2312-E2453 HydrophobicContact CG-CG 4.38Å; E2312-E2453 WeakPolarHBondContact CG-OE2 3.43Å; E2312-E2678 HydrophobicContact CG-CG 4.24Å
2313	I	33.7	Very low	33.7	Very low	56.25 Å²	56.25	93.1 Å²	93.1	29%	0.288	47%	0.467	S	S	.	.	H	α-helix	trans	-112.7	-120.8	-178	-81.8	177.7	0	0	0	110	I2309 T2311 W2317 I2374 F2394 L2449 E2453	I2309-I2313 HydrophobicContact CG2-CD1 3.99Å; I2309-I2313 HydrophobicContact CG2-CG1 4.1Å; I2309-I2313 WeakPolarHBondContact O-CG1 3.45Å; I2309-I2313 PolarHBondContact O-N 3.15Å; I2309-I2313 VanDerWaalsContact O-N 3.15Å; T2311-I2313 VanDerWaalsContact C-N 3.34Å; T2311-I2313 PolarHBondContact O-N 2.84Å; T2311-I2313 VanDerWaalsContact O-N 3.15Å; I2313-W2317 VanDerWaalsContact O-CD1 3.26Å; I2313-I2374 HydrophobicContact CD1-CD1 4.36Å; I2313-I2374 HydrophobicContact CG2-CD1 3.84Å; I2313-F2394 HydrophobicContact CG2-CE1 4.17Å; I2313-F2394 HydrophobicContact CG2-CZ 4.06Å; I2313-L2449 HydrophobicContact CG1-CD1 4.22Å; I2313-E2453 WeakPolarHBondContact O-CG 3.39Å
2314	K	35	Very low	34.3	Very low	127.75 Å²	127.75	94.9 Å²	94.9	56%	0.555	47%	0.469	S	S	*	.	H	α-helix	trans	-81.5	-125.4	-173.1	-140.2	176.5	171.4	-123.8	0	111.9	T2311 E2312 H2316 W2317 E2318 N2354 E2453	T2311-K2314 CarbonylContact O-C 3.54Å; T2311-K2314 WeakPolarHBondContact O-CA 3.31Å; T2311-K2314 WeakPolarHBondContact O-CB 3.37Å; T2311-K2314 PolarHBondContact O-N 3.13Å; E2312-K2314 PolarHBondContact O-N 2.98Å; K2314-H2316 VanDerWaalsContact C-N 3.29Å; K2314-H2316 PolarHBondContact O-N 3.22Å; K2314-W2317 PolarHBondContact O-N 2.79Å; K2314-E2318 WeakPolarHBondContact CE-OE2 3.32Å; K2314-E2318 IonicContact NZ-OE1 2.78Å; K2314-E2318 IonicContact NZ-OE2 3.6Å; K2314-E2318 PolarHBondContact NZ-OE2 2.59Å; K2314-E2318 PolarHBondContact O-N 2.73Å; K2314-N2354 WeakPolarHBondContact CE-OD1 3.48Å; K2314-E2453 HydrophobicContact CG-CG 4.4Å
2315	D	37	Very low	35.1	Very low	101 Å²	101	95.7 Å²	95.7	54%	0.54	47%	0.474	S	S	.	.	H	α-helix	trans	-84.4	15.8	153	-77.2	-31.8	0	0	0	115.1	T2311 E2312 W2317 E2318	T2311-D2315 VanDerWaalsContact C-OD2 3.29Å; T2311-D2315 WeakPolarHBondContact CB-OD2 3.46Å; T2311-D2315 VanDerWaalsContact CG2-OD2 3.3Å; T2311-D2315 WeakPolarHBondContact CG2-OD2 3.31Å; T2311-D2315 WeakPolarHBondContact O-CB 3.45Å; T2311-D2315 PolarHBondContact O-N 2.92Å; E2312-D2315 PolarHBondContact O-N 2.75Å; D2315-W2317 PolarHBondContact O-N 3.15Å; D2315-W2317 VanDerWaalsContact O-N 3.08Å; D2315-E2318 CarbonylContact O-C 3.46Å; D2315-E2318 PolarHBondContact O-N 2.82Å
2316	H	38.5	Very low	35.8	Very low	115.25 Å²	115.25	95.2 Å²	95.2	53%	0.534	48%	0.483	S	S	.	.			trans	9.3	45.2	162.3	-98.4	53.8	0	0	0	117.5	E2312 K2314	E2312-H2316 WeakPolarHBondContact O-CB 3.24Å; E2312-H2316 PolarHBondContact O-N 2.71Å; K2314-H2316 VanDerWaalsContact C-N 3.29Å; K2314-H2316 PolarHBondContact O-N 3.22Å
2317	W	36.4	Very low	36.4	Very low	130.75 Å²	130.75	94.6 Å²	94.6	50%	0.495	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	61.1	163.1	-67.3	84.1	0	0	0	110.7	I2313 K2314 D2315 V2363 E2365 K2370 V2389 E2484	I2313-W2317 VanDerWaalsContact O-CD1 3.26Å; K2314-W2317 PolarHBondContact O-N 2.79Å; D2315-W2317 PolarHBondContact O-N 3.15Å; D2315-W2317 VanDerWaalsContact O-N 3.08Å; W2317-V2363 HydrophobicContact CZ2-CG1 4.36Å; W2317-E2365 HydrophobicContact CH2-CB 4.42Å; W2317-E2365 HydrophobicContact CH2-CG 4.05Å; W2317-E2365 HydrophobicContact CZ2-CG 4.36Å; W2317-E2365 HydrophobicContact CZ3-CG 4.3Å; W2317-K2370 VanDerWaalsContact CE3-N 3.35Å; W2317-K2370 VanDerWaalsContact CZ3-N 3.25Å; W2317-V2389 HydrophobicContact CZ2-CB 4.12Å; W2317-V2389 HydrophobicContact CZ2-CG1 4.26Å; W2317-V2389 HydrophobicContact CZ2-CG2 4.06Å; W2317-E2484 HydrophobicContact CH2-CG 4.02Å
2318	E	35.5	Very low	37.4	Very low	144.25 Å²	144.25	91 Å²	91	67%	0.674	47%	0.47	S	S	*	.	S	Bend	trans	-122.4	114.2	169.1	-66.9	-172.5	158.2	0	0	112.4	K2314 D2315 S2320 Q2517	K2314-E2318 WeakPolarHBondContact CE-OE2 3.32Å; K2314-E2318 IonicContact NZ-OE1 2.78Å; K2314-E2318 IonicContact NZ-OE2 3.6Å; K2314-E2318 PolarHBondContact NZ-OE2 2.59Å; K2314-E2318 PolarHBondContact O-N 2.73Å; D2315-E2318 CarbonylContact O-C 3.46Å; D2315-E2318 PolarHBondContact O-N 2.82Å; E2318-S2320 PolarHBondContact O-N 2.86Å; E2318-Q2517 PolarHBondContact O-NE2 2.88Å
2319	E	37.5	Very low	38.5	Very low	125.75 Å²	125.75	94.7 Å²	94.7	59%	0.588	48%	0.482	S	S	*	.			trans	2.3	119.1	177.2	-65	-146.1	131.2	0	0	119.8	N2321 Y2323 K2324 K2369 K2514	E2319-N2321 PolarHBondContact OE1-ND2 3.09Å; E2319-Y2323 WeakPolarHBondContact OE2-CD1 3.35Å; E2319-K2324 WeakPolarHBondContact OE1-CE 3.47Å; E2319-K2324 IonicContact OE1-NZ 2.81Å; E2319-K2324 PolarHBondContact OE1-NZ 2.78Å; E2319-K2324 VanDerWaalsContact OE2-CE 3.25Å; E2319-K2324 WeakPolarHBondContact OE2-CE 3.27Å; E2319-K2324 IonicContact OE2-NZ 2.71Å; E2319-K2324 PolarHBondContact OE2-NZ 2.81Å; E2319-K2369 IonicContact OE1-NZ 2.72Å; E2319-K2369 PolarHBondContact OE1-NZ 2.69Å; E2319-K2514 WeakPolarHBondContact O-CD 3.31Å; E2319-K2514 PolarHBondContact O-NZ 3.33Å; E2319-K2514 IonicContact OE2-NZ 3.69Å; E2319-K2514 PolarHBondContact OE2-NZ 2.69Å
2320	S	34.2	Very low	39.3	Very low	79.5 Å²	79.5	99 Å²	99	56%	0.556	50%	0.497	S	S	*	.			trans	-102.8	138.3	148.3	178.6	0	0	0	0	111.3	E2318 D2322 Y2323	E2318-S2320 PolarHBondContact O-N 2.86Å; S2320-D2322 VanDerWaalsContact C-N 3.34Å; S2320-D2322 PolarHBondContact O-N 3.05Å; S2320-D2322 PolarHBondContact OG-N 3.07Å; S2320-Y2323 WeakPolarHBondContact O-CB 3.45Å; S2320-Y2323 PolarHBondContact O-N 2.77Å
2321	N	38.6	Very low	40.3	Very low	99 Å²	99	96.6 Å²	96.6	53%	0.529	48%	0.48	S	S	.	.	H	α-helix	trans	-77.4	-30.4	-173.7	-89.5	-33.3	0	0	0	114	E2319 Y2323 K2324 N2325	E2319-N2321 PolarHBondContact OE1-ND2 3.09Å; N2321-Y2323 VanDerWaalsContact C-N 3.31Å; N2321-Y2323 PolarHBondContact O-N 2.9Å; N2321-K2324 WeakPolarHBondContact O-CB 3.39Å; N2321-K2324 PolarHBondContact O-N 2.91Å; N2321-K2324 WeakPolarHBondContact OD1-CE 3.48Å; N2321-K2324 PolarHBondContact OD1-NZ 3.19Å; N2321-N2325 VanDerWaalsContact O-CB 3.24Å; N2321-N2325 WeakPolarHBondContact O-CB 3.48Å; N2321-N2325 PolarHBondContact O-N 2.79Å; N2321-N2325 PolarHBondContact O-ND2 2.79Å
2322	D	41	Very low	41.3	Very low	125.75 Å²	125.75	97.9 Å²	97.9	67%	0.672	48%	0.482	S	S	*	.	H	α-helix	trans	-66.1	-35.8	-174.1	-86.8	-41.1	0	0	0	113.6	S2320 K2324 N2325 A2326	S2320-D2322 VanDerWaalsContact C-N 3.34Å; S2320-D2322 PolarHBondContact O-N 3.05Å; S2320-D2322 PolarHBondContact OG-N 3.07Å; D2322-K2324 PolarHBondContact O-N 2.82Å; D2322-N2325 PolarHBondContact O-N 3.15Å; D2322-N2325 VanDerWaalsContact O-N 3.17Å; D2322-A2326 PolarHBondContact O-N 3.17Å
2323	Y	38.9	Very low	42.1	Very low	125.25 Å²	125.25	100.1 Å²	100.1	49%	0.491	49%	0.488	S	S	.	.	H	α-helix	trans	-61.3	-36.7	177.4	-165.3	-104.2	0	0	0	112	E2319 S2320 N2321 N2325 A2326 L2327 E2365 N2445	E2319-Y2323 WeakPolarHBondContact OE2-CD1 3.35Å; S2320-Y2323 WeakPolarHBondContact O-CB 3.45Å; S2320-Y2323 PolarHBondContact O-N 2.77Å; N2321-Y2323 VanDerWaalsContact C-N 3.31Å; N2321-Y2323 PolarHBondContact O-N 2.9Å; Y2323-N2325 VanDerWaalsContact C-N 3.32Å; Y2323-N2325 PolarHBondContact O-N 2.94Å; Y2323-A2326 PolarHBondContact O-N 3.1Å; Y2323-L2327 HydrophobicContact CD1-CB 4.38Å; Y2323-L2327 HydrophobicContact CD1-CD2 4.25Å; Y2323-L2327 HydrophobicContact CE1-CB 4.32Å; Y2323-L2327 HydrophobicContact CE1-CD1 4.29Å; Y2323-L2327 HydrophobicContact CE1-CD2 3.9Å; Y2323-L2327 HydrophobicContact CE1-CG 4.44Å; Y2323-L2327 VanDerWaalsContact O-CB 3.27Å; Y2323-L2327 WeakPolarHBondContact O-CB 3.29Å; Y2323-L2327 PolarHBondContact O-N 3.06Å; Y2323-L2327 VanDerWaalsContact O-N 3.16Å; Y2323-E2365 PolarHBondContact OH-OE2 2.89Å; Y2323-N2445 PolarHBondContact OH-ND2 2.96Å; Y2323-N2445 PolarHBondContact OH-OD1 2.85Å
2324	K	40.1	Very low	42.8	Very low	104.75 Å²	104.75	98.2 Å²	98.2	46%	0.455	48%	0.479	S	S	.	.	H	α-helix	trans	-61.5	-39.8	177.1	-68	173.6	-176.6	165.4	0	111.7	E2319 N2321 D2322 A2326 L2327 A2328	E2319-K2324 WeakPolarHBondContact OE1-CE 3.47Å; E2319-K2324 IonicContact OE1-NZ 2.81Å; E2319-K2324 PolarHBondContact OE1-NZ 2.78Å; E2319-K2324 VanDerWaalsContact OE2-CE 3.25Å; E2319-K2324 WeakPolarHBondContact OE2-CE 3.27Å; E2319-K2324 IonicContact OE2-NZ 2.71Å; E2319-K2324 PolarHBondContact OE2-NZ 2.81Å; N2321-K2324 WeakPolarHBondContact O-CB 3.39Å; N2321-K2324 PolarHBondContact O-N 2.91Å; N2321-K2324 WeakPolarHBondContact OD1-CE 3.48Å; N2321-K2324 PolarHBondContact OD1-NZ 3.19Å; D2322-K2324 PolarHBondContact O-N 2.82Å; K2324-A2326 VanDerWaalsContact C-N 3.35Å; K2324-A2326 PolarHBondContact O-N 2.82Å; K2324-L2327 PolarHBondContact O-N 3.08Å; K2324-A2328 WeakPolarHBondContact O-CA 3.29Å; K2324-A2328 VanDerWaalsContact O-CB 3.23Å; K2324-A2328 WeakPolarHBondContact O-CB 3.36Å; K2324-A2328 PolarHBondContact O-N 3.12Å
2325	N	45.1	Very low	43.7	Very low	98.25 Å²	98.25	95 Å²	95	53%	0.525	47%	0.47	S	S	.	.	H	α-helix	trans	-72.4	-38.1	-178.6	-72.8	-25.7	0	0	0	112.6	N2321 D2322 Y2323 L2327 A2328 K2329	N2321-N2325 VanDerWaalsContact O-CB 3.24Å; N2321-N2325 WeakPolarHBondContact O-CB 3.48Å; N2321-N2325 PolarHBondContact O-N 2.79Å; N2321-N2325 PolarHBondContact O-ND2 2.79Å; D2322-N2325 PolarHBondContact O-N 3.15Å; D2322-N2325 VanDerWaalsContact O-N 3.17Å; Y2323-N2325 VanDerWaalsContact C-N 3.32Å; Y2323-N2325 PolarHBondContact O-N 2.94Å; N2325-L2327 VanDerWaalsContact C-N 3.34Å; N2325-A2328 PolarHBondContact O-N 2.78Å; N2325-K2329 WeakPolarHBondContact O-CB 3.43Å; N2325-K2329 WeakPolarHBondContact O-CG 3.43Å; N2325-K2329 PolarHBondContact O-N 2.97Å
2326	A	43.1	Very low	44.4	Very low	64.25 Å²	64.25	95.8 Å²	95.8	53%	0.531	47%	0.47	S	S	.	.	H	α-helix	trans	-66.7	-43.7	174.3	0	0	0	0	0	111.7	D2322 Y2323 K2324 A2328 K2329 R2330	D2322-A2326 PolarHBondContact O-N 3.17Å; Y2323-A2326 PolarHBondContact O-N 3.1Å; K2324-A2326 VanDerWaalsContact C-N 3.35Å; K2324-A2326 PolarHBondContact O-N 2.82Å; A2326-A2328 PolarHBondContact O-N 2.87Å; A2326-K2329 PolarHBondContact O-N 3.47Å; A2326-R2330 WeakPolarHBondContact O-CB 3.46Å; A2326-R2330 PolarHBondContact O-N 3.13Å; A2326-R2330 VanDerWaalsContact O-N 3.1Å
2327	L	41.7	Very low	44.9	Very low	39 Å²	39	92.4 Å²	92.4	20%	0.204	46%	0.462	C	S	.	.	H	α-helix	trans	-66.4	-43	179	-170.1	69.4	0	0	0	112.1	Y2323 K2324 N2325 K2329 R2330 I2331 R2444 N2445	Y2323-L2327 HydrophobicContact CD1-CB 4.38Å; Y2323-L2327 HydrophobicContact CD1-CD2 4.25Å; Y2323-L2327 HydrophobicContact CE1-CB 4.32Å; Y2323-L2327 HydrophobicContact CE1-CD1 4.29Å; Y2323-L2327 HydrophobicContact CE1-CD2 3.9Å; Y2323-L2327 HydrophobicContact CE1-CG 4.44Å; Y2323-L2327 VanDerWaalsContact O-CB 3.27Å; Y2323-L2327 WeakPolarHBondContact O-CB 3.29Å; Y2323-L2327 PolarHBondContact O-N 3.06Å; Y2323-L2327 VanDerWaalsContact O-N 3.16Å; K2324-L2327 PolarHBondContact O-N 3.08Å; N2325-L2327 VanDerWaalsContact C-N 3.34Å; L2327-K2329 PolarHBondContact O-N 2.72Å; L2327-R2330 WeakPolarHBondContact O-CA 3.5Å; L2327-R2330 VanDerWaalsContact O-CB 3.27Å; L2327-R2330 WeakPolarHBondContact O-CB 3.31Å; L2327-R2330 PolarHBondContact O-N 3.13Å; L2327-I2331 HydrophobicContact CD1-CD1 4.34Å; L2327-I2331 HydrophobicContact CD1-CG1 4.35Å; L2327-I2331 HydrophobicContact CD2-CD1 4.45Å; L2327-I2331 HydrophobicContact CG-CD1 4.04Å; L2327-I2331 HydrophobicContact CG-CG1 4.47Å; L2327-I2331 WeakPolarHBondContact O-CB 3.11Å; L2327-I2331 WeakPolarHBondContact O-CD1 3.19Å; L2327-I2331 WeakPolarHBondContact O-CG1 3.29Å; L2327-I2331 PolarHBondContact O-N 3.01Å; L2327-I2331 VanDerWaalsContact O-N 3.14Å; L2327-R2444 HydrophobicContact CD1-CB 4.31Å; L2327-R2444 HydrophobicContact CD1-CG 4.43Å; L2327-R2444 WeakPolarHBondContact CD1-O 3.3Å; L2327-N2445 HydrophobicContact CD1-CB 4.29Å
2328	A	49.3	Very low	45.4	Very low	51.5 Å²	51.5	87.5 Å²	87.5	43%	0.426	45%	0.445	S	S	.	.	H	α-helix	trans	-60.8	-47.5	178.3	0	0	0	0	0	111.9	K2324 N2325 A2326 R2330 I2331 Q2332	K2324-A2328 WeakPolarHBondContact O-CA 3.29Å; K2324-A2328 VanDerWaalsContact O-CB 3.23Å; K2324-A2328 WeakPolarHBondContact O-CB 3.36Å; K2324-A2328 PolarHBondContact O-N 3.12Å; N2325-A2328 PolarHBondContact O-N 2.78Å; A2326-A2328 PolarHBondContact O-N 2.87Å; A2328-R2330 VanDerWaalsContact C-N 3.29Å; A2328-R2330 PolarHBondContact O-N 3Å; A2328-I2331 PolarHBondContact O-N 3.06Å; A2328-Q2332 WeakPolarHBondContact O-CA 2.84Å; A2328-Q2332 VanDerWaalsContact O-CB 3.29Å; A2328-Q2332 WeakPolarHBondContact O-CB 3.36Å; A2328-Q2332 PolarHBondContact O-N 2.85Å; A2328-Q2332 VanDerWaalsContact O-N 3.1Å
2329	K	51.8	Low	45.8	Very low	152.75 Å²	152.75	85.4 Å²	85.4	66%	0.664	44%	0.444	S	S	*	.	H	α-helix	trans	-60.3	-33.4	174.3	-73.8	179.7	176.7	179.7	0	112.6	N2325 A2326 L2327 Y2333	N2325-K2329 WeakPolarHBondContact O-CB 3.43Å; N2325-K2329 WeakPolarHBondContact O-CG 3.43Å; N2325-K2329 PolarHBondContact O-N 2.97Å; A2326-K2329 PolarHBondContact O-N 3.47Å; L2327-K2329 PolarHBondContact O-N 2.72Å; K2329-Y2333 WeakPolarHBondContact O-CB 3.43Å; K2329-Y2333 PolarHBondContact O-N 3.11Å; K2329-Y2333 VanDerWaalsContact O-N 3.08Å
2330	R	50.3	Low	46.2	Very low	115 Å²	115	85 Å²	85	43%	0.434	45%	0.446	S	S	.	.	H	α-helix	trans	-72.7	-40.8	179	-160.9	153.9	-174.4	166.7	1.7	112.2	A2326 L2327 A2328 Y2333 I2334	A2326-R2330 WeakPolarHBondContact O-CB 3.46Å; A2326-R2330 PolarHBondContact O-N 3.13Å; A2326-R2330 VanDerWaalsContact O-N 3.1Å; L2327-R2330 WeakPolarHBondContact O-CA 3.5Å; L2327-R2330 VanDerWaalsContact O-CB 3.27Å; L2327-R2330 WeakPolarHBondContact O-CB 3.31Å; L2327-R2330 PolarHBondContact O-N 3.13Å; A2328-R2330 VanDerWaalsContact C-N 3.29Å; A2328-R2330 PolarHBondContact O-N 3Å; R2330-Y2333 PolarHBondContact O-N 2.61Å; R2330-I2334 HydrophobicContact CG-CD1 4.36Å; R2330-I2334 VanDerWaalsContact O-CB 3.27Å; R2330-I2334 WeakPolarHBondContact O-CB 3.3Å; R2330-I2334 WeakPolarHBondContact O-CD1 3.43Å; R2330-I2334 VanDerWaalsContact O-CG1 3.32Å; R2330-I2334 WeakPolarHBondContact O-CG1 3.43Å; R2330-I2334 PolarHBondContact O-N 2.82Å
2331	I	50.4	Low	46.8	Very low	38.5 Å²	38.5	83.5 Å²	83.5	20%	0.197	44%	0.435	C	S	.	.	H	α-helix	trans	-67.3	-46.6	174.7	-65.5	164.7	0	0	0	110.2	L2327 A2328 Y2333 I2334 T2335 F2348 I2442 R2444	L2327-I2331 HydrophobicContact CD1-CD1 4.34Å; L2327-I2331 HydrophobicContact CD1-CG1 4.35Å; L2327-I2331 HydrophobicContact CD2-CD1 4.45Å; L2327-I2331 HydrophobicContact CG-CD1 4.04Å; L2327-I2331 HydrophobicContact CG-CG1 4.47Å; L2327-I2331 WeakPolarHBondContact O-CB 3.11Å; L2327-I2331 WeakPolarHBondContact O-CD1 3.19Å; L2327-I2331 WeakPolarHBondContact O-CG1 3.29Å; L2327-I2331 PolarHBondContact O-N 3.01Å; L2327-I2331 VanDerWaalsContact O-N 3.14Å; A2328-I2331 PolarHBondContact O-N 3.06Å; I2331-Y2333 VanDerWaalsContact C-N 3.28Å; I2331-Y2333 PolarHBondContact O-N 2.99Å; I2331-I2334 PolarHBondContact O-N 2.96Å; I2331-I2334 VanDerWaalsContact O-N 3.13Å; I2331-T2335 VanDerWaalsContact O-CB 3.31Å; I2331-T2335 WeakPolarHBondContact O-CB 3.4Å; I2331-T2335 PolarHBondContact O-N 2.78Å; I2331-T2335 PolarHBondContact O-OG1 3.03Å; I2331-T2335 VanDerWaalsContact O-OG1 3.05Å; I2331-F2348 HydrophobicContact CD1-CE1 4.27Å; I2331-F2348 HydrophobicContact CD1-CZ 4.42Å; I2331-F2348 HydrophobicContact CG1-CE1 3.87Å; I2331-F2348 HydrophobicContact CG1-CZ 4.32Å; I2331-F2348 HydrophobicContact CG2-CE1 4.44Å; I2331-F2348 HydrophobicContact CG2-CZ 4.25Å; I2331-I2442 HydrophobicContact CG2-CD1 4.45Å; I2331-R2444 HydrophobicContact CD1-CB 4.35Å; I2331-R2444 HydrophobicContact CD1-CG 3.81Å; I2331-R2444 HydrophobicContact CG1-CG 4.03Å
2332	Q	55	Low	47.4	Very low	98.75 Å²	98.75	80.4 Å²	80.4	46%	0.461	42%	0.421	S	S	.	.	H	α-helix	trans	-53.4	-53.1	176	177.3	178.2	-2.9	0	0	110.9	A2328 I2334 T2335 E2336	A2328-Q2332 WeakPolarHBondContact O-CA 2.84Å; A2328-Q2332 VanDerWaalsContact O-CB 3.29Å; A2328-Q2332 WeakPolarHBondContact O-CB 3.36Å; A2328-Q2332 PolarHBondContact O-N 2.85Å; A2328-Q2332 VanDerWaalsContact O-N 3.1Å; Q2332-I2334 VanDerWaalsContact C-N 3.33Å; Q2332-I2334 PolarHBondContact O-N 2.96Å; Q2332-T2335 CarbonylContact O-C 3.56Å; Q2332-T2335 WeakPolarHBondContact O-CA 3.32Å; Q2332-T2335 WeakPolarHBondContact O-CB 3.38Å; Q2332-T2335 PolarHBondContact O-N 3.01Å; Q2332-T2335 VanDerWaalsContact O-N 3.12Å; Q2332-E2336 VanDerWaalsContact CG-CD 3.47Å; Q2332-E2336 HydrophobicContact CG-CG 4.24Å; Q2332-E2336 VanDerWaalsContact CG-OE1 3.26Å; Q2332-E2336 WeakPolarHBondContact CG-OE1 3.34Å; Q2332-E2336 PolarHBondContact NE2-OE1 2.9Å; Q2332-E2336 WeakPolarHBondContact O-CB 3.25Å; Q2332-E2336 VanDerWaalsContact O-CG 3.31Å; Q2332-E2336 WeakPolarHBondContact O-CG 3.31Å; Q2332-E2336 PolarHBondContact O-N 2.91Å
2333	Y	51.3	Low	48	Very low	108.5 Å²	108.5	74.8 Å²	74.8	43%	0.425	39%	0.391	S	S	.	.	H	α-helix	trans	-59	-39.9	178.3	178.7	-93.5	0	0	0	113.4	L2297 K2329 R2330 I2331 T2335 E2336 A2337 G2498 R2499 L2506	L2297-Y2333 HydrophobicContact CD2-CE1 3.77Å; K2329-Y2333 WeakPolarHBondContact O-CB 3.43Å; K2329-Y2333 PolarHBondContact O-N 3.11Å; K2329-Y2333 VanDerWaalsContact O-N 3.08Å; R2330-Y2333 PolarHBondContact O-N 2.61Å; I2331-Y2333 VanDerWaalsContact C-N 3.28Å; I2331-Y2333 PolarHBondContact O-N 2.99Å; Y2333-T2335 VanDerWaalsContact C-N 3.3Å; Y2333-T2335 PolarHBondContact O-N 2.86Å; Y2333-E2336 PolarHBondContact O-N 2.81Å; Y2333-A2337 HydrophobicContact CD1-CB 4.38Å; Y2333-A2337 HydrophobicContact CE1-CB 4.17Å; Y2333-A2337 VanDerWaalsContact O-CB 3.23Å; Y2333-A2337 WeakPolarHBondContact O-CB 3.22Å; Y2333-A2337 PolarHBondContact O-N 3.14Å; Y2333-G2498 PolarHBondContact OH-O 2.9Å; Y2333-G2498 VanDerWaalsContact OH-O 3.05Å; Y2333-R2499 VanDerWaalsContact CE1-CZ 3.46Å; Y2333-L2506 HydrophobicContact CD1-CD2 4.26Å; Y2333-L2506 HydrophobicContact CE1-CD2 3.34Å; Y2333-L2506 HydrophobicContact CE2-CD2 4.49Å; Y2333-L2506 VanDerWaalsContact CZ-CD2 3.48Å; Y2333-L2506 WeakPolarHBondContact OH-CD2 3.44Å
2334	I	48.6	Very low	49	Very low	17.5 Å²	17.5	69.3 Å²	69.3	9%	0.09	37%	0.372	C	S	.	.	H	α-helix	trans	-65.9	-37.8	177.2	-71	167.8	0	0	0	110.8	L2297 R2330 I2331 Q2332 A2337 M2338 P2342 L2415 I2442 Y2461	L2297-I2334 HydrophobicContact CD1-CD1 4.45Å; L2297-I2334 HydrophobicContact CD1-CG1 4.43Å; R2330-I2334 HydrophobicContact CG-CD1 4.36Å; R2330-I2334 VanDerWaalsContact O-CB 3.27Å; R2330-I2334 WeakPolarHBondContact O-CB 3.3Å; R2330-I2334 WeakPolarHBondContact O-CD1 3.43Å; R2330-I2334 VanDerWaalsContact O-CG1 3.32Å; R2330-I2334 WeakPolarHBondContact O-CG1 3.43Å; R2330-I2334 PolarHBondContact O-N 2.82Å; I2331-I2334 PolarHBondContact O-N 2.96Å; I2331-I2334 VanDerWaalsContact O-N 3.13Å; Q2332-I2334 VanDerWaalsContact C-N 3.33Å; Q2332-I2334 PolarHBondContact O-N 2.96Å; I2334-A2337 PolarHBondContact O-N 3.12Å; I2334-M2338 HydrophobicContact CG2-CE 3.85Å; I2334-M2338 WeakPolarHBondContact O-CE 3.39Å; I2334-M2338 WeakPolarHBondContact O-CG 3.31Å; I2334-M2338 PolarHBondContact O-N 3.06Å; I2334-M2338 VanDerWaalsContact O-N 3.11Å; I2334-P2342 HydrophobicContact CG2-CB 4.01Å; I2334-P2342 HydrophobicContact CG2-CG 4.18Å; I2334-L2415 HydrophobicContact CG2-CD2 3.79Å; I2334-I2442 HydrophobicContact CD1-CG2 4.4Å; I2334-I2442 HydrophobicContact CG2-CD1 4.26Å; I2334-I2442 HydrophobicContact CG2-CG1 4.47Å; I2334-I2442 HydrophobicContact CG2-CG2 4.24Å; I2334-Y2461 HydrophobicContact CG2-CE1 4.28Å
2335	T	53.2	Low	50.1	Low	60.75 Å²	60.75	64.4 Å²	64.4	37%	0.373	35%	0.351	S	S	.	.	H	α-helix	trans	-72.7	-40.4	177.6	-51.6	0	0	0	0	111.9	I2331 Q2332 Y2333 A2337 M2338 P2339 I2481	I2331-T2335 VanDerWaalsContact O-CB 3.31Å; I2331-T2335 WeakPolarHBondContact O-CB 3.4Å; I2331-T2335 PolarHBondContact O-N 2.78Å; I2331-T2335 PolarHBondContact O-OG1 3.03Å; I2331-T2335 VanDerWaalsContact O-OG1 3.05Å; Q2332-T2335 CarbonylContact O-C 3.56Å; Q2332-T2335 WeakPolarHBondContact O-CA 3.32Å; Q2332-T2335 WeakPolarHBondContact O-CB 3.38Å; Q2332-T2335 PolarHBondContact O-N 3.01Å; Q2332-T2335 VanDerWaalsContact O-N 3.12Å; Y2333-T2335 VanDerWaalsContact C-N 3.3Å; Y2333-T2335 PolarHBondContact O-N 2.86Å; T2335-A2337 VanDerWaalsContact C-N 3.31Å; T2335-A2337 PolarHBondContact O-N 3.48Å; T2335-M2338 CarbonylContact O-C 3.54Å; T2335-M2338 PolarHBondContact O-N 3.02Å; T2335-P2339 WeakPolarHBondContact O-CA 3.25Å; T2335-P2339 VanDerWaalsContact O-N 3.16Å; T2335-I2481 HydrophobicContact CG2-CD1 4.1Å
2336	E	52.8	Low	51.2	Low	116.5 Å²	116.5	60.7 Å²	60.7	54%	0.544	33%	0.331	S	S	.	.	H	α-helix	trans	-66.6	-35.7	175.2	-72.6	170.8	171.2	0	0	112.4	Q2332 Y2333 M2338	Q2332-E2336 VanDerWaalsContact CG-CD 3.47Å; Q2332-E2336 HydrophobicContact CG-CG 4.24Å; Q2332-E2336 VanDerWaalsContact CG-OE1 3.26Å; Q2332-E2336 WeakPolarHBondContact CG-OE1 3.34Å; Q2332-E2336 PolarHBondContact NE2-OE1 2.9Å; Q2332-E2336 WeakPolarHBondContact O-CB 3.25Å; Q2332-E2336 VanDerWaalsContact O-CG 3.31Å; Q2332-E2336 WeakPolarHBondContact O-CG 3.31Å; Q2332-E2336 PolarHBondContact O-N 2.91Å; Y2333-E2336 PolarHBondContact O-N 2.81Å; E2336-M2338 PolarHBondContact O-N 2.82Å
2337	A	47.3	Very low	52.7	Low	44.75 Å²	44.75	57.7 Å²	57.7	37%	0.37	31%	0.305	S	S	.	.	H	α-helix	trans	-79.8	-14.5	177.9	0	0	0	0	0	114	Y2333 I2334 T2335 I2488	Y2333-A2337 HydrophobicContact CD1-CB 4.38Å; Y2333-A2337 HydrophobicContact CE1-CB 4.17Å; Y2333-A2337 VanDerWaalsContact O-CB 3.23Å; Y2333-A2337 WeakPolarHBondContact O-CB 3.22Å; Y2333-A2337 PolarHBondContact O-N 3.14Å; I2334-A2337 PolarHBondContact O-N 3.12Å; T2335-A2337 VanDerWaalsContact C-N 3.31Å; T2335-A2337 PolarHBondContact O-N 3.48Å; A2337-I2488 HydrophobicContact CB-CD1 4.23Å
2338	M	47.9	Very low	54.1	Low	26.25 Å²	26.25	57.9 Å²	57.9	13%	0.129	31%	0.305	C	S	.	.			trans	-135.1	71	-177.1	-67.6	-173.8	-95.7	0	0	111.9	V2295 I2334 T2335 E2336 D2340 S2341 P2342 Q2417 I2426 Y2461 I2488	V2295-M2338 HydrophobicContact CB-CE 4.21Å; V2295-M2338 HydrophobicContact CB-SD 4.15Å; V2295-M2338 HydrophobicContact CG1-CE 4.48Å; V2295-M2338 HydrophobicContact CG2-CE 4.4Å; V2295-M2338 HydrophobicContact CG2-CG 4.4Å; V2295-M2338 HydrophobicContact CG2-SD 4.02Å; I2334-M2338 HydrophobicContact CG2-CE 3.85Å; I2334-M2338 WeakPolarHBondContact O-CE 3.39Å; I2334-M2338 WeakPolarHBondContact O-CG 3.31Å; I2334-M2338 PolarHBondContact O-N 3.06Å; I2334-M2338 VanDerWaalsContact O-N 3.11Å; T2335-M2338 CarbonylContact O-C 3.54Å; T2335-M2338 PolarHBondContact O-N 3.02Å; E2336-M2338 PolarHBondContact O-N 2.82Å; M2338-D2340 VanDerWaalsContact C-N 3.27Å; M2338-D2340 PolarHBondContact O-N 2.95Å; M2338-S2341 CarbonylContact O-C 3.48Å; M2338-S2341 PolarHBondContact O-N 2.82Å; M2338-P2342 HydrophobicContact CB-CB 4.09Å; M2338-P2342 HydrophobicContact CB-CG 4.36Å; M2338-P2342 WeakPolarHBondContact O-CD 3.31Å; M2338-P2342 HydrophobicContact SD-CB 3.99Å; M2338-Q2417 PolarHBondContact SD-NE2 3.35Å; M2338-I2426 HydrophobicContact CE-CD1 3.78Å; M2338-I2426 HydrophobicContact SD-CD1 3.6Å; M2338-Y2461 HydrophobicContact CE-CD1 3.89Å; M2338-Y2461 HydrophobicContact CE-CG 4.19Å; M2338-I2488 HydrophobicContact CE-CD1 4.36Å; M2338-I2488 HydrophobicContact CG-CD1 3.94Å; M2338-I2488 HydrophobicContact SD-CD1 3.92Å
2339	P	44.7	Very low	55.5	Low	102 Å²	102	55.4 Å²	55.4	66%	0.662	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-30.2	-178.2	13.5	-19.4	0	0	0	113.5	T2335 S2341	T2335-P2339 WeakPolarHBondContact O-CA 3.25Å; T2335-P2339 VanDerWaalsContact O-N 3.16Å; P2339-S2341 VanDerWaalsContact C-N 3.29Å; P2339-S2341 PolarHBondContact O-N 3.25Å
2340	D	44.4	Very low	56.6	Low	117.25 Å²	117.25	49.8 Å²	49.8	63%	0.627	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	21.8	-172.1	-59.2	-46.2	0	0	0	114.3	M2338 K2424 K2466	M2338-D2340 VanDerWaalsContact C-N 3.27Å; M2338-D2340 PolarHBondContact O-N 2.95Å; D2340-K2424 PolarHBondContact O-NZ 3.26Å; D2340-K2466 WeakPolarHBondContact OD1-CE 3.42Å; D2340-K2466 IonicContact OD1-NZ 3.54Å; D2340-K2466 WeakPolarHBondContact OD2-CE 3.3Å; D2340-K2466 IonicContact OD2-NZ 2.74Å
2341	S	47.2	Very low	58.1	Low	46.25 Å²	46.25	44.5 Å²	44.5	32%	0.323	24%	0.243	S	C	.	.			trans	128.3	105.8	169.1	-160.7	0	0	0	0	114.2	M2338 P2339 S2343 H2419 N2464	M2338-S2341 CarbonylContact O-C 3.48Å; M2338-S2341 PolarHBondContact O-N 2.82Å; P2339-S2341 VanDerWaalsContact C-N 3.29Å; P2339-S2341 PolarHBondContact O-N 3.25Å; S2341-S2343 VanDerWaalsContact C-N 3.26Å; S2341-S2343 PolarHBondContact O-N 2.95Å; S2341-S2343 VanDerWaalsContact O-N 3.12Å; S2341-S2343 PolarHBondContact O-OG 2.98Å; S2341-S2343 PolarHBondContact OG-OG 3.07Å; S2341-S2343 VanDerWaalsContact OG-OG 3.04Å; S2341-H2419 PolarHBondContact OG-CE1 2.82Å; S2341-H2419 PolarHBondContact OG-ND1 3.39Å; S2341-H2419 VanDerWaalsContact OG-ND1 3.15Å; S2341-N2464 WeakPolarHBondContact CB-ND2 3.49Å; S2341-N2464 PolarHBondContact OG-ND2 2.82Å
2342	P	51.3	Low	59.7	Low	35.5 Å²	35.5	44.8 Å²	44.8	23%	0.231	24%	0.243	C	C	.	.			trans	-77.9	57.3	174.8	32.3	-33.9	0	0	0	112.2	I2334 M2338 A2344 H2419 I2442 Y2461 W2462	I2334-P2342 HydrophobicContact CG2-CB 4.01Å; I2334-P2342 HydrophobicContact CG2-CG 4.18Å; M2338-P2342 HydrophobicContact CB-CB 4.09Å; M2338-P2342 HydrophobicContact CB-CG 4.36Å; M2338-P2342 WeakPolarHBondContact O-CD 3.31Å; M2338-P2342 HydrophobicContact SD-CB 3.99Å; P2342-A2344 PolarHBondContact O-N 3.02Å; P2342-H2419 PolarHBondContact O-ND1 2.96Å; P2342-I2442 HydrophobicContact CB-CD1 3.9Å; P2342-I2442 HydrophobicContact CB-CG1 4.2Å; P2342-I2442 HydrophobicContact CG-CD1 3.92Å; P2342-I2442 HydrophobicContact CG-CG1 4.03Å; P2342-Y2461 WeakPolarHBondContact O-CD1 3.47Å; P2342-Y2461 WeakPolarHBondContact O-CE1 3.3Å; P2342-W2462 HydrophobicContact CB-CH2 4.27Å; P2342-W2462 HydrophobicContact CB-CZ3 4.23Å
2343	S	53.3	Low	61.1	Low	7 Å²	7	40.3 Å²	40.3	5%	0.049	22%	0.222	C	C	.	.			trans	-73.7	127.4	-179	-6.1	0	0	0	0	111.5	S2341 G2345 Q2417 I2418 N2420 W2462	S2341-S2343 VanDerWaalsContact C-N 3.26Å; S2341-S2343 PolarHBondContact O-N 2.95Å; S2341-S2343 VanDerWaalsContact O-N 3.12Å; S2341-S2343 PolarHBondContact O-OG 2.98Å; S2341-S2343 PolarHBondContact OG-OG 3.07Å; S2341-S2343 VanDerWaalsContact OG-OG 3.04Å; S2343-G2345 PolarHBondContact O-N 3.01Å; S2343-G2345 VanDerWaalsContact O-N 3.09Å; S2343-Q2417 PolarHBondContact OG-NE2 2.7Å; S2343-I2418 CarbonylContact C-O 3.51Å; S2343-I2418 WeakPolarHBondContact CB-O 3.18Å; S2343-N2420 PolarHBondContact OG-N 2.87Å; S2343-N2420 VanDerWaalsContact OG-N 3.14Å; S2343-W2462 PolarHBondContact O-NE1 3.31Å
2344	A	59.7	Low	62.6	Low	10.25 Å²	10.25	37.3 Å²	37.3	9%	0.085	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	129.1	167.6	0	0	0	0	0	110.7	P2342 I2418 T2441 V2443 I2459 Y2461	P2342-A2344 PolarHBondContact O-N 3.02Å; A2344-I2418 HydrophobicContact CB-CB 4.32Å; A2344-I2418 HydrophobicContact CB-CD1 4.14Å; A2344-I2418 HydrophobicContact CB-CG2 4.26Å; A2344-I2418 PolarHBondContact N-O 2.9Å; A2344-I2418 CarbonylContact O-C 3.55Å; A2344-I2418 VanDerWaalsContact O-CB 3.3Å; A2344-I2418 WeakPolarHBondContact O-CB 3.37Å; A2344-I2418 VanDerWaalsContact O-CG2 3.29Å; A2344-I2418 WeakPolarHBondContact O-CG2 3.38Å; A2344-I2418 VanDerWaalsContact O-O 3.06Å; A2344-T2441 WeakPolarHBondContact CB-O 3.31Å; A2344-T2441 PolarHBondContact N-O 3.05Å; A2344-V2443 HydrophobicContact CB-CB 4.45Å; A2344-V2443 HydrophobicContact CB-CG2 3.72Å; A2344-I2459 HydrophobicContact CB-CG2 4.29Å; A2344-Y2461 HydrophobicContact CB-CD1 4.16Å; A2344-Y2461 HydrophobicContact CB-CE1 3.83Å
2345	G	63.6	Low	63.9	Low	1 Å²	1	41.8 Å²	41.8	1%	0.01	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	-49.2	179.2	0	0	0	0	0	113.1	S2343 I2418 V2460 W2462	S2343-G2345 PolarHBondContact O-N 3.01Å; S2343-G2345 VanDerWaalsContact O-N 3.09Å; G2345-I2418 CarbonylContact C-O 3.59Å; G2345-I2418 VanDerWaalsContact CA-O 3.27Å; G2345-I2418 WeakPolarHBondContact CA-O 3.47Å; G2345-I2418 PolarHBondContact N-O 3.07Å; G2345-I2418 WeakPolarHBondContact O-CA 3.49Å; G2345-I2418 WeakPolarHBondContact O-CB 3.18Å; G2345-I2418 PolarHBondContact O-N 2.93Å; G2345-I2418 VanDerWaalsContact O-O 3.05Å; G2345-V2460 CarbonylContact C-O 3.59Å; G2345-V2460 WeakPolarHBondContact CA-O 3.49Å; G2345-V2460 PolarHBondContact N-O 2.84Å; G2345-W2462 VanDerWaalsContact CA-CD1 3.45Å; G2345-W2462 VanDerWaalsContact CA-CD2 3.43Å; G2345-W2462 VanDerWaalsContact CA-CE2 3.42Å; G2345-W2462 WeakPolarHBondContact O-CH2 3.23Å; G2345-W2462 VanDerWaalsContact O-CZ2 3.29Å; G2345-W2462 WeakPolarHBondContact O-CZ2 3.48Å
2346	M	68.8	Low	65.1	Low	22.25 Å²	22.25	46.1 Å²	46.1	11%	0.11	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	145	177	-83	179.6	89.6	0	0	110.6	F2348 L2415 T2416 Q2417 I2459 V2460 W2641	M2346-F2348 HydrophobicContact CB-CD2 4.28Å; M2346-F2348 HydrophobicContact CB-CE2 3.67Å; M2346-F2348 HydrophobicContact CB-CZ 4.3Å; M2346-F2348 HydrophobicContact CE-CB 4.18Å; M2346-F2348 HydrophobicContact CE-CE1 4.02Å; M2346-F2348 HydrophobicContact CE-CE2 4.06Å; M2346-F2348 HydrophobicContact CE-CZ 3.46Å; M2346-F2348 VanDerWaalsContact CE-CZ 3.4Å; M2346-F2348 HydrophobicContact SD-CE2 4.25Å; M2346-F2348 HydrophobicContact SD-CZ 3.99Å; M2346-L2415 HydrophobicContact CB-CD1 4.34Å; M2346-L2415 HydrophobicContact CE-CD1 3.94Å; M2346-L2415 HydrophobicContact CE-CD2 4.08Å; M2346-L2415 HydrophobicContact CE-CG 4.38Å; M2346-L2415 HydrophobicContact CG-CD1 4.28Å; M2346-L2415 HydrophobicContact CG-CD2 4.47Å; M2346-L2415 HydrophobicContact CG-CG 4.03Å; M2346-L2415 HydrophobicContact SD-CD1 3.76Å; M2346-L2415 VanDerWaalsContact SD-CD1 3.58Å; M2346-L2415 HydrophobicContact SD-CD2 3.78Å; M2346-L2415 HydrophobicContact SD-CG 3.76Å; M2346-T2416 CarbonylContact C-O 3.47Å; M2346-T2416 VanDerWaalsContact CA-O 3.27Å; M2346-T2416 WeakPolarHBondContact CA-O 3.17Å; M2346-T2416 WeakPolarHBondContact CG-O 3.43Å; M2346-Q2417 HydrophobicContact CE-CG 4.12Å; M2346-Q2417 HydrophobicContact CG-CG 4.39Å; M2346-I2459 CarbonylContact O-C 3.55Å; M2346-V2460 HydrophobicContact CB-CB 4.25Å; M2346-V2460 HydrophobicContact CB-CG2 4.37Å; M2346-V2460 HydrophobicContact CE-CG2 4.43Å; M2346-V2460 PolarHBondContact N-O 3.03Å; M2346-V2460 PolarHBondContact O-N 2.84Å; M2346-W2641 HydrophobicContact CE-CH2 3.51Å; M2346-W2641 HydrophobicContact CE-CZ3 3.65Å; M2346-W2641 HydrophobicContact SD-CH2 4.27Å
2347	I	73.9	Confident	66.5	Low	0 Å²	0	41.3 Å²	41.3	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	129.4	160.2	-54.6	164.4	0	0	0	107.1	M2349 W2373 L2415 T2416 I2418 V2443 V2446 T2458 I2459	I2347-M2349 HydrophobicContact CB-CE 4.47Å; I2347-M2349 HydrophobicContact CG2-CE 4.32Å; I2347-M2349 HydrophobicContact CG2-CG 3.89Å; I2347-M2349 HydrophobicContact CG2-SD 4.2Å; I2347-W2373 HydrophobicContact CD1-CZ2 3.79Å; I2347-L2415 CarbonylContact O-C 3.5Å; I2347-L2415 VanDerWaalsContact O-CA 3.3Å; I2347-L2415 WeakPolarHBondContact O-CA 3.31Å; I2347-T2416 PolarHBondContact N-O 2.91Å; I2347-T2416 PolarHBondContact O-N 2.82Å; I2347-I2418 HydrophobicContact CD1-CD1 4.02Å; I2347-I2418 HydrophobicContact CG1-CD1 4.12Å; I2347-V2443 HydrophobicContact CD1-CB 4.42Å; I2347-V2443 HydrophobicContact CD1-CG1 4.09Å; I2347-V2443 HydrophobicContact CD1-CG2 3.8Å; I2347-V2443 HydrophobicContact CG1-CG1 4.46Å; I2347-V2443 HydrophobicContact CG1-CG2 4.11Å; I2347-V2446 HydrophobicContact CD1-CG2 3.8Å; I2347-V2446 HydrophobicContact CG1-CG2 4.17Å; I2347-V2446 HydrophobicContact CG2-CG2 4.16Å; I2347-T2458 CarbonylContact C-O 3.52Å; I2347-T2458 WeakPolarHBondContact CA-O 3.48Å; I2347-I2459 HydrophobicContact CG1-CG1 4.47Å; I2347-I2459 HydrophobicContact CG1-CG2 4.5Å; I2347-I2459 HydrophobicContact CG2-CG1 4.37Å
2348	F	72.1	Confident	68.3	Low	43.5 Å²	43.5	46.8 Å²	46.8	19%	0.191	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	128	168.5	-119.5	-100	0	0	0	107.6	I2331 M2346 T2350 L2413 L2415 P2457 T2458 V2460 V2664 K2667 V2668	I2331-F2348 HydrophobicContact CD1-CE1 4.27Å; I2331-F2348 HydrophobicContact CD1-CZ 4.42Å; I2331-F2348 HydrophobicContact CG1-CE1 3.87Å; I2331-F2348 HydrophobicContact CG1-CZ 4.32Å; I2331-F2348 HydrophobicContact CG2-CE1 4.44Å; I2331-F2348 HydrophobicContact CG2-CZ 4.25Å; M2346-F2348 HydrophobicContact CB-CD2 4.28Å; M2346-F2348 HydrophobicContact CB-CE2 3.67Å; M2346-F2348 HydrophobicContact CB-CZ 4.3Å; M2346-F2348 HydrophobicContact CE-CB 4.18Å; M2346-F2348 HydrophobicContact CE-CE1 4.02Å; M2346-F2348 HydrophobicContact CE-CE2 4.06Å; M2346-F2348 HydrophobicContact CE-CZ 3.46Å; M2346-F2348 VanDerWaalsContact CE-CZ 3.4Å; M2346-F2348 HydrophobicContact SD-CE2 4.25Å; M2346-F2348 HydrophobicContact SD-CZ 3.99Å; F2348-T2350 HydrophobicContact CD1-CG2 4.04Å; F2348-T2350 HydrophobicContact CE1-CG2 3.16Å; F2348-T2350 HydrophobicContact CE2-CG2 3.88Å; F2348-T2350 HydrophobicContact CZ-CG2 3.09Å; F2348-L2413 HydrophobicContact CD1-CD1 4.14Å; F2348-L2413 HydrophobicContact CD2-CD1 4.24Å; F2348-L2413 HydrophobicContact CE1-CD1 3.63Å; F2348-L2413 HydrophobicContact CE2-CD1 3.66Å; F2348-L2413 HydrophobicContact CE2-CD2 4.46Å; F2348-L2413 HydrophobicContact CE2-CG 4Å; F2348-L2413 HydrophobicContact CG-CD1 4.42Å; F2348-L2413 HydrophobicContact CZ-CD1 3.56Å; F2348-L2413 VanDerWaalsContact CZ-CD1 3.43Å; F2348-L2413 HydrophobicContact CZ-CD2 4.4Å; F2348-L2415 HydrophobicContact CB-CD1 4.22Å; F2348-L2415 HydrophobicContact CD1-CD2 3.58Å; F2348-L2415 HydrophobicContact CD1-CG 3.88Å; F2348-L2415 HydrophobicContact CD2-CD1 3.8Å; F2348-L2415 HydrophobicContact CE1-CD2 3.41Å; F2348-L2415 VanDerWaalsContact CE1-CD2 3.41Å; F2348-L2415 HydrophobicContact CE1-CG 4.22Å; F2348-L2415 HydrophobicContact CG-CD1 4.43Å; F2348-L2415 HydrophobicContact CZ-CD2 4.37Å; F2348-P2457 CarbonylContact O-C 3.49Å; F2348-P2457 WeakPolarHBondContact O-CA 3.32Å; F2348-T2458 PolarHBondContact N-O 2.96Å; F2348-T2458 PolarHBondContact O-N 3.47Å; F2348-V2460 HydrophobicContact CD2-CB 4.32Å; F2348-V2460 HydrophobicContact CD2-CG2 3.72Å; F2348-V2460 HydrophobicContact CE2-CB 3.92Å; F2348-V2460 HydrophobicContact CE2-CG2 3.61Å; F2348-V2664 HydrophobicContact CD1-CG1 3.71Å; F2348-V2664 HydrophobicContact CE1-CB 4.31Å; F2348-V2664 HydrophobicContact CE1-CG1 3.58Å; F2348-V2664 HydrophobicContact CE1-CG2 4.25Å; F2348-V2664 HydrophobicContact CZ-CG1 4.37Å; F2348-K2667 HydrophobicContact CZ-CB 3.72Å; F2348-K2667 HydrophobicContact CZ-CD 4.32Å; F2348-V2668 HydrophobicContact CD1-CG2 4.13Å; F2348-V2668 HydrophobicContact CD2-CG2 3.45Å; F2348-V2668 VanDerWaalsContact CD2-CG2 3.45Å; F2348-V2668 HydrophobicContact CE1-CG2 4Å; F2348-V2668 HydrophobicContact CE2-CB 4.23Å; F2348-V2668 HydrophobicContact CE2-CG2 3.28Å; F2348-V2668 HydrophobicContact CG-CG2 3.84Å; F2348-V2668 HydrophobicContact CZ-CG2 3.55Å
2349	M	77.8	Confident	70.3	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	122.6	178	-165.3	-177.8	-77	0	0	109.7	I2347 M2351 I2362 W2373 L2413 L2414 T2416 V2446 A2448 F2455 E2456 P2457	I2347-M2349 HydrophobicContact CB-CE 4.47Å; I2347-M2349 HydrophobicContact CG2-CE 4.32Å; I2347-M2349 HydrophobicContact CG2-CG 3.89Å; I2347-M2349 HydrophobicContact CG2-SD 4.2Å; M2349-M2351 HydrophobicContact CG-CB 4.44Å; M2349-M2351 HydrophobicContact CG-CE 4.07Å; M2349-M2351 HydrophobicContact SD-CB 4.5Å; M2349-M2351 HydrophobicContact SD-CE 3.48Å; M2349-M2351 VanDerWaalsContact SD-CE 3.5Å; M2349-M2351 WeakPolarHBondContact SD-CE 3.15Å; M2349-M2351 HydrophobicContact SD-SD 4.33Å; M2349-I2362 HydrophobicContact CE-CG2 4.08Å; M2349-I2362 HydrophobicContact SD-CD1 4.41Å; M2349-I2362 HydrophobicContact SD-CG1 4.35Å; M2349-I2362 HydrophobicContact SD-CG2 3.97Å; M2349-W2373 HydrophobicContact CE-CH2 4.11Å; M2349-W2373 HydrophobicContact SD-CH2 4.4Å; M2349-L2413 CarbonylContact O-C 3.57Å; M2349-L2413 WeakPolarHBondContact O-CA 3.49Å; M2349-L2414 HydrophobicContact CB-CB 4.27Å; M2349-L2414 HydrophobicContact CB-CD2 4.48Å; M2349-L2414 HydrophobicContact CE-CB 3.94Å; M2349-L2414 PolarHBondContact N-O 2.87Å; M2349-L2414 PolarHBondContact O-N 3.18Å; M2349-L2414 VanDerWaalsContact O-O 3.13Å; M2349-L2414 HydrophobicContact SD-CD2 4.48Å; M2349-T2416 VanDerWaalsContact CE-OG1 3.28Å; M2349-T2416 WeakPolarHBondContact CE-OG1 3.26Å; M2349-V2446 HydrophobicContact CE-CB 4.32Å; M2349-V2446 HydrophobicContact CE-CG1 3.52Å; M2349-V2446 HydrophobicContact CG-CG1 4.49Å; M2349-V2446 HydrophobicContact SD-CG1 3.85Å; M2349-A2448 HydrophobicContact CE-CB 4.49Å; M2349-A2448 HydrophobicContact SD-CB 4.45Å; M2349-F2455 HydrophobicContact CB-CE2 3.9Å; M2349-F2455 HydrophobicContact CB-CZ 4.24Å; M2349-F2455 HydrophobicContact CE-CD2 3.91Å; M2349-F2455 HydrophobicContact CG-CB 4.3Å; M2349-F2455 HydrophobicContact CG-CE2 4.02Å; M2349-F2455 HydrophobicContact CG-CZ 3.84Å; M2349-F2455 HydrophobicContact SD-CB 4.16Å; M2349-F2455 HydrophobicContact SD-CE2 4.22Å; M2349-F2455 HydrophobicContact SD-CZ 3.9Å; M2349-E2456 WeakPolarHBondContact CA-O 3.37Å; M2349-P2457 HydrophobicContact CE-CB 3.98Å; M2349-P2457 HydrophobicContact CG-CB 4.19Å
2350	T	75.5	Confident	72.4	Confident	34.25 Å²	34.25	45.4 Å²	45.4	21%	0.21	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	126.4	165	-42.3	0	0	0	0	108	F2348 K2411 L2413 F2455 E2456 K2667	F2348-T2350 HydrophobicContact CD1-CG2 4.04Å; F2348-T2350 HydrophobicContact CE1-CG2 3.16Å; F2348-T2350 HydrophobicContact CE2-CG2 3.88Å; F2348-T2350 HydrophobicContact CZ-CG2 3.09Å; T2350-K2411 HydrophobicContact CG2-CD 3.69Å; T2350-K2411 HydrophobicContact CG2-CG 3.64Å; T2350-L2413 HydrophobicContact CG2-CD1 4.1Å; T2350-F2455 CarbonylContact O-C 3.54Å; T2350-F2455 WeakPolarHBondContact O-CA 3.34Å; T2350-E2456 PolarHBondContact N-O 2.96Å; T2350-E2456 VanDerWaalsContact N-O 3.12Å; T2350-E2456 PolarHBondContact O-N 3Å; T2350-E2456 PolarHBondContact OG1-OE2 3.02Å; T2350-E2456 VanDerWaalsContact OG1-OE2 3.11Å; T2350-K2667 HydrophobicContact CG2-CD 3.67Å; T2350-K2667 PolarHBondContact OG1-NZ 3.22Å
2351	M	81.7	Confident	74.5	Confident	3 Å²	3	41.5 Å²	41.5	2%	0.015	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	160.3	176.1	86.1	175.2	63.8	0	0	111.3	M2349 V2353 F2360 I2362 K2411 I2412 L2414 A2448 V2452 S2454 F2455	M2349-M2351 HydrophobicContact CG-CB 4.44Å; M2349-M2351 HydrophobicContact CG-CE 4.07Å; M2349-M2351 HydrophobicContact SD-CB 4.5Å; M2349-M2351 HydrophobicContact SD-CE 3.48Å; M2349-M2351 VanDerWaalsContact SD-CE 3.5Å; M2349-M2351 WeakPolarHBondContact SD-CE 3.15Å; M2349-M2351 HydrophobicContact SD-SD 4.33Å; M2351-V2353 HydrophobicContact CE-CG2 4.49Å; M2351-V2353 HydrophobicContact SD-CG1 4.42Å; M2351-F2360 HydrophobicContact CE-CD1 4.48Å; M2351-F2360 HydrophobicContact CE-CD2 3.98Å; M2351-F2360 HydrophobicContact CE-CE1 4.17Å; M2351-F2360 HydrophobicContact CE-CE2 3.61Å; M2351-F2360 HydrophobicContact CE-CG 4.26Å; M2351-F2360 HydrophobicContact CE-CZ 3.95Å; M2351-F2360 HydrophobicContact SD-CD2 4.25Å; M2351-F2360 HydrophobicContact SD-CE1 4.25Å; M2351-F2360 HydrophobicContact SD-CE2 3.64Å; M2351-F2360 WeakPolarHBondContact SD-CE2 3.29Å; M2351-F2360 HydrophobicContact SD-CZ 3.95Å; M2351-F2360 VanDerWaalsContact SD-CZ 3.53Å; M2351-I2362 HydrophobicContact CE-CD1 3.76Å; M2351-I2362 HydrophobicContact CE-CG1 3.98Å; M2351-I2362 HydrophobicContact SD-CD1 4.15Å; M2351-I2362 HydrophobicContact SD-CG1 4.4Å; M2351-K2411 CarbonylContact O-C 3.56Å; M2351-K2411 VanDerWaalsContact O-CA 3.24Å; M2351-K2411 WeakPolarHBondContact O-CA 3.47Å; M2351-K2411 WeakPolarHBondContact O-CB 3.44Å; M2351-K2411 WeakPolarHBondContact O-CG 3.33Å; M2351-I2412 HydrophobicContact CE-CB 3.91Å; M2351-I2412 HydrophobicContact CE-CG2 4.33Å; M2351-I2412 HydrophobicContact CG-CB 3.81Å; M2351-I2412 HydrophobicContact CG-CG1 4.44Å; M2351-I2412 PolarHBondContact N-O 3.13Å; M2351-I2412 VanDerWaalsContact N-O 3.12Å; M2351-I2412 PolarHBondContact O-N 2.8Å; M2351-I2412 HydrophobicContact SD-CB 3.97Å; M2351-I2412 HydrophobicContact SD-CD1 4.3Å; M2351-I2412 HydrophobicContact SD-CG1 4.37Å; M2351-L2414 HydrophobicContact CE-CB 4.36Å; M2351-L2414 HydrophobicContact CE-CD1 3.98Å; M2351-L2414 HydrophobicContact CG-CD1 4.25Å; M2351-L2414 HydrophobicContact SD-CD1 3.97Å; M2351-A2448 HydrophobicContact CE-CB 4.47Å; M2351-A2448 HydrophobicContact SD-CB 3.58Å; M2351-A2448 VanDerWaalsContact SD-CB 3.58Å; M2351-V2452 HydrophobicContact CB-CG1 4.32Å; M2351-V2452 HydrophobicContact CG-CG1 3.59Å; M2351-V2452 HydrophobicContact CG-CG2 4.43Å; M2351-V2452 HydrophobicContact SD-CB 4.4Å; M2351-V2452 HydrophobicContact SD-CG1 3.75Å; M2351-V2452 HydrophobicContact SD-CG2 3.68Å; M2351-S2454 CarbonylContact C-O 3.51Å; M2351-S2454 WeakPolarHBondContact CA-O 3.38Å; M2351-S2454 WeakPolarHBondContact CB-O 3.44Å; M2351-S2454 WeakPolarHBondContact CG-O 3.38Å; M2351-F2455 HydrophobicContact CB-CB 3.98Å; M2351-F2455 HydrophobicContact CB-CD2 4.15Å; M2351-F2455 HydrophobicContact CE-CD2 3.85Å; M2351-F2455 HydrophobicContact CE-CE2 3.86Å; M2351-F2455 HydrophobicContact CG-CB 4.04Å; M2351-F2455 HydrophobicContact SD-CB 4.41Å
2352	K	83.6	Confident	76.5	Confident	46.25 Å²	46.25	39.4 Å²	39.4	20%	0.201	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	133.8	163.3	-174.1	171.6	176.4	-132	0	108.9	E2312 D2409 G2410 K2411 V2452 E2453 S2454	E2312-K2352 IonicContact OE1-NZ 3.17Å; E2312-K2352 IonicContact OE2-NZ 3.45Å; E2312-K2352 PolarHBondContact OE2-NZ 2.9Å; K2352-D2409 WeakPolarHBondContact CE-O 3.37Å; K2352-G2410 CarbonylContact C-O 3.59Å; K2352-G2410 VanDerWaalsContact CA-O 3.28Å; K2352-G2410 WeakPolarHBondContact CA-O 3.39Å; K2352-G2410 WeakPolarHBondContact CB-O 3.37Å; K2352-G2410 WeakPolarHBondContact CD-O 3.49Å; K2352-G2410 WeakPolarHBondContact CG-O 3.5Å; K2352-K2411 HydrophobicContact CB-CG 4.18Å; K2352-K2411 HydrophobicContact CG-CG 4.16Å; K2352-V2452 WeakPolarHBondContact O-CG1 3.46Å; K2352-E2453 HydrophobicContact CB-CB 4.34Å; K2352-E2453 WeakPolarHBondContact CB-OE1 3.48Å; K2352-E2453 WeakPolarHBondContact CD-OE1 3.36Å; K2352-E2453 WeakPolarHBondContact CD-OE2 3.4Å; K2352-E2453 WeakPolarHBondContact CE-OE2 3.31Å; K2352-E2453 HydrophobicContact CG-CB 4.17Å; K2352-E2453 VanDerWaalsContact CG-CD 3.42Å; K2352-E2453 HydrophobicContact CG-CG 4.34Å; K2352-E2453 WeakPolarHBondContact CG-OE1 2.87Å; K2352-E2453 VanDerWaalsContact CG-OE2 3.27Å; K2352-E2453 WeakPolarHBondContact CG-OE2 3.19Å; K2352-E2453 IonicContact NZ-OE1 3.29Å; K2352-E2453 PolarHBondContact NZ-OE1 2.87Å; K2352-E2453 IonicContact NZ-OE2 3.53Å; K2352-E2453 PolarHBondContact NZ-OE2 2.95Å; K2352-E2453 WeakPolarHBondContact O-CB 3.34Å; K2352-E2453 PolarHBondContact O-N 2.89Å; K2352-S2454 WeakPolarHBondContact CB-OG 3.43Å; K2352-S2454 PolarHBondContact N-O 2.99Å; K2352-S2454 PolarHBondContact O-N 2.85Å
2353	V	84.7	Confident	78.2	Confident	3 Å²	3	38.6 Å²	38.6	2%	0.018	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	148.6	178.8	-114.2	0	0	0	0	110.2	M2351 A2357 F2360 L2379 M2406 G2410 I2412 D2451	M2351-V2353 HydrophobicContact CE-CG2 4.49Å; M2351-V2353 HydrophobicContact SD-CG1 4.42Å; V2353-A2357 HydrophobicContact CB-CB 4.16Å; V2353-A2357 HydrophobicContact CG1-CB 3.42Å; V2353-A2357 HydrophobicContact CG2-CB 4.18Å; V2353-F2360 HydrophobicContact CG1-CD1 3.85Å; V2353-F2360 VanDerWaalsContact CG1-CD1 3.44Å; V2353-F2360 HydrophobicContact CG1-CE1 3.91Å; V2353-F2360 HydrophobicContact CG1-CG 4.31Å; V2353-F2360 HydrophobicContact CG1-CZ 4.41Å; V2353-F2360 HydrophobicContact CG2-CD1 4.24Å; V2353-F2360 HydrophobicContact CG2-CE1 3.89Å; V2353-F2360 HydrophobicContact CG2-CZ 4.45Å; V2353-L2379 HydrophobicContact CB-CD1 4.47Å; V2353-L2379 HydrophobicContact CG1-CD1 3.94Å; V2353-L2379 HydrophobicContact CG2-CD1 4.42Å; V2353-M2406 HydrophobicContact CB-SD 4.3Å; V2353-M2406 HydrophobicContact CG1-SD 4.33Å; V2353-M2406 HydrophobicContact CG2-CE 3.83Å; V2353-M2406 HydrophobicContact CG2-SD 4.03Å; V2353-G2410 PolarHBondContact N-O 2.87Å; V2353-I2412 HydrophobicContact CG1-CD1 3.94Å; V2353-I2412 HydrophobicContact CG2-CD1 3.88Å; V2353-I2412 HydrophobicContact CG2-CG1 4.16Å; V2353-D2451 WeakPolarHBondContact CA-O 3.28Å; V2353-D2451 WeakPolarHBondContact CG1-O 3.49Å
2354	N	82.3	Confident	79.8	Confident	45.75 Å²	45.75	38.3 Å²	38.3	25%	0.245	20%	0.198	C	C	.	.			trans	-63.2	148.1	179.1	-72.8	-41.4	0	0	0	111.3	H2305 K2314 N2356 A2357 D2451 V2452 E2453	H2305-N2354 PolarHBondContact CE1-ND2 2.83Å; K2314-N2354 WeakPolarHBondContact CE-OD1 3.48Å; N2354-N2356 PolarHBondContact O-N 3.02Å; N2354-N2356 VanDerWaalsContact O-N 3.09Å; N2354-A2357 HydrophobicContact CB-CB 4.38Å; N2354-A2357 VanDerWaalsContact O-CB 3.22Å; N2354-A2357 WeakPolarHBondContact O-CB 3.28Å; N2354-A2357 PolarHBondContact O-N 3.04Å; N2354-D2451 HydrophobicContact CB-CB 4.48Å; N2354-D2451 PolarHBondContact N-O 3.12Å; N2354-D2451 VanDerWaalsContact ND2-C 3.33Å; N2354-D2451 PolarHBondContact ND2-O 3.42Å; N2354-V2452 PolarHBondContact ND2-O 3.2Å; N2354-E2453 WeakPolarHBondContact OD1-CA 3.22Å; N2354-E2453 WeakPolarHBondContact OD1-CB 3.27Å; N2354-E2453 PolarHBondContact OD1-N 2.8Å
2355	P	75.2	Confident	80.9	Confident	112.5 Å²	112.5	39.8 Å²	39.8	73%	0.731	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-28.3	-176.1	-28.9	36	0	0	0	115.8
2356	N	79.8	Confident	81.8	Confident	151 Å²	151	39.8 Å²	39.8	81%	0.807	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-111.8	25.6	179.6	-65.1	-31.5	0	0	0	112.7	N2354 K2358	N2354-N2356 PolarHBondContact O-N 3.02Å; N2354-N2356 VanDerWaalsContact O-N 3.09Å; N2356-K2358 PolarHBondContact O-N 3.24Å
2357	A	80.9	Confident	81.8	Confident	15.25 Å²	15.25	40.7 Å²	40.7	13%	0.126	21%	0.209	C	C	.	.			trans	-61.5	136.2	-175.5	0	0	0	0	0	113.3	V2353 N2354 L2379 D2451	V2353-A2357 HydrophobicContact CB-CB 4.16Å; V2353-A2357 HydrophobicContact CG1-CB 3.42Å; V2353-A2357 HydrophobicContact CG2-CB 4.18Å; N2354-A2357 HydrophobicContact CB-CB 4.38Å; N2354-A2357 VanDerWaalsContact O-CB 3.22Å; N2354-A2357 WeakPolarHBondContact O-CB 3.28Å; N2354-A2357 PolarHBondContact O-N 3.04Å; A2357-L2379 HydrophobicContact CB-CD1 3.56Å; A2357-L2379 VanDerWaalsContact O-CB 3.29Å; A2357-L2379 WeakPolarHBondContact O-CB 3.19Å; A2357-D2451 HydrophobicContact CB-CB 3.4Å; A2357-D2451 VanDerWaalsContact CB-CB 3.43Å
2358	K	85.6	Confident	81.5	Confident	160.25 Å²	160.25	46 Å²	46	70%	0.697	23%	0.234	S	C	*	.			trans	-110.2	-35.9	176.4	-62.3	179	-178.4	177	0	111.9	N2356 Q2378 L2379 D2451	N2356-K2358 PolarHBondContact O-N 3.24Å; K2358-Q2378 CarbonylContact O-C 3.48Å; K2358-Q2378 WeakPolarHBondContact O-CA 3.43Å; K2358-L2379 PolarHBondContact O-N 2.96Å; K2358-D2451 WeakPolarHBondContact CA-OD2 3.41Å; K2358-D2451 PolarHBondContact N-OD2 2.89Å
2359	K	89.1	Confident	80.9	Confident	99.5 Å²	99.5	49.7 Å²	49.7	43%	0.433	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	149.2	178.8	59.2	173.2	-178.5	171	0	113.6	I2309 A2377 D2451	I2309-K2359 HydrophobicContact CD1-CD 4.17Å; I2309-K2359 VanDerWaalsContact CD1-CE 3.43Å; I2309-K2359 HydrophobicContact CD1-CG 4.47Å; K2359-A2377 CarbonylContact C-O 3.51Å; K2359-A2377 VanDerWaalsContact CA-O 3.26Å; K2359-A2377 WeakPolarHBondContact CA-O 3.42Å; K2359-A2377 WeakPolarHBondContact CB-O 3.43Å; K2359-D2451 PolarHBondContact N-OD2 2.99Å; K2359-D2451 WeakPolarHBondContact O-CB 3.31Å; K2359-D2451 VanDerWaalsContact O-CG 3.29Å; K2359-D2451 PolarHBondContact O-N 2.83Å; K2359-D2451 VanDerWaalsContact O-OD2 3.1Å
2360	F	88.8	Confident	80.6	Confident	0 Å²	0	55 Å²	55	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	166.5	165.7	63.1	-94.4	0	0	0	111.2	M2351 V2353 I2362 D2376 A2377 L2379 W2384 I2412 L2449 V2452	M2351-F2360 HydrophobicContact CE-CD1 4.48Å; M2351-F2360 HydrophobicContact CE-CD2 3.98Å; M2351-F2360 HydrophobicContact CE-CE1 4.17Å; M2351-F2360 HydrophobicContact CE-CE2 3.61Å; M2351-F2360 HydrophobicContact CE-CG 4.26Å; M2351-F2360 HydrophobicContact CE-CZ 3.95Å; M2351-F2360 HydrophobicContact SD-CD2 4.25Å; M2351-F2360 HydrophobicContact SD-CE1 4.25Å; M2351-F2360 HydrophobicContact SD-CE2 3.64Å; M2351-F2360 WeakPolarHBondContact SD-CE2 3.29Å; M2351-F2360 HydrophobicContact SD-CZ 3.95Å; M2351-F2360 VanDerWaalsContact SD-CZ 3.53Å; V2353-F2360 HydrophobicContact CG1-CD1 3.85Å; V2353-F2360 VanDerWaalsContact CG1-CD1 3.44Å; V2353-F2360 HydrophobicContact CG1-CE1 3.91Å; V2353-F2360 HydrophobicContact CG1-CG 4.31Å; V2353-F2360 HydrophobicContact CG1-CZ 4.41Å; V2353-F2360 HydrophobicContact CG2-CD1 4.24Å; V2353-F2360 HydrophobicContact CG2-CE1 3.89Å; V2353-F2360 HydrophobicContact CG2-CZ 4.45Å; F2360-I2362 HydrophobicContact CD2-CD1 4.18Å; F2360-I2362 HydrophobicContact CD2-CG1 4.36Å; F2360-I2362 HydrophobicContact CE2-CD1 4.09Å; F2360-I2362 HydrophobicContact CE2-CG1 4.29Å; F2360-D2376 CarbonylContact O-C 3.57Å; F2360-D2376 WeakPolarHBondContact O-CA 3.44Å; F2360-A2377 HydrophobicContact CD1-CB 4.08Å; F2360-A2377 HydrophobicContact CD2-CB 4.01Å; F2360-A2377 HydrophobicContact CE1-CB 3.62Å; F2360-A2377 VanDerWaalsContact CE1-CB 3.49Å; F2360-A2377 HydrophobicContact CE2-CB 3.53Å; F2360-A2377 HydrophobicContact CG-CB 4.17Å; F2360-A2377 HydrophobicContact CZ-CB 3.31Å; F2360-A2377 PolarHBondContact N-O 2.77Å; F2360-A2377 PolarHBondContact O-N 2.93Å; F2360-L2379 HydrophobicContact CD1-CD1 4.2Å; F2360-L2379 HydrophobicContact CE1-CD1 4.07Å; F2360-L2379 HydrophobicContact CE1-CG 4.41Å; F2360-W2384 AromaticContact CE2-CH2 3.82Å; F2360-W2384 HydrophobicContact CE2-CH2 3.89Å; F2360-W2384 AromaticContact CE2-CZ3 3.74Å; F2360-W2384 HydrophobicContact CE2-CZ3 3.81Å; F2360-W2384 AromaticContact CZ-CH2 3.57Å; F2360-W2384 HydrophobicContact CZ-CH2 3.57Å; F2360-W2384 HydrophobicContact CZ-CZ2 4.31Å; F2360-W2384 AromaticContact CZ-CZ3 3.88Å; F2360-W2384 HydrophobicContact CZ-CZ3 3.91Å; F2360-I2412 HydrophobicContact CE1-CD1 3.86Å; F2360-I2412 HydrophobicContact CE2-CD1 4.08Å; F2360-I2412 HydrophobicContact CZ-CD1 3.54Å; F2360-L2449 CarbonylContact C-O 3.49Å; F2360-L2449 VanDerWaalsContact CA-O 3.25Å; F2360-L2449 WeakPolarHBondContact CA-O 3.32Å; F2360-L2449 VanDerWaalsContact CB-O 3.31Å; F2360-L2449 WeakPolarHBondContact CB-O 3.42Å; F2360-V2452 HydrophobicContact CB-CG2 3.52Å; F2360-V2452 HydrophobicContact CD1-CG2 4.49Å; F2360-V2452 HydrophobicContact CD2-CG2 4.29Å; F2360-V2452 HydrophobicContact CG-CG2 3.99Å
2361	H	88.8	Confident	80.8	Confident	36 Å²	36	54.1 Å²	54.1	17%	0.167	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	124.1	-174.3	-52.8	-89.2	0	0	0	109.3	I2309 I2374 D2376 A2448 L2449	I2309-H2361 WeakPolarHBondContact CG2-NE2 3.49Å; H2361-I2374 HydrophobicContact CB-CG2 4.29Å; H2361-D2376 IonicContact CE1-OD1 3.2Å; H2361-D2376 IonicContact CG-OD1 3.42Å; H2361-D2376 IonicContact ND1-OD1 3.01Å; H2361-D2376 PolarHBondContact ND1-OD1 3.15Å; H2361-A2448 CarbonylContact O-C 3.53Å; H2361-A2448 VanDerWaalsContact O-CA 3.28Å; H2361-A2448 WeakPolarHBondContact O-CA 3.32Å; H2361-L2449 HydrophobicContact CB-CB 4.4Å; H2361-L2449 PolarHBondContact N-O 3.01Å; H2361-L2449 PolarHBondContact O-N 2.91Å
2362	I	89.5	Confident	81.1	Confident	0.5 Å²	0.5	54 Å²	54	0%	0.003	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	114.9	171	-56.8	150.5	0	0	0	107.7	M2349 M2351 F2360 W2373 I2374 L2375 W2384 L2414 V2446 I2447 A2448 F2455	M2349-I2362 HydrophobicContact CE-CG2 4.08Å; M2349-I2362 HydrophobicContact SD-CD1 4.41Å; M2349-I2362 HydrophobicContact SD-CG1 4.35Å; M2349-I2362 HydrophobicContact SD-CG2 3.97Å; M2351-I2362 HydrophobicContact CE-CD1 3.76Å; M2351-I2362 HydrophobicContact CE-CG1 3.98Å; M2351-I2362 HydrophobicContact SD-CD1 4.15Å; M2351-I2362 HydrophobicContact SD-CG1 4.4Å; F2360-I2362 HydrophobicContact CD2-CD1 4.18Å; F2360-I2362 HydrophobicContact CD2-CG1 4.36Å; F2360-I2362 HydrophobicContact CE2-CD1 4.09Å; F2360-I2362 HydrophobicContact CE2-CG1 4.29Å; I2362-W2373 HydrophobicContact CB-CZ3 4.31Å; I2362-W2373 HydrophobicContact CG2-CH2 4.1Å; I2362-W2373 HydrophobicContact CG2-CZ3 3.98Å; I2362-W2373 WeakPolarHBondContact O-CZ3 3.24Å; I2362-I2374 CarbonylContact O-C 3.55Å; I2362-I2374 VanDerWaalsContact O-CA 3.28Å; I2362-I2374 WeakPolarHBondContact O-CA 3.31Å; I2362-L2375 HydrophobicContact CB-CB 4.35Å; I2362-L2375 HydrophobicContact CD1-CB 4.38Å; I2362-L2375 HydrophobicContact CD1-CD2 4.27Å; I2362-L2375 HydrophobicContact CD1-CG 4.31Å; I2362-L2375 PolarHBondContact N-O 3.14Å; I2362-L2375 PolarHBondContact O-N 2.96Å; I2362-W2384 HydrophobicContact CD1-CH2 4.42Å; I2362-W2384 HydrophobicContact CD1-CZ3 4.1Å; I2362-L2414 HydrophobicContact CD1-CD1 3.93Å; I2362-L2414 HydrophobicContact CD1-CD2 3.86Å; I2362-L2414 HydrophobicContact CD1-CG 4.42Å; I2362-L2414 HydrophobicContact CG1-CD2 4.44Å; I2362-L2414 HydrophobicContact CG2-CD2 4.19Å; I2362-V2446 HydrophobicContact CG2-CG1 4.05Å; I2362-I2447 CarbonylContact C-O 3.54Å; I2362-I2447 WeakPolarHBondContact CA-O 3.41Å; I2362-A2448 HydrophobicContact CG1-CB 4.44Å; I2362-F2455 HydrophobicContact CG2-CZ 4.18Å
2363	V	87.7	Confident	81.5	Confident	18.75 Å²	18.75	51.9 Å²	51.9	11%	0.114	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	131	179.1	-177	0	0	0	0	109.1	W2317 W2373 I2374 V2446 I2447 L2449	W2317-V2363 HydrophobicContact CZ2-CG1 4.36Å; V2363-W2373 WeakPolarHBondContact CA-O 3.12Å; V2363-I2374 HydrophobicContact CB-CG1 4.48Å; V2363-I2374 HydrophobicContact CG1-CD1 4.46Å; V2363-I2374 HydrophobicContact CG1-CG1 4.22Å; V2363-I2374 HydrophobicContact CG2-CD1 4.14Å; V2363-I2374 HydrophobicContact CG2-CG1 4.05Å; V2363-I2374 HydrophobicContact CG2-CG2 4.13Å; V2363-V2446 CarbonylContact O-C 3.2Å; V2363-V2446 WeakPolarHBondContact O-CA 3.21Å; V2363-I2447 HydrophobicContact CB-CD1 4.34Å; V2363-I2447 HydrophobicContact CB-CG1 3.85Å; V2363-I2447 HydrophobicContact CB-CG2 3.86Å; V2363-I2447 PolarHBondContact N-O 2.88Å; V2363-I2447 PolarHBondContact O-N 3.14Å; V2363-L2449 HydrophobicContact CG2-CD1 4.07Å
2364	A	86.9	Confident	81.7	Confident	0.5 Å²	0.5	52.3 Å²	52.3	0%	0.004	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	123.7	171.3	0	0	0	0	0	111	G2372 W2373 N2445 V2446	A2364-G2372 CarbonylContact O-C 3.53Å; A2364-G2372 WeakPolarHBondContact O-CA 3.24Å; A2364-W2373 HydrophobicContact CB-CD2 3.85Å; A2364-W2373 HydrophobicContact CB-CE3 4.33Å; A2364-W2373 HydrophobicContact CB-CG 4.31Å; A2364-W2373 HydrophobicContact CB-CH2 4.08Å; A2364-W2373 HydrophobicContact CB-CZ2 3.51Å; A2364-W2373 VanDerWaalsContact CB-CZ2 3.46Å; A2364-W2373 HydrophobicContact CB-CZ3 4.38Å; A2364-W2373 PolarHBondContact N-O 2.96Å; A2364-W2373 PolarHBondContact O-N 3.22Å; A2364-W2373 VanDerWaalsContact O-N 3.14Å; A2364-N2445 VanDerWaalsContact CA-O 3.26Å; A2364-N2445 WeakPolarHBondContact CA-O 3.32Å; A2364-V2446 HydrophobicContact CB-CG1 4.3Å; A2364-V2446 HydrophobicContact CB-CG2 4.22Å
2365	E	83.4	Confident	82.1	Confident	42.75 Å²	42.75	50.2 Å²	50.2	20%	0.2	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	139.9	175.1	-60.2	175.1	174.2	0	0	110.1	W2317 Y2323 V2443 R2444 N2445	W2317-E2365 HydrophobicContact CH2-CB 4.42Å; W2317-E2365 HydrophobicContact CH2-CG 4.05Å; W2317-E2365 HydrophobicContact CZ2-CG 4.36Å; W2317-E2365 HydrophobicContact CZ3-CG 4.3Å; Y2323-E2365 PolarHBondContact OH-OE2 2.89Å; E2365-V2443 CarbonylContact O-C 3.54Å; E2365-R2444 HydrophobicContact CB-CB 4.11Å; E2365-R2444 PolarHBondContact O-N 2.9Å; E2365-N2445 HydrophobicContact CB-CB 4.14Å; E2365-N2445 HydrophobicContact CG-CB 4.24Å; E2365-N2445 PolarHBondContact N-O 2.76Å; E2365-N2445 VanDerWaalsContact N-O 3.07Å; E2365-N2445 PolarHBondContact O-N 2.94Å; E2365-N2445 VanDerWaalsContact OE1-CB 3.27Å; E2365-N2445 WeakPolarHBondContact OE1-CB 3.29Å; E2365-N2445 PolarHBondContact OE1-ND2 2.86Å; E2365-N2445 WeakPolarHBondContact OE2-CB 3.24Å; E2365-N2445 PolarHBondContact OE2-ND2 3.24Å
2366	M	81.7	Confident	82.8	Confident	0.75 Å²	0.75	45.3 Å²	45.3	0%	0.004	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	169.3	-177.9	-56	-118.9	-15.3	0	0	112.6	E2368 I2371 L2423 L2438 A2440 I2442 V2443 R2444	M2366-E2368 VanDerWaalsContact C-N 3.31Å; M2366-E2368 PolarHBondContact O-N 2.98Å; M2366-I2371 WeakPolarHBondContact CB-O 3.41Å; M2366-I2371 PolarHBondContact N-O 2.93Å; M2366-I2371 WeakPolarHBondContact O-CB 3.38Å; M2366-I2371 VanDerWaalsContact O-O 3.09Å; M2366-L2423 HydrophobicContact CE-CD1 4.36Å; M2366-L2423 HydrophobicContact SD-CD2 4.01Å; M2366-L2438 HydrophobicContact CE-CB 3.94Å; M2366-L2438 HydrophobicContact CE-CD1 3.71Å; M2366-L2438 HydrophobicContact CE-CG 4.48Å; M2366-L2438 HydrophobicContact CG-CD1 4.11Å; M2366-L2438 HydrophobicContact SD-CD1 3.66Å; M2366-A2440 HydrophobicContact CB-CB 3.56Å; M2366-A2440 HydrophobicContact CE-CB 4.14Å; M2366-A2440 VanDerWaalsContact CE-O 3.32Å; M2366-A2440 WeakPolarHBondContact CE-O 3.21Å; M2366-A2440 HydrophobicContact CG-CB 4.15Å; M2366-I2442 CarbonylContact C-O 3.57Å; M2366-I2442 VanDerWaalsContact CA-O 3.29Å; M2366-I2442 WeakPolarHBondContact CA-O 3.37Å; M2366-I2442 WeakPolarHBondContact CE-O 3.48Å; M2366-V2443 HydrophobicContact CE-CG2 4.17Å; M2366-V2443 HydrophobicContact CG-CG2 4.38Å; M2366-V2443 HydrophobicContact SD-CB 4.43Å; M2366-V2443 HydrophobicContact SD-CG2 4.05Å; M2366-R2444 VanDerWaalsContact O-CD 3.28Å; M2366-R2444 WeakPolarHBondContact O-CD 3.37Å; M2366-R2444 WeakPolarHBondContact O-CG 3.35Å; M2366-R2444 PolarHBondContact O-NE 3.03Å; M2366-R2444 PolarHBondContact O-NH1 2.91Å
2367	D	68.7	Low	83.3	Confident	42 Å²	42	38.1 Å²	38.1	23%	0.225	18%	0.177	C	C	.	.	S	Bend	trans	-22.9	-41.3	-176.4	-13.1	4.2	0	0	0	116.4	A2440 T2441 I2442 R2444	D2367-A2440 HydrophobicContact CB-CB 3.58Å; D2367-A2440 VanDerWaalsContact CG-CA 3.41Å; D2367-A2440 VanDerWaalsContact CG-CB 3.4Å; D2367-A2440 WeakPolarHBondContact OD1-CA 3.13Å; D2367-A2440 WeakPolarHBondContact OD1-CB 3.44Å; D2367-A2440 VanDerWaalsContact OD2-CA 3.23Å; D2367-A2440 WeakPolarHBondContact OD2-CA 3.15Å; D2367-T2441 PolarHBondContact OD1-N 2.9Å; D2367-T2441 PolarHBondContact OD2-N 3.05Å; D2367-T2441 PolarHBondContact OD2-OG1 3.44Å; D2367-I2442 HydrophobicContact CB-CB 3.88Å; D2367-I2442 HydrophobicContact CB-CD1 4.23Å; D2367-I2442 HydrophobicContact CB-CG1 4.33Å; D2367-I2442 WeakPolarHBondContact CB-O 3.28Å; D2367-I2442 PolarHBondContact N-O 3.03Å; D2367-I2442 WeakPolarHBondContact OD1-CA 3.39Å; D2367-I2442 WeakPolarHBondContact OD1-CB 3.25Å; D2367-I2442 PolarHBondContact OD1-N 2.69Å; D2367-I2442 VanDerWaalsContact OD1-O 3.13Å; D2367-I2442 WeakPolarHBondContact OD2-CB 3.45Å; D2367-I2442 WeakPolarHBondContact OD2-CG1 3.41Å; D2367-I2442 PolarHBondContact OD2-N 3.13Å; D2367-R2444 VanDerWaalsContact C-CZ 3.48Å; D2367-R2444 PolarHBondContact O-NE 2.77Å; D2367-R2444 PolarHBondContact O-NH1 3.33Å; D2367-R2444 PolarHBondContact O-NH2 2.71Å
2368	E	67	Low	83.7	Confident	111.5 Å²	111.5	42.3 Å²	42.3	52%	0.521	19%	0.194	S	C	.	.	S	Bend	trans	-108.8	150.4	176.2	-64	-165.3	169	0	0	112.4	M2366 K2370 I2371 A2440	M2366-E2368 VanDerWaalsContact C-N 3.31Å; M2366-E2368 PolarHBondContact O-N 2.98Å; E2368-K2370 PolarHBondContact O-N 3.11Å; E2368-I2371 HydrophobicContact CB-CB 4.13Å; E2368-I2371 HydrophobicContact CB-CD1 3.93Å; E2368-I2371 HydrophobicContact CB-CG1 3.96Å; E2368-I2371 PolarHBondContact O-N 2.88Å; E2368-I2371 VanDerWaalsContact O-N 3.12Å; E2368-I2371 WeakPolarHBondContact OE2-CD1 3.48Å; E2368-A2440 HydrophobicContact CB-CB 4.18Å; E2368-A2440 HydrophobicContact CG-CB 4.06Å
2369	K	59.8	Low	83.5	Confident	119.75 Å²	119.75	35.7 Å²	35.7	52%	0.521	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	68.8	-175	-80.6	-177.1	174.5	175.3	0	113.2	E2319 I2371 V2664 E2666	E2319-K2369 IonicContact OE1-NZ 2.72Å; E2319-K2369 PolarHBondContact OE1-NZ 2.69Å; K2369-I2371 PolarHBondContact O-N 2.84Å; K2369-V2664 VanDerWaalsContact NZ-CG1 3.33Å; K2369-E2666 IonicContact NZ-OE1 3.35Å; K2369-E2666 PolarHBondContact NZ-OE1 2.81Å
2370	K	71.1	Confident	82.8	Confident	111.5 Å²	111.5	36.3 Å²	36.3	49%	0.485	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	142.7	15.1	-177.4	-52.2	-174.5	179.1	-177.4	0	114.1	W2317 E2368 V2389 I2390 D2391 G2392	W2317-K2370 VanDerWaalsContact CE3-N 3.35Å; W2317-K2370 VanDerWaalsContact CZ3-N 3.25Å; E2368-K2370 PolarHBondContact O-N 3.11Å; K2370-V2389 CarbonylContact O-C 3.57Å; K2370-I2390 CarbonylContact O-C 3.53Å; K2370-I2390 WeakPolarHBondContact O-CA 3.37Å; K2370-D2391 VanDerWaalsContact CB-CA 3.5Å; K2370-D2391 WeakPolarHBondContact CD-O 3.41Å; K2370-D2391 PolarHBondContact NZ-O 3.2Å; K2370-D2391 VanDerWaalsContact NZ-O 3.15Å; K2370-D2391 PolarHBondContact O-N 3Å; K2370-D2391 VanDerWaalsContact O-N 3.09Å; K2370-G2392 VanDerWaalsContact CB-N 3.29Å; K2370-G2392 PolarHBondContact O-N 3.1Å
2371	I	80.5	Confident	82.3	Confident	15.5 Å²	15.5	42.5 Å²	42.5	8%	0.079	21%	0.21	C	C	.	.			trans	-112.3	132.8	176.2	-54.2	-172.6	0	0	0	109.6	M2366 E2368 K2369 V2389 I2390 L2438 P2439 A2440	M2366-I2371 WeakPolarHBondContact CB-O 3.41Å; M2366-I2371 PolarHBondContact N-O 2.93Å; M2366-I2371 WeakPolarHBondContact O-CB 3.38Å; M2366-I2371 VanDerWaalsContact O-O 3.09Å; E2368-I2371 HydrophobicContact CB-CB 4.13Å; E2368-I2371 HydrophobicContact CB-CD1 3.93Å; E2368-I2371 HydrophobicContact CB-CG1 3.96Å; E2368-I2371 PolarHBondContact O-N 2.88Å; E2368-I2371 VanDerWaalsContact O-N 3.12Å; E2368-I2371 WeakPolarHBondContact OE2-CD1 3.48Å; K2369-I2371 PolarHBondContact O-N 2.84Å; I2371-V2389 CarbonylContact C-O 3.49Å; I2371-V2389 VanDerWaalsContact CA-O 3.31Å; I2371-V2389 WeakPolarHBondContact CA-O 3.33Å; I2371-I2390 HydrophobicContact CD1-CG2 4.17Å; I2371-I2390 HydrophobicContact CG1-CG2 4.37Å; I2371-I2390 HydrophobicContact CG2-CG1 4.45Å; I2371-L2438 HydrophobicContact CG2-CB 4.32Å; I2371-L2438 HydrophobicContact CG2-CD1 4.31Å; I2371-L2438 HydrophobicContact CG2-CD2 4.1Å; I2371-L2438 HydrophobicContact CG2-CG 4.41Å; I2371-P2439 HydrophobicContact CD1-CG 3.76Å; I2371-P2439 HydrophobicContact CG1-CG 4.47Å; I2371-P2439 HydrophobicContact CG2-CG 4.19Å; I2371-A2440 HydrophobicContact CB-CB 4.32Å; I2371-A2440 HydrophobicContact CG2-CB 3.67Å
2372	G	88.1	Confident	81.9	Confident	2 Å²	2	41.3 Å²	41.3	2%	0.021	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.1	-171.7	-176.4	0	0	0	0	0	113.5	A2364 T2388 V2389 L2438	A2364-G2372 CarbonylContact O-C 3.53Å; A2364-G2372 WeakPolarHBondContact O-CA 3.24Å; G2372-T2388 WeakPolarHBondContact O-CA 3.36Å; G2372-V2389 PolarHBondContact N-O 3.11Å; G2372-V2389 PolarHBondContact O-N 3.08Å; G2372-L2438 WeakPolarHBondContact O-CD2 3.48Å
2373	W	90.8	Very high	81.9	Confident	0.5 Å²	0.5	43.1 Å²	43.1	0%	0.002	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	154.8	171.9	56.5	-90.9	0	0	0	111.1	I2347 M2349 I2362 V2363 A2364 L2375 L2386 R2387 L2414 T2416 L2423 F2425 L2438	I2347-W2373 HydrophobicContact CD1-CZ2 3.79Å; M2349-W2373 HydrophobicContact CE-CH2 4.11Å; M2349-W2373 HydrophobicContact SD-CH2 4.4Å; I2362-W2373 HydrophobicContact CB-CZ3 4.31Å; I2362-W2373 HydrophobicContact CG2-CH2 4.1Å; I2362-W2373 HydrophobicContact CG2-CZ3 3.98Å; I2362-W2373 WeakPolarHBondContact O-CZ3 3.24Å; V2363-W2373 WeakPolarHBondContact CA-O 3.12Å; A2364-W2373 HydrophobicContact CB-CD2 3.85Å; A2364-W2373 HydrophobicContact CB-CE3 4.33Å; A2364-W2373 HydrophobicContact CB-CG 4.31Å; A2364-W2373 HydrophobicContact CB-CH2 4.08Å; A2364-W2373 HydrophobicContact CB-CZ2 3.51Å; A2364-W2373 VanDerWaalsContact CB-CZ2 3.46Å; A2364-W2373 HydrophobicContact CB-CZ3 4.38Å; A2364-W2373 PolarHBondContact N-O 2.96Å; A2364-W2373 PolarHBondContact O-N 3.22Å; A2364-W2373 VanDerWaalsContact O-N 3.14Å; W2373-L2375 HydrophobicContact CE3-CB 4.04Å; W2373-L2375 HydrophobicContact CZ3-CB 3.87Å; W2373-L2386 HydrophobicContact CB-CD1 4.2Å; W2373-L2386 HydrophobicContact CE3-CD1 4.4Å; W2373-R2387 CarbonylContact C-O 3.55Å; W2373-R2387 VanDerWaalsContact CA-O 3.29Å; W2373-R2387 WeakPolarHBondContact CA-O 3.32Å; W2373-R2387 WeakPolarHBondContact CB-O 3.39Å; W2373-L2414 HydrophobicContact CH2-CD2 4.11Å; W2373-T2416 HydrophobicContact CZ2-CG2 4.04Å; W2373-L2423 HydrophobicContact CB-CD1 4.26Å; W2373-L2423 VanDerWaalsContact CD1-CD2 3.42Å; W2373-L2423 HydrophobicContact CD2-CD1 4.12Å; W2373-L2423 HydrophobicContact CG-CD1 3.64Å; W2373-L2423 HydrophobicContact CG-CD2 4.27Å; W2373-F2425 HydrophobicContact CD2-CE1 4.23Å; W2373-F2425 AromaticContact CD2-CZ 3.96Å; W2373-F2425 HydrophobicContact CD2-CZ 4.04Å; W2373-F2425 AromaticContact CE3-CE1 3.8Å; W2373-F2425 HydrophobicContact CE3-CE1 3.94Å; W2373-F2425 AromaticContact CE3-CZ 3.99Å; W2373-F2425 HydrophobicContact CE3-CZ 4.04Å; W2373-F2425 HydrophobicContact CG-CZ 4.47Å; W2373-F2425 AromaticContact CH2-CE1 3.72Å; W2373-F2425 HydrophobicContact CH2-CE1 3.72Å; W2373-F2425 HydrophobicContact CH2-CZ 4.38Å; W2373-F2425 AromaticContact CZ2-CE1 3.95Å; W2373-F2425 HydrophobicContact CZ2-CE1 3.97Å; W2373-F2425 HydrophobicContact CZ2-CZ 4.37Å; W2373-F2425 AromaticContact CZ3-CE1 3.7Å; W2373-F2425 HydrophobicContact CZ3-CE1 3.7Å; W2373-F2425 HydrophobicContact CZ3-CZ 4.28Å; W2373-L2438 HydrophobicContact CB-CD1 4.3Å; W2373-L2438 HydrophobicContact CG-CD1 4.4Å
2374	I	90.2	Very high	81.9	Confident	12.5 Å²	12.5	42.3 Å²	42.3	6%	0.064	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	129.2	175.1	-52.6	-174.2	0	0	0	107.6	I2313 H2361 I2362 V2363 D2376 L2386 R2387 V2389 F2394	I2313-I2374 HydrophobicContact CD1-CD1 4.36Å; I2313-I2374 HydrophobicContact CG2-CD1 3.84Å; H2361-I2374 HydrophobicContact CB-CG2 4.29Å; I2362-I2374 CarbonylContact O-C 3.55Å; I2362-I2374 VanDerWaalsContact O-CA 3.28Å; I2362-I2374 WeakPolarHBondContact O-CA 3.31Å; V2363-I2374 HydrophobicContact CB-CG1 4.48Å; V2363-I2374 HydrophobicContact CG1-CD1 4.46Å; V2363-I2374 HydrophobicContact CG1-CG1 4.22Å; V2363-I2374 HydrophobicContact CG2-CD1 4.14Å; V2363-I2374 HydrophobicContact CG2-CG1 4.05Å; V2363-I2374 HydrophobicContact CG2-CG2 4.13Å; I2374-D2376 VanDerWaalsContact CG2-OD1 3.27Å; I2374-D2376 WeakPolarHBondContact CG2-OD1 3.43Å; I2374-L2386 CarbonylContact O-C 3.58Å; I2374-L2386 WeakPolarHBondContact O-CA 3.21Å; I2374-R2387 HydrophobicContact CB-CB 4.42Å; I2374-R2387 PolarHBondContact N-O 2.98Å; I2374-R2387 PolarHBondContact O-N 3.23Å; I2374-V2389 HydrophobicContact CD1-CG2 4.14Å; I2374-V2389 HydrophobicContact CG1-CG2 4.13Å; I2374-F2394 HydrophobicContact CD1-CD1 4.23Å; I2374-F2394 HydrophobicContact CD1-CE1 3.7Å
2375	L	91	Very high	82.1	Confident	0.25 Å²	0.25	43.1 Å²	43.1	0%	0.001	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	98.1	170.6	-179.9	61.7	0	0	0	107.6	I2362 W2373 W2384 L2386 L2414 F2425 I2427 L2434	I2362-L2375 HydrophobicContact CB-CB 4.35Å; I2362-L2375 HydrophobicContact CD1-CB 4.38Å; I2362-L2375 HydrophobicContact CD1-CD2 4.27Å; I2362-L2375 HydrophobicContact CD1-CG 4.31Å; I2362-L2375 PolarHBondContact N-O 3.14Å; I2362-L2375 PolarHBondContact O-N 2.96Å; W2373-L2375 HydrophobicContact CE3-CB 4.04Å; W2373-L2375 HydrophobicContact CZ3-CB 3.87Å; L2375-W2384 HydrophobicContact CD1-CB 4.23Å; L2375-W2384 HydrophobicContact CD1-CD2 4.46Å; L2375-W2384 HydrophobicContact CD1-CE3 3.98Å; L2375-W2384 HydrophobicContact CD1-CZ3 4.44Å; L2375-W2384 HydrophobicContact CD2-CE3 3.9Å; L2375-W2384 HydrophobicContact CD2-CZ3 4.02Å; L2375-W2384 HydrophobicContact CG-CE3 3.71Å; L2375-W2384 HydrophobicContact CG-CZ3 4.11Å; L2375-L2386 HydrophobicContact CB-CD1 4.5Å; L2375-L2386 HydrophobicContact CD1-CB 4.36Å; L2375-L2414 HydrophobicContact CD2-CD1 4.24Å; L2375-L2414 HydrophobicContact CD2-CD2 3.96Å; L2375-F2425 HydrophobicContact CD2-CD1 3.88Å; L2375-F2425 HydrophobicContact CD2-CE1 4.16Å; L2375-F2425 HydrophobicContact CD2-CG 4.4Å; L2375-I2427 HydrophobicContact CD2-CD1 4.36Å; L2375-L2434 HydrophobicContact CD1-CD1 3.85Å
2376	D	90	Very high	82.5	Confident	10.25 Å²	10.25	41.1 Å²	41.1	6%	0.055	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	149.3	172.5	-50.1	-39	0	0	0	109.5	F2360 H2361 I2374 W2384 V2385 R2387	F2360-D2376 CarbonylContact O-C 3.57Å; F2360-D2376 WeakPolarHBondContact O-CA 3.44Å; H2361-D2376 IonicContact CE1-OD1 3.2Å; H2361-D2376 IonicContact CG-OD1 3.42Å; H2361-D2376 IonicContact ND1-OD1 3.01Å; H2361-D2376 PolarHBondContact ND1-OD1 3.15Å; I2374-D2376 VanDerWaalsContact CG2-OD1 3.27Å; I2374-D2376 WeakPolarHBondContact CG2-OD1 3.43Å; D2376-W2384 CarbonylContact O-C 3.56Å; D2376-W2384 VanDerWaalsContact O-CA 3.26Å; D2376-W2384 WeakPolarHBondContact O-CA 3.33Å; D2376-V2385 HydrophobicContact CB-CB 4.16Å; D2376-V2385 PolarHBondContact N-O 3.01Å; D2376-V2385 PolarHBondContact O-N 2.99Å; D2376-R2387 IonicContact OD1-NE 3.15Å; D2376-R2387 IonicContact OD1-NH1 4Å; D2376-R2387 IonicContact OD2-CZ 3.49Å; D2376-R2387 IonicContact OD2-NE 3.21Å; D2376-R2387 PolarHBondContact OD2-NE 2.91Å; D2376-R2387 IonicContact OD2-NH1 2.63Å; D2376-R2387 PolarHBondContact OD2-NH1 3.47Å; D2376-R2387 IonicContact OD2-NH2 3.38Å; D2376-R2387 PolarHBondContact OD2-NH2 3.12Å
2377	A	89	Confident	83	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.008	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	137.6	168.2	0	0	0	0	0	110.6	K2359 F2360 H2383 W2384	K2359-A2377 CarbonylContact C-O 3.51Å; K2359-A2377 VanDerWaalsContact CA-O 3.26Å; K2359-A2377 WeakPolarHBondContact CA-O 3.42Å; K2359-A2377 WeakPolarHBondContact CB-O 3.43Å; F2360-A2377 HydrophobicContact CD1-CB 4.08Å; F2360-A2377 HydrophobicContact CD2-CB 4.01Å; F2360-A2377 HydrophobicContact CE1-CB 3.62Å; F2360-A2377 VanDerWaalsContact CE1-CB 3.49Å; F2360-A2377 HydrophobicContact CE2-CB 3.53Å; F2360-A2377 HydrophobicContact CG-CB 4.17Å; F2360-A2377 HydrophobicContact CZ-CB 3.31Å; F2360-A2377 PolarHBondContact N-O 2.77Å; F2360-A2377 PolarHBondContact O-N 2.93Å; A2377-H2383 CarbonylContact C-O 3.52Å; A2377-H2383 WeakPolarHBondContact CA-O 3.34Å; A2377-W2384 HydrophobicContact CB-CD2 4.1Å; A2377-W2384 HydrophobicContact CB-CE3 3.66Å; A2377-W2384 HydrophobicContact CB-CH2 4.1Å; A2377-W2384 HydrophobicContact CB-CZ2 4.42Å; A2377-W2384 HydrophobicContact CB-CZ3 3.68Å
2378	Q	89.2	Confident	84	Confident	103.25 Å²	103.25	44 Å²	44	48%	0.482	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	141.4	172	-61.4	176.4	-19.9	0	0	109.9	K2358 L2382 H2383	K2358-Q2378 CarbonylContact O-C 3.48Å; K2358-Q2378 WeakPolarHBondContact O-CA 3.43Å; Q2378-L2382 CarbonylContact O-C 3.45Å; Q2378-L2382 VanDerWaalsContact O-CA 3.25Å; Q2378-L2382 WeakPolarHBondContact O-CA 3.33Å; Q2378-L2382 PolarHBondContact O-N 3.04Å; Q2378-H2383 HydrophobicContact CB-CB 4.33Å; Q2378-H2383 PolarHBondContact N-O 2.93Å; Q2378-H2383 PolarHBondContact O-N 2.81Å; Q2378-H2383 VanDerWaalsContact O-N 3.11Å; Q2378-H2383 PolarHBondContact OE1-CD2 2.88Å
2379	L	81.8	Confident	84.9	Confident	20 Å²	20	39.2 Å²	39.2	11%	0.105	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126	150	-174	-68	174.8	0	0	0	110.4	V2353 A2357 K2358 F2360 E2381 L2382 M2406	V2353-L2379 HydrophobicContact CB-CD1 4.47Å; V2353-L2379 HydrophobicContact CG1-CD1 3.94Å; V2353-L2379 HydrophobicContact CG2-CD1 4.42Å; A2357-L2379 HydrophobicContact CB-CD1 3.56Å; A2357-L2379 VanDerWaalsContact O-CB 3.29Å; A2357-L2379 WeakPolarHBondContact O-CB 3.19Å; K2358-L2379 PolarHBondContact O-N 2.96Å; F2360-L2379 HydrophobicContact CD1-CD1 4.2Å; F2360-L2379 HydrophobicContact CE1-CD1 4.07Å; F2360-L2379 HydrophobicContact CE1-CG 4.41Å; L2379-E2381 VanDerWaalsContact C-N 3.34Å; L2379-E2381 VanDerWaalsContact C-OE2 3.32Å; L2379-L2382 HydrophobicContact CD2-CB 4.38Å; L2379-L2382 HydrophobicContact CD2-CD2 3.51Å; L2379-L2382 VanDerWaalsContact CD2-CD2 3.49Å; L2379-L2382 HydrophobicContact CD2-CG 3.9Å; L2379-M2406 HydrophobicContact CD1-SD 4.31Å; L2379-M2406 HydrophobicContact CD2-SD 4.06Å
2380	P	75.1	Confident	86.1	Confident	113.25 Å²	113.25	36.5 Å²	36.5	74%	0.735	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	cis	-81.9	-7.5	7.2	33.8	-37.4	0	0	0	115	L2382	P2380-L2382 PolarHBondContact O-N 2.9Å; P2380-L2382 VanDerWaalsContact O-N 3.12Å
2381	E	77.7	Confident	86.4	Confident	130.25 Å²	130.25	36.4 Å²	36.4	61%	0.609	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-13.2	-171.1	-62.6	154	-164.5	0	0	114.7	L2379 H2383 T2401 S2402	L2379-E2381 VanDerWaalsContact C-N 3.34Å; L2379-E2381 VanDerWaalsContact C-OE2 3.32Å; E2381-H2383 VanDerWaalsContact C-N 3.28Å; E2381-H2383 PolarHBondContact O-N 3.06Å; E2381-T2401 HydrophobicContact CB-CG2 3.93Å; E2381-T2401 VanDerWaalsContact O-CG2 3.26Å; E2381-T2401 WeakPolarHBondContact O-CG2 3.31Å; E2381-S2402 PolarHBondContact O-N 3.39Å; E2381-S2402 VanDerWaalsContact O-N 3.09Å
2382	L	80.6	Confident	86.1	Confident	10.25 Å²	10.25	37.2 Å²	37.2	5%	0.054	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	49.2	-173.2	-71.6	162.9	0	0	0	110.8	Q2378 L2379 P2380 W2384 T2401 S2402 T2404 M2406 I2412	Q2378-L2382 CarbonylContact O-C 3.45Å; Q2378-L2382 VanDerWaalsContact O-CA 3.25Å; Q2378-L2382 WeakPolarHBondContact O-CA 3.33Å; Q2378-L2382 PolarHBondContact O-N 3.04Å; L2379-L2382 HydrophobicContact CD2-CB 4.38Å; L2379-L2382 HydrophobicContact CD2-CD2 3.51Å; L2379-L2382 VanDerWaalsContact CD2-CD2 3.49Å; L2379-L2382 HydrophobicContact CD2-CG 3.9Å; P2380-L2382 PolarHBondContact O-N 2.9Å; P2380-L2382 VanDerWaalsContact O-N 3.12Å; L2382-W2384 HydrophobicContact CD2-CZ2 4.18Å; L2382-W2384 PolarHBondContact O-N 2.72Å; L2382-W2384 PolarHBondContact O-NE1 3.04Å; L2382-T2401 CarbonylContact O-C 3.55Å; L2382-T2401 WeakPolarHBondContact O-CA 3.28Å; L2382-S2402 PolarHBondContact O-N 3.09Å; L2382-T2404 VanDerWaalsContact CD1-O 3.23Å; L2382-T2404 WeakPolarHBondContact CD1-O 3.22Å; L2382-M2406 HydrophobicContact CD1-CB 4.06Å; L2382-M2406 HydrophobicContact CD1-CG 4.26Å; L2382-I2412 HydrophobicContact CD2-CD1 4.13Å
2383	H	88.4	Confident	85.6	Confident	38.75 Å²	38.75	44.9 Å²	44.9	18%	0.179	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	110.5	173	-172	52.4	0	0	0	109.9	A2377 Q2378 E2381 N2399 T2401	A2377-H2383 CarbonylContact C-O 3.52Å; A2377-H2383 WeakPolarHBondContact CA-O 3.34Å; Q2378-H2383 HydrophobicContact CB-CB 4.33Å; Q2378-H2383 PolarHBondContact N-O 2.93Å; Q2378-H2383 PolarHBondContact O-N 2.81Å; Q2378-H2383 VanDerWaalsContact O-N 3.11Å; Q2378-H2383 PolarHBondContact OE1-CD2 2.88Å; E2381-H2383 VanDerWaalsContact C-N 3.28Å; E2381-H2383 PolarHBondContact O-N 3.06Å; H2383-N2399 PolarHBondContact CE1-ND2 3Å; H2383-N2399 VanDerWaalsContact CE1-ND2 3.34Å; H2383-N2399 PolarHBondContact NE2-ND2 2.75Å; H2383-T2401 HydrophobicContact CB-CG2 4.28Å; H2383-T2401 PolarHBondContact ND1-OG1 3.1Å
2384	W	89.1	Confident	85.3	Confident	2.25 Å²	2.25	50.5 Å²	50.5	1%	0.009	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	137.7	-177.8	-59.7	86.2	0	0	0	111	F2360 I2362 L2375 D2376 A2377 L2382 N2399 Y2400 I2412 L2414 I2427 L2434	F2360-W2384 AromaticContact CE2-CH2 3.82Å; F2360-W2384 HydrophobicContact CE2-CH2 3.89Å; F2360-W2384 AromaticContact CE2-CZ3 3.74Å; F2360-W2384 HydrophobicContact CE2-CZ3 3.81Å; F2360-W2384 AromaticContact CZ-CH2 3.57Å; F2360-W2384 HydrophobicContact CZ-CH2 3.57Å; F2360-W2384 HydrophobicContact CZ-CZ2 4.31Å; F2360-W2384 AromaticContact CZ-CZ3 3.88Å; F2360-W2384 HydrophobicContact CZ-CZ3 3.91Å; I2362-W2384 HydrophobicContact CD1-CH2 4.42Å; I2362-W2384 HydrophobicContact CD1-CZ3 4.1Å; L2375-W2384 HydrophobicContact CD1-CB 4.23Å; L2375-W2384 HydrophobicContact CD1-CD2 4.46Å; L2375-W2384 HydrophobicContact CD1-CE3 3.98Å; L2375-W2384 HydrophobicContact CD1-CZ3 4.44Å; L2375-W2384 HydrophobicContact CD2-CE3 3.9Å; L2375-W2384 HydrophobicContact CD2-CZ3 4.02Å; L2375-W2384 HydrophobicContact CG-CE3 3.71Å; L2375-W2384 HydrophobicContact CG-CZ3 4.11Å; D2376-W2384 CarbonylContact O-C 3.56Å; D2376-W2384 VanDerWaalsContact O-CA 3.26Å; D2376-W2384 WeakPolarHBondContact O-CA 3.33Å; A2377-W2384 HydrophobicContact CB-CD2 4.1Å; A2377-W2384 HydrophobicContact CB-CE3 3.66Å; A2377-W2384 HydrophobicContact CB-CH2 4.1Å; A2377-W2384 HydrophobicContact CB-CZ2 4.42Å; A2377-W2384 HydrophobicContact CB-CZ3 3.68Å; L2382-W2384 HydrophobicContact CD2-CZ2 4.18Å; L2382-W2384 PolarHBondContact O-N 2.72Å; L2382-W2384 PolarHBondContact O-NE1 3.04Å; W2384-N2399 CarbonylContact O-C 3.54Å; W2384-N2399 WeakPolarHBondContact O-CA 3.29Å; W2384-N2399 WeakPolarHBondContact O-CB 3.17Å; W2384-Y2400 HydrophobicContact CB-CD1 4Å; W2384-Y2400 WeakPolarHBondContact CB-O 3.43Å; W2384-Y2400 AromaticContact CD1-CD1 3.76Å; W2384-Y2400 VanDerWaalsContact CD1-CD1 3.42Å; W2384-Y2400 AromaticContact CD1-CE1 3.83Å; W2384-Y2400 VanDerWaalsContact CD1-O 3.28Å; W2384-Y2400 AromaticContact CG-CD1 3.87Å; W2384-Y2400 HydrophobicContact CG-CD1 4.17Å; W2384-Y2400 PolarHBondContact N-O 3.06Å; W2384-Y2400 PolarHBondContact O-N 3.1Å; W2384-I2412 HydrophobicContact CH2-CB 4.45Å; W2384-I2412 HydrophobicContact CH2-CD1 4.08Å; W2384-I2412 HydrophobicContact CH2-CG1 4.48Å; W2384-I2412 HydrophobicContact CH2-CG2 4.09Å; W2384-I2412 HydrophobicContact CZ2-CD1 4.13Å; W2384-I2412 HydrophobicContact CZ2-CG1 4.48Å; W2384-I2412 HydrophobicContact CZ2-CG2 4.05Å; W2384-L2414 HydrophobicContact CH2-CD1 4.2Å; W2384-L2414 HydrophobicContact CH2-CD2 3.83Å; W2384-L2414 HydrophobicContact CH2-CG 4.41Å; W2384-L2414 HydrophobicContact CZ3-CD2 3.7Å; W2384-I2427 HydrophobicContact CD2-CD1 3.69Å; W2384-I2427 HydrophobicContact CE3-CD1 3.93Å; W2384-I2427 HydrophobicContact CG-CD1 4.14Å; W2384-I2427 HydrophobicContact CH2-CD1 3.89Å; W2384-I2427 HydrophobicContact CH2-CG2 4.25Å; W2384-I2427 HydrophobicContact CZ2-CD1 3.68Å; W2384-I2427 HydrophobicContact CZ2-CG2 3.84Å; W2384-I2427 HydrophobicContact CZ3-CD1 4.01Å; W2384-L2434 HydrophobicContact CB-CD1 4.16Å
2385	V	90.8	Very high	85.1	Confident	17.5 Å²	17.5	57 Å²	57	11%	0.106	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	116.4	175.3	-175.3	0	0	0	0	109.6	D2376 R2387 T2396 N2399	D2376-V2385 HydrophobicContact CB-CB 4.16Å; D2376-V2385 PolarHBondContact N-O 3.01Å; D2376-V2385 PolarHBondContact O-N 2.99Å; V2385-R2387 HydrophobicContact CG1-CG 4.34Å; V2385-T2396 HydrophobicContact CG1-CG2 3.73Å; V2385-N2399 HydrophobicContact CG2-CB 4.28Å
2386	L	92.7	Very high	85	Confident	0.25 Å²	0.25	60.8 Å²	60.8	0%	0.001	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	122.8	174.1	178.1	63.9	0	0	0	109.8	W2373 I2374 L2375 V2397 G2398 F2425 L2434 C2436	W2373-L2386 HydrophobicContact CB-CD1 4.2Å; W2373-L2386 HydrophobicContact CE3-CD1 4.4Å; I2374-L2386 CarbonylContact O-C 3.58Å; I2374-L2386 WeakPolarHBondContact O-CA 3.21Å; L2375-L2386 HydrophobicContact CB-CD1 4.5Å; L2375-L2386 HydrophobicContact CD1-CB 4.36Å; L2386-V2397 HydrophobicContact CB-CB 4.49Å; L2386-V2397 HydrophobicContact CD2-CB 4.26Å; L2386-V2397 HydrophobicContact CD2-CG1 4.34Å; L2386-V2397 HydrophobicContact CG-CB 4.25Å; L2386-V2397 HydrophobicContact CG-CG2 4.35Å; L2386-V2397 PolarHBondContact O-N 2.88Å; L2386-G2398 PolarHBondContact N-O 2.99Å; L2386-G2398 PolarHBondContact O-N 3.33Å; L2386-F2425 HydrophobicContact CD1-CE1 4.47Å; L2386-F2425 HydrophobicContact CD1-CE2 3.92Å; L2386-F2425 HydrophobicContact CD1-CZ 3.73Å; L2386-F2425 HydrophobicContact CD2-CD2 4.37Å; L2386-F2425 HydrophobicContact CD2-CE2 3.67Å; L2386-F2425 HydrophobicContact CD2-CZ 4.33Å; L2386-F2425 HydrophobicContact CG-CE2 4.42Å; L2386-L2434 HydrophobicContact CB-CB 4.35Å; L2386-L2434 HydrophobicContact CB-CD1 4.12Å; L2386-L2434 HydrophobicContact CB-CD2 4.26Å; L2386-L2434 HydrophobicContact CB-CG 4.45Å; L2386-L2434 HydrophobicContact CD2-CB 4.12Å; L2386-C2436 HydrophobicContact CD2-CB 4Å
2387	R	91.4	Very high	84.9	Confident	91.25 Å²	91.25	63.3 Å²	63.3	34%	0.344	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	145.5	169.7	-51	-177.7	-167.3	-163.9	3.7	110	W2373 I2374 D2376 V2385 K2395	W2373-R2387 CarbonylContact C-O 3.55Å; W2373-R2387 VanDerWaalsContact CA-O 3.29Å; W2373-R2387 WeakPolarHBondContact CA-O 3.32Å; W2373-R2387 WeakPolarHBondContact CB-O 3.39Å; I2374-R2387 HydrophobicContact CB-CB 4.42Å; I2374-R2387 PolarHBondContact N-O 2.98Å; I2374-R2387 PolarHBondContact O-N 3.23Å; D2376-R2387 IonicContact OD1-NE 3.15Å; D2376-R2387 IonicContact OD1-NH1 4Å; D2376-R2387 IonicContact OD2-CZ 3.49Å; D2376-R2387 IonicContact OD2-NE 3.21Å; D2376-R2387 PolarHBondContact OD2-NE 2.91Å; D2376-R2387 IonicContact OD2-NH1 2.63Å; D2376-R2387 PolarHBondContact OD2-NH1 3.47Å; D2376-R2387 IonicContact OD2-NH2 3.38Å; D2376-R2387 PolarHBondContact OD2-NH2 3.12Å; V2385-R2387 HydrophobicContact CG1-CG 4.34Å; R2387-K2395 CarbonylContact C-O 3.56Å; R2387-K2395 VanDerWaalsContact CA-O 3.26Å; R2387-K2395 WeakPolarHBondContact CA-O 3.38Å
2388	T	90.1	Very high	84.8	Confident	11.25 Å²	11.25	64.3 Å²	64.3	7%	0.069	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	145.1	164.2	47.5	0	0	0	0	109.8	G2372 F2394 K2395 V2397 C2436 L2438	G2372-T2388 WeakPolarHBondContact O-CA 3.36Å; T2388-F2394 CarbonylContact O-C 3.52Å; T2388-F2394 WeakPolarHBondContact O-CA 3.42Å; T2388-K2395 PolarHBondContact N-O 3.01Å; T2388-K2395 PolarHBondContact O-N 3.12Å; T2388-K2395 PolarHBondContact OG1-O 3.17Å; T2388-V2397 HydrophobicContact CG2-CG2 3.76Å; T2388-C2436 HydrophobicContact CG2-CB 4.01Å; T2388-L2438 HydrophobicContact CG2-CD2 3.61Å; T2388-L2438 HydrophobicContact CG2-CG 4.28Å
2389	V	85.9	Confident	84.8	Confident	11 Å²	11	64.1 Å²	64.1	7%	0.067	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	124.1	169.1	-169.9	0	0	0	0	106.8	W2317 K2370 I2371 G2372 I2374 K2393 F2394	W2317-V2389 HydrophobicContact CZ2-CB 4.12Å; W2317-V2389 HydrophobicContact CZ2-CG1 4.26Å; W2317-V2389 HydrophobicContact CZ2-CG2 4.06Å; K2370-V2389 CarbonylContact O-C 3.57Å; I2371-V2389 CarbonylContact C-O 3.49Å; I2371-V2389 VanDerWaalsContact CA-O 3.31Å; I2371-V2389 WeakPolarHBondContact CA-O 3.33Å; G2372-V2389 PolarHBondContact N-O 3.11Å; G2372-V2389 PolarHBondContact O-N 3.08Å; I2374-V2389 HydrophobicContact CD1-CG2 4.14Å; I2374-V2389 HydrophobicContact CG1-CG2 4.13Å; V2389-K2393 WeakPolarHBondContact CA-O 3.34Å; V2389-F2394 HydrophobicContact CG1-CE1 4.39Å; V2389-F2394 HydrophobicContact CG1-CZ 4.49Å; V2389-F2394 HydrophobicContact CG2-CD1 3.82Å; V2389-F2394 HydrophobicContact CG2-CE1 3.79Å; V2389-F2394 HydrophobicContact CG2-CG 4.49Å; V2389-F2394 HydrophobicContact CG2-CZ 4.42Å
2390	I	83.6	Confident	85	Confident	64 Å²	64	64.9 Å²	64.9	33%	0.328	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	126	173.8	-56.9	178.9	0	0	0	106.8	K2370 I2371 G2392 K2393 L2438 P2439	K2370-I2390 CarbonylContact O-C 3.53Å; K2370-I2390 WeakPolarHBondContact O-CA 3.37Å; I2371-I2390 HydrophobicContact CD1-CG2 4.17Å; I2371-I2390 HydrophobicContact CG1-CG2 4.37Å; I2371-I2390 HydrophobicContact CG2-CG1 4.45Å; I2390-G2392 PolarHBondContact O-N 2.85Å; I2390-G2392 VanDerWaalsContact O-N 3.12Å; I2390-K2393 PolarHBondContact N-O 2.87Å; I2390-K2393 VanDerWaalsContact N-O 3.08Å; I2390-K2393 WeakPolarHBondContact O-CA 3.37Å; I2390-K2393 WeakPolarHBondContact O-CB 3.26Å; I2390-K2393 PolarHBondContact O-N 2.98Å; I2390-L2438 HydrophobicContact CD1-CD2 4.16Å; I2390-L2438 HydrophobicContact CG1-CD2 4.1Å; I2390-P2439 HydrophobicContact CD1-CG 4.46Å
2391	D	79.1	Confident	85.6	Confident	108.5 Å²	108.5	62.5 Å²	62.5	58%	0.58	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	23.8	-173.1	-61.1	-47.8	0	0	0	114.8	K2370 K2393	K2370-D2391 VanDerWaalsContact CB-CA 3.5Å; K2370-D2391 WeakPolarHBondContact CD-O 3.41Å; K2370-D2391 PolarHBondContact NZ-O 3.2Å; K2370-D2391 VanDerWaalsContact NZ-O 3.15Å; K2370-D2391 PolarHBondContact O-N 3Å; K2370-D2391 VanDerWaalsContact O-N 3.09Å; D2391-K2393 PolarHBondContact O-N 3.01Å
2392	G	72.6	Confident	85.6	Confident	33.5 Å²	33.5	57.3 Å²	57.3	35%	0.345	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.1	0	-173.9	0	0	0	0	0	114.2	K2370 I2390 F2394	K2370-G2392 VanDerWaalsContact CB-N 3.29Å; K2370-G2392 PolarHBondContact O-N 3.1Å; I2390-G2392 PolarHBondContact O-N 2.85Å; I2390-G2392 VanDerWaalsContact O-N 3.12Å; G2392-F2394 WeakPolarHBondContact O-CD2 3.33Å; G2392-F2394 WeakPolarHBondContact O-CE2 3.43Å
2393	K	78.6	Confident	85.3	Confident	162.5 Å²	162.5	65.2 Å²	65.2	71%	0.707	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.2	123.9	173	-61.3	176.5	-178.4	172.9	0	109.2	V2389 I2390 D2391	V2389-K2393 WeakPolarHBondContact CA-O 3.34Å; I2390-K2393 PolarHBondContact N-O 2.87Å; I2390-K2393 VanDerWaalsContact N-O 3.08Å; I2390-K2393 WeakPolarHBondContact O-CA 3.37Å; I2390-K2393 WeakPolarHBondContact O-CB 3.26Å; I2390-K2393 PolarHBondContact O-N 2.98Å; D2391-K2393 PolarHBondContact O-N 3.01Å
2394	F	83.6	Confident	84.2	Confident	119.5 Å²	119.5	66.6 Å²	66.6	52%	0.524	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	132.9	176.7	-61.4	-99	0	0	0	110	I2313 I2374 T2388 V2389 G2392	I2313-F2394 HydrophobicContact CG2-CE1 4.17Å; I2313-F2394 HydrophobicContact CG2-CZ 4.06Å; I2374-F2394 HydrophobicContact CD1-CD1 4.23Å; I2374-F2394 HydrophobicContact CD1-CE1 3.7Å; T2388-F2394 CarbonylContact O-C 3.52Å; T2388-F2394 WeakPolarHBondContact O-CA 3.42Å; V2389-F2394 HydrophobicContact CG1-CE1 4.39Å; V2389-F2394 HydrophobicContact CG1-CZ 4.49Å; V2389-F2394 HydrophobicContact CG2-CD1 3.82Å; V2389-F2394 HydrophobicContact CG2-CE1 3.79Å; V2389-F2394 HydrophobicContact CG2-CG 4.49Å; V2389-F2394 HydrophobicContact CG2-CZ 4.42Å; G2392-F2394 WeakPolarHBondContact O-CD2 3.33Å; G2392-F2394 WeakPolarHBondContact O-CE2 3.43Å
2395	K	87.5	Confident	83.2	Confident	149.25 Å²	149.25	71.6 Å²	71.6	65%	0.649	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.3	119.6	172.4	-180	175	-179.8	176.6	0	110.4	R2387 T2388 V2397	R2387-K2395 CarbonylContact C-O 3.56Å; R2387-K2395 VanDerWaalsContact CA-O 3.26Å; R2387-K2395 WeakPolarHBondContact CA-O 3.38Å; T2388-K2395 PolarHBondContact N-O 3.01Å; T2388-K2395 PolarHBondContact O-N 3.12Å; T2388-K2395 PolarHBondContact OG1-O 3.17Å; K2395-V2397 PolarHBondContact O-N 3.17Å
2396	T	89.1	Confident	82.1	Confident	79 Å²	79	74.1 Å²	74.1	49%	0.485	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	130.3	169.3	-54	0	0	0	0	109.8	V2385	V2385-T2396 HydrophobicContact CG1-CG2 3.73Å
2397	V	86.8	Confident	81	Confident	62.25 Å²	62.25	78.7 Å²	78.7	38%	0.377	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	-35.6	178.4	-176.3	0	0	0	0	111.3	L2386 T2388 K2395 K2435 C2436	L2386-V2397 HydrophobicContact CB-CB 4.49Å; L2386-V2397 HydrophobicContact CD2-CB 4.26Å; L2386-V2397 HydrophobicContact CD2-CG1 4.34Å; L2386-V2397 HydrophobicContact CG-CB 4.25Å; L2386-V2397 HydrophobicContact CG-CG2 4.35Å; L2386-V2397 PolarHBondContact O-N 2.88Å; T2388-V2397 HydrophobicContact CG2-CG2 3.76Å; K2395-V2397 PolarHBondContact O-N 3.17Å; V2397-K2435 VanDerWaalsContact CG1-O 3.27Å; V2397-K2435 WeakPolarHBondContact CG1-O 3.42Å; V2397-C2436 HydrophobicContact CB-CB 4.42Å; V2397-C2436 HydrophobicContact CG1-CB 3.97Å; V2397-C2436 HydrophobicContact CG2-CB 4.15Å
2398	G	87	Confident	79.8	Confident	21.5 Å²	21.5	84.2 Å²	84.2	22%	0.222	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	173.7	168.9	177.1	0	0	0	0	0	112.5	L2386 L2434	L2386-G2398 PolarHBondContact N-O 2.99Å; L2386-G2398 PolarHBondContact O-N 3.33Å; G2398-L2434 VanDerWaalsContact O-CD2 3.32Å; G2398-L2434 WeakPolarHBondContact O-CD2 3.21Å
2399	N	90.1	Very high	79.1	Confident	99.75 Å²	99.75	86.5 Å²	86.5	53%	0.533	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	159.3	179.8	41.4	-11.1	0	0	0	111.7	H2383 W2384 V2385	H2383-N2399 PolarHBondContact CE1-ND2 3Å; H2383-N2399 VanDerWaalsContact CE1-ND2 3.34Å; H2383-N2399 PolarHBondContact NE2-ND2 2.75Å; W2384-N2399 CarbonylContact O-C 3.54Å; W2384-N2399 WeakPolarHBondContact O-CA 3.29Å; W2384-N2399 WeakPolarHBondContact O-CB 3.17Å; V2385-N2399 HydrophobicContact CG2-CB 4.28Å
2400	Y	86.4	Confident	78.7	Confident	37.75 Å²	37.75	86.4 Å²	86.4	15%	0.148	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	122.6	-178.7	168.9	-103.9	0	0	0	111.2	W2384 V2432 P2433	W2384-Y2400 HydrophobicContact CB-CD1 4Å; W2384-Y2400 WeakPolarHBondContact CB-O 3.43Å; W2384-Y2400 AromaticContact CD1-CD1 3.76Å; W2384-Y2400 VanDerWaalsContact CD1-CD1 3.42Å; W2384-Y2400 AromaticContact CD1-CE1 3.83Å; W2384-Y2400 VanDerWaalsContact CD1-O 3.28Å; W2384-Y2400 AromaticContact CG-CD1 3.87Å; W2384-Y2400 HydrophobicContact CG-CD1 4.17Å; W2384-Y2400 PolarHBondContact N-O 3.06Å; W2384-Y2400 PolarHBondContact O-N 3.1Å; Y2400-V2432 HydrophobicContact CD1-CB 4.21Å; Y2400-V2432 HydrophobicContact CD1-CG1 3.63Å; Y2400-V2432 HydrophobicContact CD1-CG2 4.13Å; Y2400-V2432 HydrophobicContact CD2-CB 4.37Å; Y2400-V2432 HydrophobicContact CD2-CG1 4.33Å; Y2400-V2432 HydrophobicContact CE1-CB 4.16Å; Y2400-V2432 HydrophobicContact CE1-CG1 3.72Å; Y2400-V2432 HydrophobicContact CE1-CG2 3.87Å; Y2400-V2432 HydrophobicContact CE2-CB 4.49Å; Y2400-V2432 HydrophobicContact CE2-CG1 4.25Å; Y2400-V2432 HydrophobicContact CG-CB 4.11Å; Y2400-V2432 HydrophobicContact CG-CG1 4.04Å; Y2400-P2433 VanDerWaalsContact CD2-CD 3.45Å; Y2400-P2433 HydrophobicContact CD2-CG 3.59Å; Y2400-P2433 VanDerWaalsContact CD2-CG 3.43Å; Y2400-P2433 HydrophobicContact CE2-CG 3.85Å; Y2400-P2433 HydrophobicContact CG-CG 4.33Å
2401	T	86.3	Confident	78.5	Confident	61.3333 Å²	61.3333	86.2 Å²	86.2	38%	0.376	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	139.8	171.9	-44.5	0	0	0	0	110.4	E2381 L2382 H2383	E2381-T2401 HydrophobicContact CB-CG2 3.93Å; E2381-T2401 VanDerWaalsContact O-CG2 3.26Å; E2381-T2401 WeakPolarHBondContact O-CG2 3.31Å; L2382-T2401 CarbonylContact O-C 3.55Å; L2382-T2401 WeakPolarHBondContact O-CA 3.28Å; H2383-T2401 HydrophobicContact CB-CG2 4.28Å; H2383-T2401 PolarHBondContact ND1-OG1 3.1Å
2402	S	77.9	Confident	78.5	Confident	22 Å²	22	81.1 Å²	81.1	15%	0.154	42%	0.417	C	S	.	.			trans	-74.6	146	177.9	-169.2	0	0	0	0	112.8	E2381 L2382 T2404	E2381-S2402 PolarHBondContact O-N 3.39Å; E2381-S2402 VanDerWaalsContact O-N 3.09Å; L2382-S2402 PolarHBondContact O-N 3.09Å; S2402-T2404 WeakPolarHBondContact CB-O 3.23Å; S2402-T2404 PolarHBondContact OG-N 3.06Å; S2402-T2404 PolarHBondContact OG-O 2.95Å
2403	K	73.4	Confident	78.7	Confident	175.333 Å²	175.333	81.1 Å²	81.1	76%	0.762	41%	0.409	S	S	*	.	S	Bend	trans	-100.7	-22.9	171.5	-94.9	-172.6	-154	-178.4	0	112.2
2404	T	66.7	Low	78.9	Confident	69.6667 Å²	69.6667	73.4 Å²	73.4	43%	0.427	38%	0.376	S	S	.	.	S	Bend	trans	-87.3	127.2	169.9	-44.6	0	0	0	0	108.1	L2382 S2402	L2382-T2404 VanDerWaalsContact CD1-O 3.23Å; L2382-T2404 WeakPolarHBondContact CD1-O 3.22Å; S2402-T2404 WeakPolarHBondContact CB-O 3.23Å; S2402-T2404 PolarHBondContact OG-N 3.06Å; S2402-T2404 PolarHBondContact OG-O 2.95Å
2405	P	67.5	Low	78.6	Confident	106 Å²	106	68.6 Å²	68.6	69%	0.688	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-66	162.2	175.4	28.7	-35.3	0	0	0	111.5	R2407	P2405-R2407 PolarHBondContact O-N 3.11Å
2406	M	68.7	Low	78.3	Confident	70.6667 Å²	70.6667	61.5 Å²	61.5	35%	0.348	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-61.8	141.8	175.5	-160.6	167	70.6	0	0	110.6	V2353 L2379 L2382 I2412	V2353-M2406 HydrophobicContact CB-SD 4.3Å; V2353-M2406 HydrophobicContact CG1-SD 4.33Å; V2353-M2406 HydrophobicContact CG2-CE 3.83Å; V2353-M2406 HydrophobicContact CG2-SD 4.03Å; L2379-M2406 HydrophobicContact CD1-SD 4.31Å; L2379-M2406 HydrophobicContact CD2-SD 4.06Å; L2382-M2406 HydrophobicContact CD1-CB 4.06Å; L2382-M2406 HydrophobicContact CD1-CG 4.26Å; M2406-I2412 HydrophobicContact SD-CD1 4.4Å
2407	R	69.1	Low	77.7	Confident	95.6667 Å²	95.6667	60.2 Å²	60.2	36%	0.361	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-63.3	143.2	174	-64.1	-179.8	105	142.1	8.7	109.4	D2308 P2405 D2409 G2410 K2411 D2428 E2671	D2308-R2407 IonicContact OD1-CZ 3.39Å; D2308-R2407 IonicContact OD1-NH1 2.69Å; D2308-R2407 PolarHBondContact OD1-NH1 3.24Å; D2308-R2407 IonicContact OD1-NH2 2.75Å; D2308-R2407 PolarHBondContact OD1-NH2 3.07Å; D2308-R2407 IonicContact OD2-CZ 2.81Å; D2308-R2407 IonicContact OD2-NH1 3.03Å; D2308-R2407 IonicContact OD2-NH2 3.67Å; D2308-R2407 PolarHBondContact OD2-NH2 3.32Å; P2405-R2407 PolarHBondContact O-N 3.11Å; R2407-D2409 WeakPolarHBondContact CB-OD1 3.4Å; R2407-D2409 PolarHBondContact O-N 2.9Å; R2407-D2409 VanDerWaalsContact O-N 3.15Å; R2407-G2410 PolarHBondContact O-N 3.05Å; R2407-K2411 WeakPolarHBondContact CD-O 3.22Å; R2407-K2411 VanDerWaalsContact CG-O 3.3Å; R2407-K2411 WeakPolarHBondContact CG-O 3.38Å; R2407-D2428 WeakPolarHBondContact CD-OD1 3.49Å; R2407-D2428 IonicContact CZ-OD1 2.99Å; R2407-D2428 IonicContact NE-OD1 3.02Å; R2407-D2428 IonicContact NH1-OD1 2.87Å; R2407-D2428 PolarHBondContact NH1-OD1 2.88Å; R2407-E2671 IonicContact CZ-OE1 2.68Å; R2407-E2671 IonicContact CZ-OE2 3.29Å; R2407-E2671 IonicContact NH1-OE1 3.18Å; R2407-E2671 IonicContact NH1-OE2 3.94Å; R2407-E2671 PolarHBondContact NH1-OE2 3.46Å; R2407-E2671 IonicContact NH2-OE1 3.87Å; R2407-E2671 PolarHBondContact NH2-OE1 2.89Å; R2407-E2671 IonicContact NH2-OE2 3.56Å; R2407-E2671 PolarHBondContact NH2-OE2 2.75Å
2408	Q	66.4	Low	77	Confident	208.333 Å²	208.333	57.3 Å²	57.3	97%	0.974	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-16.4	-173.5	-69.9	178.6	-38.5	0	0	114.4	G2410	Q2408-G2410 VanDerWaalsContact C-N 3.32Å; Q2408-G2410 PolarHBondContact O-N 3.49Å
2409	D	74.6	Confident	76.1	Confident	59 Å²	59	60.3 Å²	60.3	32%	0.316	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	3	-175.5	60.1	-18.1	0	0	0	113.7	V2310 K2352 R2407 K2411	V2310-D2409 HydrophobicContact CB-CB 4.41Å; V2310-D2409 HydrophobicContact CG1-CB 3.67Å; V2310-D2409 HydrophobicContact CG2-CB 3.81Å; V2310-D2409 VanDerWaalsContact CG2-OD2 3.24Å; V2310-D2409 WeakPolarHBondContact CG2-OD2 3.42Å; K2352-D2409 WeakPolarHBondContact CE-O 3.37Å; R2407-D2409 WeakPolarHBondContact CB-OD1 3.4Å; R2407-D2409 PolarHBondContact O-N 2.9Å; R2407-D2409 VanDerWaalsContact O-N 3.15Å; D2409-K2411 VanDerWaalsContact CG-NZ 3.25Å; D2409-K2411 PolarHBondContact O-N 3.11Å; D2409-K2411 PolarHBondContact O-NZ 2.84Å; D2409-K2411 PolarHBondContact OD1-N 3.12Å; D2409-K2411 VanDerWaalsContact OD2-CD 3.32Å; D2409-K2411 WeakPolarHBondContact OD2-CD 3.38Å; D2409-K2411 WeakPolarHBondContact OD2-CE 3.47Å; D2409-K2411 VanDerWaalsContact OD2-CG 3.3Å; D2409-K2411 WeakPolarHBondContact OD2-CG 3.46Å; D2409-K2411 IonicContact OD2-NZ 3.46Å; D2409-K2411 PolarHBondContact OD2-NZ 3.09Å
2410	G	77.6	Confident	75	Confident	9 Å²	9	60.2 Å²	60.2	9%	0.093	30%	0.303	C	S	.	.			trans	70.5	31.9	175.9	0	0	0	0	0	115.2	K2352 V2353 R2407 Q2408	K2352-G2410 CarbonylContact C-O 3.59Å; K2352-G2410 VanDerWaalsContact CA-O 3.28Å; K2352-G2410 WeakPolarHBondContact CA-O 3.39Å; K2352-G2410 WeakPolarHBondContact CB-O 3.37Å; K2352-G2410 WeakPolarHBondContact CD-O 3.49Å; K2352-G2410 WeakPolarHBondContact CG-O 3.5Å; V2353-G2410 PolarHBondContact N-O 2.87Å; R2407-G2410 PolarHBondContact O-N 3.05Å; Q2408-G2410 VanDerWaalsContact C-N 3.32Å; Q2408-G2410 PolarHBondContact O-N 3.49Å
2411	K	79.6	Confident	74.2	Confident	58.6667 Å²	58.6667	58.4 Å²	58.4	26%	0.255	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	151.7	178.3	-87	177	-131.1	105.6	0	108.7	I2309 T2350 M2351 K2352 R2407 D2409	I2309-K2411 PolarHBondContact O-NZ 2.79Å; T2350-K2411 HydrophobicContact CG2-CD 3.69Å; T2350-K2411 HydrophobicContact CG2-CG 3.64Å; M2351-K2411 CarbonylContact O-C 3.56Å; M2351-K2411 VanDerWaalsContact O-CA 3.24Å; M2351-K2411 WeakPolarHBondContact O-CA 3.47Å; M2351-K2411 WeakPolarHBondContact O-CB 3.44Å; M2351-K2411 WeakPolarHBondContact O-CG 3.33Å; K2352-K2411 HydrophobicContact CB-CG 4.18Å; K2352-K2411 HydrophobicContact CG-CG 4.16Å; R2407-K2411 WeakPolarHBondContact CD-O 3.22Å; R2407-K2411 VanDerWaalsContact CG-O 3.3Å; R2407-K2411 WeakPolarHBondContact CG-O 3.38Å; D2409-K2411 VanDerWaalsContact CG-NZ 3.25Å; D2409-K2411 PolarHBondContact O-N 3.11Å; D2409-K2411 PolarHBondContact O-NZ 2.84Å; D2409-K2411 PolarHBondContact OD1-N 3.12Å; D2409-K2411 VanDerWaalsContact OD2-CD 3.32Å; D2409-K2411 WeakPolarHBondContact OD2-CD 3.38Å; D2409-K2411 WeakPolarHBondContact OD2-CE 3.47Å; D2409-K2411 VanDerWaalsContact OD2-CG 3.3Å; D2409-K2411 WeakPolarHBondContact OD2-CG 3.46Å; D2409-K2411 IonicContact OD2-NZ 3.46Å; D2409-K2411 PolarHBondContact OD2-NZ 3.09Å
2412	I	80	Confident	73.8	Confident	3.33333 Å²	3.33333	59.2 Å²	59.2	2%	0.017	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	127.4	162.7	-57.3	177.4	0	0	0	108	M2351 V2353 F2360 L2382 W2384 M2406 L2414 I2427 D2428	M2351-I2412 HydrophobicContact CE-CB 3.91Å; M2351-I2412 HydrophobicContact CE-CG2 4.33Å; M2351-I2412 HydrophobicContact CG-CB 3.81Å; M2351-I2412 HydrophobicContact CG-CG1 4.44Å; M2351-I2412 PolarHBondContact N-O 3.13Å; M2351-I2412 VanDerWaalsContact N-O 3.12Å; M2351-I2412 PolarHBondContact O-N 2.8Å; M2351-I2412 HydrophobicContact SD-CB 3.97Å; M2351-I2412 HydrophobicContact SD-CD1 4.3Å; M2351-I2412 HydrophobicContact SD-CG1 4.37Å; V2353-I2412 HydrophobicContact CG1-CD1 3.94Å; V2353-I2412 HydrophobicContact CG2-CD1 3.88Å; V2353-I2412 HydrophobicContact CG2-CG1 4.16Å; F2360-I2412 HydrophobicContact CE1-CD1 3.86Å; F2360-I2412 HydrophobicContact CE2-CD1 4.08Å; F2360-I2412 HydrophobicContact CZ-CD1 3.54Å; L2382-I2412 HydrophobicContact CD2-CD1 4.13Å; W2384-I2412 HydrophobicContact CH2-CB 4.45Å; W2384-I2412 HydrophobicContact CH2-CD1 4.08Å; W2384-I2412 HydrophobicContact CH2-CG1 4.48Å; W2384-I2412 HydrophobicContact CH2-CG2 4.09Å; W2384-I2412 HydrophobicContact CZ2-CD1 4.13Å; W2384-I2412 HydrophobicContact CZ2-CG1 4.48Å; W2384-I2412 HydrophobicContact CZ2-CG2 4.05Å; M2406-I2412 HydrophobicContact SD-CD1 4.4Å; I2412-L2414 HydrophobicContact CB-CD1 4.28Å; I2412-L2414 HydrophobicContact CG2-CD1 3.63Å; I2412-L2414 HydrophobicContact CG2-CG 4.2Å; I2412-L2414 PolarHBondContact O-N 2.85Å; I2412-I2427 HydrophobicContact CG2-CG2 3.62Å; I2412-D2428 VanDerWaalsContact CA-OD2 3.29Å; I2412-D2428 WeakPolarHBondContact CA-OD2 3.19Å; I2412-D2428 WeakPolarHBondContact CG2-OD2 3.36Å
2413	L	76.6	Confident	74.1	Confident	33 Å²	33	58.2 Å²	58.2	17%	0.173	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	108.3	171.1	-176.9	70	0	0	0	109.2	F2348 M2349 T2350 L2415 I2427 D2428 K2667	F2348-L2413 HydrophobicContact CD1-CD1 4.14Å; F2348-L2413 HydrophobicContact CD2-CD1 4.24Å; F2348-L2413 HydrophobicContact CE1-CD1 3.63Å; F2348-L2413 HydrophobicContact CE2-CD1 3.66Å; F2348-L2413 HydrophobicContact CE2-CD2 4.46Å; F2348-L2413 HydrophobicContact CE2-CG 4Å; F2348-L2413 HydrophobicContact CG-CD1 4.42Å; F2348-L2413 HydrophobicContact CZ-CD1 3.56Å; F2348-L2413 VanDerWaalsContact CZ-CD1 3.43Å; F2348-L2413 HydrophobicContact CZ-CD2 4.4Å; M2349-L2413 CarbonylContact O-C 3.57Å; M2349-L2413 WeakPolarHBondContact O-CA 3.49Å; T2350-L2413 HydrophobicContact CG2-CD1 4.1Å; L2413-L2415 HydrophobicContact CD1-CD1 4.48Å; L2413-L2415 HydrophobicContact CD2-CD1 4.22Å; L2413-L2415 HydrophobicContact CG-CD1 3.94Å; L2413-I2427 CarbonylContact O-C 3.46Å; L2413-I2427 WeakPolarHBondContact O-CA 3.4Å; L2413-D2428 VanDerWaalsContact CB-OD1 3.24Å; L2413-D2428 WeakPolarHBondContact CB-OD1 3.43Å; L2413-D2428 PolarHBondContact N-OD1 2.94Å; L2413-D2428 PolarHBondContact N-OD2 3.13Å; L2413-D2428 PolarHBondContact O-N 2.84Å; L2413-K2667 HydrophobicContact CD1-CB 3.76Å; L2413-K2667 VanDerWaalsContact CD2-O 3.24Å; L2413-K2667 WeakPolarHBondContact CD2-O 3.28Å
2414	L	81.3	Confident	74.4	Confident	1.33333 Å²	1.33333	54.7 Å²	54.7	1%	0.007	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	131.2	172.6	-156.5	80.6	0	0	0	110.9	M2349 M2351 I2362 W2373 L2375 W2384 I2412 F2425 I2426 I2427	M2349-L2414 HydrophobicContact CB-CB 4.27Å; M2349-L2414 HydrophobicContact CB-CD2 4.48Å; M2349-L2414 HydrophobicContact CE-CB 3.94Å; M2349-L2414 PolarHBondContact N-O 2.87Å; M2349-L2414 PolarHBondContact O-N 3.18Å; M2349-L2414 VanDerWaalsContact O-O 3.13Å; M2349-L2414 HydrophobicContact SD-CD2 4.48Å; M2351-L2414 HydrophobicContact CE-CB 4.36Å; M2351-L2414 HydrophobicContact CE-CD1 3.98Å; M2351-L2414 HydrophobicContact CG-CD1 4.25Å; M2351-L2414 HydrophobicContact SD-CD1 3.97Å; I2362-L2414 HydrophobicContact CD1-CD1 3.93Å; I2362-L2414 HydrophobicContact CD1-CD2 3.86Å; I2362-L2414 HydrophobicContact CD1-CG 4.42Å; I2362-L2414 HydrophobicContact CG1-CD2 4.44Å; I2362-L2414 HydrophobicContact CG2-CD2 4.19Å; W2373-L2414 HydrophobicContact CH2-CD2 4.11Å; L2375-L2414 HydrophobicContact CD2-CD1 4.24Å; L2375-L2414 HydrophobicContact CD2-CD2 3.96Å; W2384-L2414 HydrophobicContact CH2-CD1 4.2Å; W2384-L2414 HydrophobicContact CH2-CD2 3.83Å; W2384-L2414 HydrophobicContact CH2-CG 4.41Å; W2384-L2414 HydrophobicContact CZ3-CD2 3.7Å; I2412-L2414 HydrophobicContact CB-CD1 4.28Å; I2412-L2414 HydrophobicContact CG2-CD1 3.63Å; I2412-L2414 HydrophobicContact CG2-CG 4.2Å; I2412-L2414 PolarHBondContact O-N 2.85Å; L2414-F2425 HydrophobicContact CD1-CB 4.04Å; L2414-F2425 HydrophobicContact CD1-CD1 4.02Å; L2414-F2425 HydrophobicContact CD1-CG 4.39Å; L2414-F2425 HydrophobicContact CD2-CD1 4.41Å; L2414-I2426 WeakPolarHBondContact CA-O 3.21Å; L2414-I2427 HydrophobicContact CD1-CD1 4.31Å; L2414-I2427 HydrophobicContact CD1-CG1 3.8Å; L2414-I2427 HydrophobicContact CD2-CD1 4.13Å; L2414-I2427 HydrophobicContact CD2-CG1 4.01Å; L2414-I2427 HydrophobicContact CG-CG1 4.48Å; L2414-I2427 HydrophobicContact CG-CG2 4.45Å
2415	L	78	Confident	75.2	Confident	18 Å²	18	51.5 Å²	51.5	9%	0.094	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	125.3	165.4	-136.1	82.8	0	0	0	109.2	I2334 M2346 I2347 F2348 L2413 Q2417 F2425 I2426 V2668	I2334-L2415 HydrophobicContact CG2-CD2 3.79Å; M2346-L2415 HydrophobicContact CB-CD1 4.34Å; M2346-L2415 HydrophobicContact CE-CD1 3.94Å; M2346-L2415 HydrophobicContact CE-CD2 4.08Å; M2346-L2415 HydrophobicContact CE-CG 4.38Å; M2346-L2415 HydrophobicContact CG-CD1 4.28Å; M2346-L2415 HydrophobicContact CG-CD2 4.47Å; M2346-L2415 HydrophobicContact CG-CG 4.03Å; M2346-L2415 HydrophobicContact SD-CD1 3.76Å; M2346-L2415 VanDerWaalsContact SD-CD1 3.58Å; M2346-L2415 HydrophobicContact SD-CD2 3.78Å; M2346-L2415 HydrophobicContact SD-CG 3.76Å; I2347-L2415 CarbonylContact O-C 3.5Å; I2347-L2415 VanDerWaalsContact O-CA 3.3Å; I2347-L2415 WeakPolarHBondContact O-CA 3.31Å; F2348-L2415 HydrophobicContact CB-CD1 4.22Å; F2348-L2415 HydrophobicContact CD1-CD2 3.58Å; F2348-L2415 HydrophobicContact CD1-CG 3.88Å; F2348-L2415 HydrophobicContact CD2-CD1 3.8Å; F2348-L2415 HydrophobicContact CE1-CD2 3.41Å; F2348-L2415 VanDerWaalsContact CE1-CD2 3.41Å; F2348-L2415 HydrophobicContact CE1-CG 4.22Å; F2348-L2415 HydrophobicContact CG-CD1 4.43Å; F2348-L2415 HydrophobicContact CZ-CD2 4.37Å; L2413-L2415 HydrophobicContact CD1-CD1 4.48Å; L2413-L2415 HydrophobicContact CD2-CD1 4.22Å; L2413-L2415 HydrophobicContact CG-CD1 3.94Å; L2415-Q2417 HydrophobicContact CD2-CG 4.28Å; L2415-F2425 CarbonylContact O-C 3.54Å; L2415-F2425 WeakPolarHBondContact O-CA 3.33Å; L2415-I2426 HydrophobicContact CB-CB 4.14Å; L2415-I2426 HydrophobicContact CB-CG1 4.35Å; L2415-I2426 HydrophobicContact CD1-CB 4.46Å; L2415-I2426 HydrophobicContact CD2-CB 4.42Å; L2415-I2426 HydrophobicContact CD2-CD1 4.02Å; L2415-I2426 HydrophobicContact CD2-CG1 4.44Å; L2415-I2426 PolarHBondContact N-O 2.91Å; L2415-I2426 PolarHBondContact O-N 2.9Å; L2415-V2668 HydrophobicContact CD1-CG1 4.44Å
2416	T	82.2	Confident	75.8	Confident	0 Å²	0	48 Å²	48	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	108	170.1	-50.1	0	0	0	0	108.8	M2346 I2347 M2349 W2373 I2418 L2423 K2424 F2425	M2346-T2416 CarbonylContact C-O 3.47Å; M2346-T2416 VanDerWaalsContact CA-O 3.27Å; M2346-T2416 WeakPolarHBondContact CA-O 3.17Å; M2346-T2416 WeakPolarHBondContact CG-O 3.43Å; I2347-T2416 PolarHBondContact N-O 2.91Å; I2347-T2416 PolarHBondContact O-N 2.82Å; M2349-T2416 VanDerWaalsContact CE-OG1 3.28Å; M2349-T2416 WeakPolarHBondContact CE-OG1 3.26Å; W2373-T2416 HydrophobicContact CZ2-CG2 4.04Å; T2416-I2418 HydrophobicContact CG2-CG1 4.28Å; T2416-I2418 PolarHBondContact O-N 3.49Å; T2416-L2423 HydrophobicContact CG2-CB 4.26Å; T2416-L2423 HydrophobicContact CG2-CD2 3.99Å; T2416-L2423 HydrophobicContact CG2-CG 4.41Å; T2416-K2424 CarbonylContact C-O 3.57Å; T2416-K2424 WeakPolarHBondContact CA-O 3.37Å; T2416-F2425 HydrophobicContact CG2-CD1 3.89Å; T2416-F2425 HydrophobicContact CG2-CE1 3.55Å; T2416-F2425 VanDerWaalsContact CG2-CE1 3.47Å; T2416-F2425 HydrophobicContact CG2-CE2 4.4Å; T2416-F2425 HydrophobicContact CG2-CG 4.43Å; T2416-F2425 HydrophobicContact CG2-CZ 3.87Å; T2416-F2425 WeakPolarHBondContact OG1-CD1 3.26Å; T2416-F2425 VanDerWaalsContact OG1-CE1 3.29Å; T2416-F2425 WeakPolarHBondContact OG1-CE1 3.31Å
2417	Q	75.2	Confident	76.2	Confident	52 Å²	52	45.1 Å²	45.1	24%	0.243	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	134.3	169.7	-67.1	-175.9	-16.5	0	0	109.3	M2338 S2343 M2346 L2415 L2423 K2424	M2338-Q2417 PolarHBondContact SD-NE2 3.35Å; S2343-Q2417 PolarHBondContact OG-NE2 2.7Å; M2346-Q2417 HydrophobicContact CE-CG 4.12Å; M2346-Q2417 HydrophobicContact CG-CG 4.39Å; L2415-Q2417 HydrophobicContact CD2-CG 4.28Å; Q2417-L2423 CarbonylContact O-C 3.53Å; Q2417-L2423 VanDerWaalsContact O-CA 3.31Å; Q2417-L2423 WeakPolarHBondContact O-CA 3.34Å; Q2417-K2424 HydrophobicContact CB-CB 4.38Å; Q2417-K2424 PolarHBondContact N-O 3.01Å; Q2417-K2424 PolarHBondContact O-N 2.75Å; Q2417-K2424 VanDerWaalsContact O-N 3.08Å
2418	I	72.7	Confident	76.3	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.005	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	126.7	178.9	-53.3	-178	0	0	0	108.1	S2343 A2344 G2345 I2347 T2416 H2422 L2423 V2443 W2462	S2343-I2418 CarbonylContact C-O 3.51Å; S2343-I2418 WeakPolarHBondContact CB-O 3.18Å; A2344-I2418 HydrophobicContact CB-CB 4.32Å; A2344-I2418 HydrophobicContact CB-CD1 4.14Å; A2344-I2418 HydrophobicContact CB-CG2 4.26Å; A2344-I2418 PolarHBondContact N-O 2.9Å; A2344-I2418 CarbonylContact O-C 3.55Å; A2344-I2418 VanDerWaalsContact O-CB 3.3Å; A2344-I2418 WeakPolarHBondContact O-CB 3.37Å; A2344-I2418 VanDerWaalsContact O-CG2 3.29Å; A2344-I2418 WeakPolarHBondContact O-CG2 3.38Å; A2344-I2418 VanDerWaalsContact O-O 3.06Å; G2345-I2418 CarbonylContact C-O 3.59Å; G2345-I2418 VanDerWaalsContact CA-O 3.27Å; G2345-I2418 WeakPolarHBondContact CA-O 3.47Å; G2345-I2418 PolarHBondContact N-O 3.07Å; G2345-I2418 WeakPolarHBondContact O-CA 3.49Å; G2345-I2418 WeakPolarHBondContact O-CB 3.18Å; G2345-I2418 PolarHBondContact O-N 2.93Å; G2345-I2418 VanDerWaalsContact O-O 3.05Å; I2347-I2418 HydrophobicContact CD1-CD1 4.02Å; I2347-I2418 HydrophobicContact CG1-CD1 4.12Å; T2416-I2418 HydrophobicContact CG2-CG1 4.28Å; T2416-I2418 PolarHBondContact O-N 3.49Å; I2418-H2422 CarbonylContact C-O 3.57Å; I2418-H2422 WeakPolarHBondContact CA-O 3.38Å; I2418-L2423 HydrophobicContact CB-CD2 4.27Å; I2418-L2423 HydrophobicContact CD1-CD2 4.17Å; I2418-L2423 HydrophobicContact CG1-CD2 3.93Å; I2418-L2423 HydrophobicContact CG1-CG 4.15Å; I2418-L2423 HydrophobicContact CG2-CD2 4.03Å; I2418-V2443 HydrophobicContact CD1-CG2 3.47Å; I2418-V2443 VanDerWaalsContact CD1-CG2 3.41Å; I2418-W2462 WeakPolarHBondContact O-CH2 3.43Å; I2418-W2462 WeakPolarHBondContact O-CZ3 3.48Å
2419	H	67.5	Low	76	Confident	84.3333 Å²	84.3333	36.3 Å²	36.3	39%	0.39	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	110	177.3	-176.7	71	0	0	0	110	S2341 P2342 G2421 H2422 W2462 R2637	S2341-H2419 PolarHBondContact OG-CE1 2.82Å; S2341-H2419 PolarHBondContact OG-ND1 3.39Å; S2341-H2419 VanDerWaalsContact OG-ND1 3.15Å; P2342-H2419 PolarHBondContact O-ND1 2.96Å; H2419-G2421 VanDerWaalsContact C-N 3.32Å; H2419-G2421 PolarHBondContact O-N 3.09Å; H2419-G2421 VanDerWaalsContact O-N 3.15Å; H2419-H2422 PolarHBondContact N-O 3.09Å; H2419-H2422 WeakPolarHBondContact O-CB 3.33Å; H2419-H2422 PolarHBondContact O-N 3.03Å; H2419-H2422 PolarHBondContact O-ND1 2.76Å; H2419-W2462 HydrophobicContact CB-CZ3 4.32Å; H2419-W2462 AromaticContact CD2-CZ3 3.81Å; H2419-R2637 PolarHBondContact NE2-NH1 2.82Å
2420	N	67.8	Low	75.7	Confident	97.6667 Å²	97.6667	35.6 Å²	35.6	52%	0.522	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.8	49.3	-179.1	-59.5	-2.1	0	0	0	112.2	S2343 H2422	S2343-N2420 PolarHBondContact OG-N 2.87Å; S2343-N2420 VanDerWaalsContact OG-N 3.14Å; N2420-H2422 VanDerWaalsContact C-N 3.26Å; N2420-H2422 PolarHBondContact O-N 2.91Å; N2420-H2422 VanDerWaalsContact O-N 3.12Å; N2420-H2422 PolarHBondContact O-ND1 2.83Å
2421	G	69.3	Low	75.4	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.01	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.2	-3.6	-178.7	0	0	0	0	0	115.7	H2419 L2423 K2437 L2438 A2440	H2419-G2421 VanDerWaalsContact C-N 3.32Å; H2419-G2421 PolarHBondContact O-N 3.09Å; H2419-G2421 VanDerWaalsContact O-N 3.15Å; G2421-L2423 VanDerWaalsContact O-CD1 3.24Å; G2421-L2423 WeakPolarHBondContact O-CD1 3.26Å; G2421-K2437 CarbonylContact O-C 3.59Å; G2421-K2437 WeakPolarHBondContact O-CA 3.28Å; G2421-L2438 WeakPolarHBondContact CA-O 3.41Å; G2421-L2438 PolarHBondContact O-N 3.17Å; G2421-A2440 WeakPolarHBondContact CA-O 3.35Å
2422	H	78.4	Confident	75.3	Confident	76.3333 Å²	76.3333	35.8 Å²	35.8	35%	0.353	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	129.3	172.4	-66.7	-76.3	0	0	0	111	I2418 H2419 N2420 C2436 K2437	I2418-H2422 CarbonylContact C-O 3.57Å; I2418-H2422 WeakPolarHBondContact CA-O 3.38Å; H2419-H2422 PolarHBondContact N-O 3.09Å; H2419-H2422 WeakPolarHBondContact O-CB 3.33Å; H2419-H2422 PolarHBondContact O-N 3.03Å; H2419-H2422 PolarHBondContact O-ND1 2.76Å; N2420-H2422 VanDerWaalsContact C-N 3.26Å; N2420-H2422 PolarHBondContact O-N 2.91Å; N2420-H2422 VanDerWaalsContact O-N 3.12Å; N2420-H2422 PolarHBondContact O-ND1 2.83Å; H2422-C2436 CarbonylContact C-O 3.45Å; H2422-C2436 VanDerWaalsContact CA-O 3.32Å; H2422-C2436 WeakPolarHBondContact CA-O 3.29Å; H2422-K2437 VanDerWaalsContact CE1-CB 3.45Å; H2422-K2437 WeakPolarHBondContact CE1-CB 3.14Å; H2422-K2437 WeakPolarHBondContact CE1-CG 3.48Å; H2422-K2437 WeakPolarHBondContact NE2-CD 3.38Å; H2422-K2437 VanDerWaalsContact NE2-CE 3.31Å; H2422-K2437 WeakPolarHBondContact NE2-CE 3.48Å; H2422-K2437 PolarHBondContact NE2-NZ 3.46Å
2423	L	83.7	Confident	75.3	Confident	1.66667 Å²	1.66667	39.3 Å²	39.3	1%	0.009	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	138.4	178.5	-57.2	121.7	0	0	0	110.9	M2366 W2373 T2416 Q2417 I2418 G2421 F2425 K2435 C2436 L2438	M2366-L2423 HydrophobicContact CE-CD1 4.36Å; M2366-L2423 HydrophobicContact SD-CD2 4.01Å; W2373-L2423 HydrophobicContact CB-CD1 4.26Å; W2373-L2423 VanDerWaalsContact CD1-CD2 3.42Å; W2373-L2423 HydrophobicContact CD2-CD1 4.12Å; W2373-L2423 HydrophobicContact CG-CD1 3.64Å; W2373-L2423 HydrophobicContact CG-CD2 4.27Å; T2416-L2423 HydrophobicContact CG2-CB 4.26Å; T2416-L2423 HydrophobicContact CG2-CD2 3.99Å; T2416-L2423 HydrophobicContact CG2-CG 4.41Å; Q2417-L2423 CarbonylContact O-C 3.53Å; Q2417-L2423 VanDerWaalsContact O-CA 3.31Å; Q2417-L2423 WeakPolarHBondContact O-CA 3.34Å; I2418-L2423 HydrophobicContact CB-CD2 4.27Å; I2418-L2423 HydrophobicContact CD1-CD2 4.17Å; I2418-L2423 HydrophobicContact CG1-CD2 3.93Å; I2418-L2423 HydrophobicContact CG1-CG 4.15Å; I2418-L2423 HydrophobicContact CG2-CD2 4.03Å; G2421-L2423 VanDerWaalsContact O-CD1 3.24Å; G2421-L2423 WeakPolarHBondContact O-CD1 3.26Å; L2423-F2425 HydrophobicContact CB-CE2 3.93Å; L2423-F2425 HydrophobicContact CB-CZ 4.21Å; L2423-F2425 HydrophobicContact CD1-CE2 4.2Å; L2423-F2425 HydrophobicContact CD1-CZ 3.77Å; L2423-F2425 HydrophobicContact CD2-CZ 4.45Å; L2423-K2435 VanDerWaalsContact O-CA 3.3Å; L2423-K2435 WeakPolarHBondContact O-CA 3.34Å; L2423-C2436 VanDerWaalsContact CD1-SG 3.51Å; L2423-C2436 WeakPolarHBondContact CD1-SG 3.12Å; L2423-C2436 PolarHBondContact N-O 3.06Å; L2423-C2436 PolarHBondContact O-N 3Å; L2423-L2438 HydrophobicContact CD1-CB 4.34Å; L2423-L2438 HydrophobicContact CD1-CD1 4.13Å; L2423-L2438 HydrophobicContact CD1-CG 4.1Å
2424	K	79.8	Confident	75.5	Confident	103 Å²	103	38.1 Å²	38.1	45%	0.448	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	139.3	166.4	-55.6	-178.4	-171.5	169.3	0	109	D2340 T2416 Q2417 K2435	D2340-K2424 PolarHBondContact O-NZ 3.26Å; T2416-K2424 CarbonylContact C-O 3.57Å; T2416-K2424 WeakPolarHBondContact CA-O 3.37Å; Q2417-K2424 HydrophobicContact CB-CB 4.38Å; Q2417-K2424 PolarHBondContact N-O 3.01Å; Q2417-K2424 PolarHBondContact O-N 2.75Å; Q2417-K2424 VanDerWaalsContact O-N 3.08Å; K2424-K2435 HydrophobicContact CG-CG 4.26Å
2425	F	84.3	Confident	75.5	Confident	2.33333 Å²	2.33333	44.2 Å²	44.2	1%	0.01	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	141.5	-178.5	-60.4	-96.3	0	0	0	110.7	W2373 L2375 L2386 L2414 L2415 T2416 L2423 V2432 L2434	W2373-F2425 HydrophobicContact CD2-CE1 4.23Å; W2373-F2425 AromaticContact CD2-CZ 3.96Å; W2373-F2425 HydrophobicContact CD2-CZ 4.04Å; W2373-F2425 AromaticContact CE3-CE1 3.8Å; W2373-F2425 HydrophobicContact CE3-CE1 3.94Å; W2373-F2425 AromaticContact CE3-CZ 3.99Å; W2373-F2425 HydrophobicContact CE3-CZ 4.04Å; W2373-F2425 HydrophobicContact CG-CZ 4.47Å; W2373-F2425 AromaticContact CH2-CE1 3.72Å; W2373-F2425 HydrophobicContact CH2-CE1 3.72Å; W2373-F2425 HydrophobicContact CH2-CZ 4.38Å; W2373-F2425 AromaticContact CZ2-CE1 3.95Å; W2373-F2425 HydrophobicContact CZ2-CE1 3.97Å; W2373-F2425 HydrophobicContact CZ2-CZ 4.37Å; W2373-F2425 AromaticContact CZ3-CE1 3.7Å; W2373-F2425 HydrophobicContact CZ3-CE1 3.7Å; W2373-F2425 HydrophobicContact CZ3-CZ 4.28Å; L2375-F2425 HydrophobicContact CD2-CD1 3.88Å; L2375-F2425 HydrophobicContact CD2-CE1 4.16Å; L2375-F2425 HydrophobicContact CD2-CG 4.4Å; L2386-F2425 HydrophobicContact CD1-CE1 4.47Å; L2386-F2425 HydrophobicContact CD1-CE2 3.92Å; L2386-F2425 HydrophobicContact CD1-CZ 3.73Å; L2386-F2425 HydrophobicContact CD2-CD2 4.37Å; L2386-F2425 HydrophobicContact CD2-CE2 3.67Å; L2386-F2425 HydrophobicContact CD2-CZ 4.33Å; L2386-F2425 HydrophobicContact CG-CE2 4.42Å; L2414-F2425 HydrophobicContact CD1-CB 4.04Å; L2414-F2425 HydrophobicContact CD1-CD1 4.02Å; L2414-F2425 HydrophobicContact CD1-CG 4.39Å; L2414-F2425 HydrophobicContact CD2-CD1 4.41Å; L2415-F2425 CarbonylContact O-C 3.54Å; L2415-F2425 WeakPolarHBondContact O-CA 3.33Å; T2416-F2425 HydrophobicContact CG2-CD1 3.89Å; T2416-F2425 HydrophobicContact CG2-CE1 3.55Å; T2416-F2425 VanDerWaalsContact CG2-CE1 3.47Å; T2416-F2425 HydrophobicContact CG2-CE2 4.4Å; T2416-F2425 HydrophobicContact CG2-CG 4.43Å; T2416-F2425 HydrophobicContact CG2-CZ 3.87Å; T2416-F2425 WeakPolarHBondContact OG1-CD1 3.26Å; T2416-F2425 VanDerWaalsContact OG1-CE1 3.29Å; T2416-F2425 WeakPolarHBondContact OG1-CE1 3.31Å; L2423-F2425 HydrophobicContact CB-CE2 3.93Å; L2423-F2425 HydrophobicContact CB-CZ 4.21Å; L2423-F2425 HydrophobicContact CD1-CE2 4.2Å; L2423-F2425 HydrophobicContact CD1-CZ 3.77Å; L2423-F2425 HydrophobicContact CD2-CZ 4.45Å; F2425-V2432 HydrophobicContact CB-CB 4.06Å; F2425-V2432 HydrophobicContact CB-CG1 4.42Å; F2425-V2432 HydrophobicContact CB-CG2 3.93Å; F2425-V2432 WeakPolarHBondContact O-CA 3.41Å; F2425-V2432 VanDerWaalsContact O-CB 3.24Å; F2425-V2432 WeakPolarHBondContact O-CB 3.34Å; F2425-V2432 WeakPolarHBondContact O-CG2 3.38Å; F2425-V2432 PolarHBondContact O-N 3.01Å; F2425-L2434 HydrophobicContact CD2-CB 4.23Å; F2425-L2434 WeakPolarHBondContact CD2-O 3.3Å
2426	I	78.5	Confident	75.8	Confident	32 Å²	32	43.8 Å²	43.8	16%	0.164	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	131.5	169.5	-51.9	-177	0	0	0	106.5	M2338 L2414 L2415 T2429 V2430 A2431	M2338-I2426 HydrophobicContact CE-CD1 3.78Å; M2338-I2426 HydrophobicContact SD-CD1 3.6Å; L2414-I2426 WeakPolarHBondContact CA-O 3.21Å; L2415-I2426 HydrophobicContact CB-CB 4.14Å; L2415-I2426 HydrophobicContact CB-CG1 4.35Å; L2415-I2426 HydrophobicContact CD1-CB 4.46Å; L2415-I2426 HydrophobicContact CD2-CB 4.42Å; L2415-I2426 HydrophobicContact CD2-CD1 4.02Å; L2415-I2426 HydrophobicContact CD2-CG1 4.44Å; L2415-I2426 PolarHBondContact N-O 2.91Å; L2415-I2426 PolarHBondContact O-N 2.9Å; I2426-T2429 VanDerWaalsContact CG2-C 3.4Å; I2426-T2429 WeakPolarHBondContact CG2-O 3.34Å; I2426-V2430 CarbonylContact C-O 3.49Å; I2426-V2430 WeakPolarHBondContact CA-O 3.23Å; I2426-V2430 WeakPolarHBondContact CG2-O 3.28Å; I2426-A2431 HydrophobicContact CG1-CB 4.3Å
2427	I	78.7	Confident	75.9	Confident	9.33333 Å²	9.33333	50.5 Å²	50.5	5%	0.048	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	120.8	-177	-56.5	-177.3	0	0	0	107.5	L2375 W2384 I2412 L2413 L2414 T2429 V2430 V2432	L2375-I2427 HydrophobicContact CD2-CD1 4.36Å; W2384-I2427 HydrophobicContact CD2-CD1 3.69Å; W2384-I2427 HydrophobicContact CE3-CD1 3.93Å; W2384-I2427 HydrophobicContact CG-CD1 4.14Å; W2384-I2427 HydrophobicContact CH2-CD1 3.89Å; W2384-I2427 HydrophobicContact CH2-CG2 4.25Å; W2384-I2427 HydrophobicContact CZ2-CD1 3.68Å; W2384-I2427 HydrophobicContact CZ2-CG2 3.84Å; W2384-I2427 HydrophobicContact CZ3-CD1 4.01Å; I2412-I2427 HydrophobicContact CG2-CG2 3.62Å; L2413-I2427 CarbonylContact O-C 3.46Å; L2413-I2427 WeakPolarHBondContact O-CA 3.4Å; L2414-I2427 HydrophobicContact CD1-CD1 4.31Å; L2414-I2427 HydrophobicContact CD1-CG1 3.8Å; L2414-I2427 HydrophobicContact CD2-CD1 4.13Å; L2414-I2427 HydrophobicContact CD2-CG1 4.01Å; L2414-I2427 HydrophobicContact CG-CG1 4.48Å; L2414-I2427 HydrophobicContact CG-CG2 4.45Å; I2427-T2429 VanDerWaalsContact C-N 3.26Å; I2427-T2429 PolarHBondContact O-N 2.94Å; I2427-V2430 PolarHBondContact N-O 3.05Å; I2427-V2430 WeakPolarHBondContact O-CB 3.25Å; I2427-V2430 PolarHBondContact O-N 2.99Å; I2427-V2430 VanDerWaalsContact O-O 3.06Å; I2427-V2432 HydrophobicContact CB-CG1 4.28Å; I2427-V2432 HydrophobicContact CB-CG2 3.97Å; I2427-V2432 HydrophobicContact CD1-CG1 4.1Å; I2427-V2432 HydrophobicContact CD1-CG2 3.98Å; I2427-V2432 HydrophobicContact CG1-CG1 3.96Å; I2427-V2432 HydrophobicContact CG1-CG2 3.9Å
2428	D	69.8	Low	76.3	Confident	23.6667 Å²	23.6667	48.1 Å²	48.1	13%	0.127	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	45.1	52.6	-177.2	-69.8	-63	0	0	0	113.6	R2407 I2412 L2413 V2430	R2407-D2428 WeakPolarHBondContact CD-OD1 3.49Å; R2407-D2428 IonicContact CZ-OD1 2.99Å; R2407-D2428 IonicContact NE-OD1 3.02Å; R2407-D2428 IonicContact NH1-OD1 2.87Å; R2407-D2428 PolarHBondContact NH1-OD1 2.88Å; I2412-D2428 VanDerWaalsContact CA-OD2 3.29Å; I2412-D2428 WeakPolarHBondContact CA-OD2 3.19Å; I2412-D2428 WeakPolarHBondContact CG2-OD2 3.36Å; L2413-D2428 VanDerWaalsContact CB-OD1 3.24Å; L2413-D2428 WeakPolarHBondContact CB-OD1 3.43Å; L2413-D2428 PolarHBondContact N-OD1 2.94Å; L2413-D2428 PolarHBondContact N-OD2 3.13Å; L2413-D2428 PolarHBondContact O-N 2.84Å; D2428-V2430 VanDerWaalsContact C-N 3.25Å; D2428-V2430 PolarHBondContact O-N 3.05Å; D2428-V2430 VanDerWaalsContact O-N 3.1Å
2429	T	61.3	Low	76.6	Confident	94.6667 Å²	94.6667	52 Å²	52	58%	0.581	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.3	-11	-174.9	72.3	0	0	0	0	116.9	I2426 I2427 A2431 E2671	I2426-T2429 VanDerWaalsContact CG2-C 3.4Å; I2426-T2429 WeakPolarHBondContact CG2-O 3.34Å; I2427-T2429 VanDerWaalsContact C-N 3.26Å; I2427-T2429 PolarHBondContact O-N 2.94Å; T2429-A2431 PolarHBondContact O-N 2.84Å; T2429-E2671 HydrophobicContact CG2-CB 3.74Å
2430	V	67	Low	76.9	Confident	44.6667 Å²	44.6667	48 Å²	48	27%	0.271	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	122.2	177.9	-176.8	0	0	0	0	110.4	I2426 I2427 D2428 V2432	I2426-V2430 CarbonylContact C-O 3.49Å; I2426-V2430 WeakPolarHBondContact CA-O 3.23Å; I2426-V2430 WeakPolarHBondContact CG2-O 3.28Å; I2427-V2430 PolarHBondContact N-O 3.05Å; I2427-V2430 WeakPolarHBondContact O-CB 3.25Å; I2427-V2430 PolarHBondContact O-N 2.99Å; I2427-V2430 VanDerWaalsContact O-O 3.06Å; D2428-V2430 VanDerWaalsContact C-N 3.25Å; D2428-V2430 PolarHBondContact O-N 3.05Å; D2428-V2430 VanDerWaalsContact O-N 3.1Å; V2430-V2432 PolarHBondContact O-N 3.05Å
2431	A	71.9	Confident	76.9	Confident	64 Å²	64	45.5 Å²	45.5	53%	0.529	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	125.9	174.8	0	0	0	0	0	110.7	I2426 T2429	I2426-A2431 HydrophobicContact CG1-CB 4.3Å; T2429-A2431 PolarHBondContact O-N 2.84Å
2432	V	77	Confident	76.8	Confident	9.33333 Å²	9.33333	47.1 Å²	47.1	6%	0.057	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	139.4	-176.6	-151.5	0	0	0	0	109.8	Y2400 F2425 I2427 V2430 L2434	Y2400-V2432 HydrophobicContact CD1-CB 4.21Å; Y2400-V2432 HydrophobicContact CD1-CG1 3.63Å; Y2400-V2432 HydrophobicContact CD1-CG2 4.13Å; Y2400-V2432 HydrophobicContact CD2-CB 4.37Å; Y2400-V2432 HydrophobicContact CD2-CG1 4.33Å; Y2400-V2432 HydrophobicContact CE1-CB 4.16Å; Y2400-V2432 HydrophobicContact CE1-CG1 3.72Å; Y2400-V2432 HydrophobicContact CE1-CG2 3.87Å; Y2400-V2432 HydrophobicContact CE2-CB 4.49Å; Y2400-V2432 HydrophobicContact CE2-CG1 4.25Å; Y2400-V2432 HydrophobicContact CG-CB 4.11Å; Y2400-V2432 HydrophobicContact CG-CG1 4.04Å; F2425-V2432 HydrophobicContact CB-CB 4.06Å; F2425-V2432 HydrophobicContact CB-CG1 4.42Å; F2425-V2432 HydrophobicContact CB-CG2 3.93Å; F2425-V2432 WeakPolarHBondContact O-CA 3.41Å; F2425-V2432 VanDerWaalsContact O-CB 3.24Å; F2425-V2432 WeakPolarHBondContact O-CB 3.34Å; F2425-V2432 WeakPolarHBondContact O-CG2 3.38Å; F2425-V2432 PolarHBondContact O-N 3.01Å; I2427-V2432 HydrophobicContact CB-CG1 4.28Å; I2427-V2432 HydrophobicContact CB-CG2 3.97Å; I2427-V2432 HydrophobicContact CD1-CG1 4.1Å; I2427-V2432 HydrophobicContact CD1-CG2 3.98Å; I2427-V2432 HydrophobicContact CG1-CG1 3.96Å; I2427-V2432 HydrophobicContact CG1-CG2 3.9Å; V2430-V2432 PolarHBondContact O-N 3.05Å; V2432-L2434 HydrophobicContact CG1-CB 3.82Å; V2432-L2434 HydrophobicContact CG1-CD1 3.72Å; V2432-L2434 HydrophobicContact CG1-CG 3.62Å; V2432-L2434 HydrophobicContact CG2-CB 3.92Å; V2432-L2434 HydrophobicContact CG2-CD1 4.15Å; V2432-L2434 HydrophobicContact CG2-CG 4.03Å; V2432-L2434 PolarHBondContact O-N 2.77Å; V2432-L2434 VanDerWaalsContact O-N 3.16Å
2433	P	80.5	Confident	76.5	Confident	75 Å²	75	43.7 Å²	43.7	49%	0.487	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71	-4.1	-178.3	29.4	-35.6	0	0	0	113.9	Y2400 K2435	Y2400-P2433 VanDerWaalsContact CD2-CD 3.45Å; Y2400-P2433 HydrophobicContact CD2-CG 3.59Å; Y2400-P2433 VanDerWaalsContact CD2-CG 3.43Å; Y2400-P2433 HydrophobicContact CE2-CG 3.85Å; Y2400-P2433 HydrophobicContact CG-CG 4.33Å; P2433-K2435 PolarHBondContact O-N 3.08Å
2434	L	81	Confident	75.8	Confident	8 Å²	8	47 Å²	47	4%	0.042	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	119.9	173.9	-58.6	176	0	0	0	110.1	L2375 W2384 L2386 G2398 F2425 V2432	L2375-L2434 HydrophobicContact CD1-CD1 3.85Å; W2384-L2434 HydrophobicContact CB-CD1 4.16Å; L2386-L2434 HydrophobicContact CB-CB 4.35Å; L2386-L2434 HydrophobicContact CB-CD1 4.12Å; L2386-L2434 HydrophobicContact CB-CD2 4.26Å; L2386-L2434 HydrophobicContact CB-CG 4.45Å; L2386-L2434 HydrophobicContact CD2-CB 4.12Å; G2398-L2434 VanDerWaalsContact O-CD2 3.32Å; G2398-L2434 WeakPolarHBondContact O-CD2 3.21Å; F2425-L2434 HydrophobicContact CD2-CB 4.23Å; F2425-L2434 WeakPolarHBondContact CD2-O 3.3Å; V2432-L2434 HydrophobicContact CG1-CB 3.82Å; V2432-L2434 HydrophobicContact CG1-CD1 3.72Å; V2432-L2434 HydrophobicContact CG1-CG 3.62Å; V2432-L2434 HydrophobicContact CG2-CB 3.92Å; V2432-L2434 HydrophobicContact CG2-CD1 4.15Å; V2432-L2434 HydrophobicContact CG2-CG 4.03Å; V2432-L2434 PolarHBondContact O-N 2.77Å; V2432-L2434 VanDerWaalsContact O-N 3.16Å
2435	K	80.5	Confident	75.6	Confident	129.333 Å²	129.333	42.9 Å²	42.9	56%	0.562	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-139.6	137.1	177.3	-60	169.5	-170	163	0	108.2	V2397 L2423 K2424 P2433	V2397-K2435 VanDerWaalsContact CG1-O 3.27Å; V2397-K2435 WeakPolarHBondContact CG1-O 3.42Å; L2423-K2435 VanDerWaalsContact O-CA 3.3Å; L2423-K2435 WeakPolarHBondContact O-CA 3.34Å; K2424-K2435 HydrophobicContact CG-CG 4.26Å; P2433-K2435 PolarHBondContact O-N 3.08Å
2436	C	84.8	Confident	75.3	Confident	11.3333 Å²	11.3333	42.9 Å²	42.9	8%	0.077	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	168.1	169.6	68.9	0	0	0	0	111.1	L2386 T2388 V2397 H2422 L2423	L2386-C2436 HydrophobicContact CD2-CB 4Å; T2388-C2436 HydrophobicContact CG2-CB 4.01Å; V2397-C2436 HydrophobicContact CB-CB 4.42Å; V2397-C2436 HydrophobicContact CG1-CB 3.97Å; V2397-C2436 HydrophobicContact CG2-CB 4.15Å; H2422-C2436 CarbonylContact C-O 3.45Å; H2422-C2436 VanDerWaalsContact CA-O 3.32Å; H2422-C2436 WeakPolarHBondContact CA-O 3.29Å; L2423-C2436 VanDerWaalsContact CD1-SG 3.51Å; L2423-C2436 WeakPolarHBondContact CD1-SG 3.12Å; L2423-C2436 PolarHBondContact N-O 3.06Å; L2423-C2436 PolarHBondContact O-N 3Å
2437	K	84.6	Confident	75.4	Confident	139 Å²	139	43.3 Å²	43.3	60%	0.604	24%	0.238	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-121.2	127.6	166.2	-171	-173.7	-176.3	179	0	108.4	G2421 H2422	G2421-K2437 CarbonylContact O-C 3.59Å; G2421-K2437 WeakPolarHBondContact O-CA 3.28Å; H2422-K2437 VanDerWaalsContact CE1-CB 3.45Å; H2422-K2437 WeakPolarHBondContact CE1-CB 3.14Å; H2422-K2437 WeakPolarHBondContact CE1-CG 3.48Å; H2422-K2437 WeakPolarHBondContact NE2-CD 3.38Å; H2422-K2437 VanDerWaalsContact NE2-CE 3.31Å; H2422-K2437 WeakPolarHBondContact NE2-CE 3.48Å; H2422-K2437 PolarHBondContact NE2-NZ 3.46Å
2438	L	83.1	Confident	75.5	Confident	3.33333 Å²	3.33333	43.5 Å²	43.5	2%	0.017	24%	0.241	C	C	.	.			trans	-108.9	151.9	168.9	-70.3	174.8	0	0	0	109.8	M2366 I2371 G2372 W2373 T2388 I2390 G2421 L2423 A2440	M2366-L2438 HydrophobicContact CE-CB 3.94Å; M2366-L2438 HydrophobicContact CE-CD1 3.71Å; M2366-L2438 HydrophobicContact CE-CG 4.48Å; M2366-L2438 HydrophobicContact CG-CD1 4.11Å; M2366-L2438 HydrophobicContact SD-CD1 3.66Å; I2371-L2438 HydrophobicContact CG2-CB 4.32Å; I2371-L2438 HydrophobicContact CG2-CD1 4.31Å; I2371-L2438 HydrophobicContact CG2-CD2 4.1Å; I2371-L2438 HydrophobicContact CG2-CG 4.41Å; G2372-L2438 WeakPolarHBondContact O-CD2 3.48Å; W2373-L2438 HydrophobicContact CB-CD1 4.3Å; W2373-L2438 HydrophobicContact CG-CD1 4.4Å; T2388-L2438 HydrophobicContact CG2-CD2 3.61Å; T2388-L2438 HydrophobicContact CG2-CG 4.28Å; I2390-L2438 HydrophobicContact CD1-CD2 4.16Å; I2390-L2438 HydrophobicContact CG1-CD2 4.1Å; G2421-L2438 WeakPolarHBondContact CA-O 3.41Å; G2421-L2438 PolarHBondContact O-N 3.17Å; L2423-L2438 HydrophobicContact CD1-CB 4.34Å; L2423-L2438 HydrophobicContact CD1-CD1 4.13Å; L2423-L2438 HydrophobicContact CD1-CG 4.1Å; L2438-A2440 HydrophobicContact CB-CB 4.35Å; L2438-A2440 PolarHBondContact O-N 2.92Å; L2438-A2440 VanDerWaalsContact O-N 3.12Å
2439	P	78.8	Confident	76.1	Confident	81 Å²	81	45.3 Å²	45.3	53%	0.526	25%	0.251	S	S	.	.	S	Bend	trans	-78.6	25.7	171	35.6	-36.3	0	0	0	112.1	I2371 I2390	I2371-P2439 HydrophobicContact CD1-CG 3.76Å; I2371-P2439 HydrophobicContact CG1-CG 4.47Å; I2371-P2439 HydrophobicContact CG2-CG 4.19Å; I2390-P2439 HydrophobicContact CD1-CG 4.46Å
2440	A	73.1	Confident	77.1	Confident	1.66667 Å²	1.66667	42.7 Å²	42.7	1%	0.014	24%	0.242	C	C	.	.			trans	-138.5	149.6	-171.7	0	0	0	0	0	110.4	M2366 D2367 E2368 I2371 G2421 L2438	M2366-A2440 HydrophobicContact CB-CB 3.56Å; M2366-A2440 HydrophobicContact CE-CB 4.14Å; M2366-A2440 VanDerWaalsContact CE-O 3.32Å; M2366-A2440 WeakPolarHBondContact CE-O 3.21Å; M2366-A2440 HydrophobicContact CG-CB 4.15Å; D2367-A2440 HydrophobicContact CB-CB 3.58Å; D2367-A2440 VanDerWaalsContact CG-CA 3.41Å; D2367-A2440 VanDerWaalsContact CG-CB 3.4Å; D2367-A2440 WeakPolarHBondContact OD1-CA 3.13Å; D2367-A2440 WeakPolarHBondContact OD1-CB 3.44Å; D2367-A2440 VanDerWaalsContact OD2-CA 3.23Å; D2367-A2440 WeakPolarHBondContact OD2-CA 3.15Å; E2368-A2440 HydrophobicContact CB-CB 4.18Å; E2368-A2440 HydrophobicContact CG-CB 4.06Å; I2371-A2440 HydrophobicContact CB-CB 4.32Å; I2371-A2440 HydrophobicContact CG2-CB 3.67Å; G2421-A2440 WeakPolarHBondContact CA-O 3.35Å; L2438-A2440 HydrophobicContact CB-CB 4.35Å; L2438-A2440 PolarHBondContact O-N 2.92Å; L2438-A2440 VanDerWaalsContact O-N 3.12Å
2441	T	68.1	Low	77.9	Confident	44.3333 Å²	44.3333	42.9 Å²	42.9	27%	0.272	24%	0.242	S	C	.	.			trans	-133.6	-26.2	-168	64.8	0	0	0	0	115.6	A2344 D2367	A2344-T2441 WeakPolarHBondContact CB-O 3.31Å; A2344-T2441 PolarHBondContact N-O 3.05Å; D2367-T2441 PolarHBondContact OD1-N 2.9Å; D2367-T2441 PolarHBondContact OD2-N 3.05Å; D2367-T2441 PolarHBondContact OD2-OG1 3.44Å
2442	I	67.7	Low	78.3	Confident	35.6667 Å²	35.6667	40.7 Å²	40.7	18%	0.183	22%	0.222	C	C	.	.	S	Bend	trans	-96.9	125.5	177.1	-54.9	171.2	0	0	0	108.4	I2331 I2334 P2342 M2366 D2367 R2444 Y2461	I2331-I2442 HydrophobicContact CG2-CD1 4.45Å; I2334-I2442 HydrophobicContact CD1-CG2 4.4Å; I2334-I2442 HydrophobicContact CG2-CD1 4.26Å; I2334-I2442 HydrophobicContact CG2-CG1 4.47Å; I2334-I2442 HydrophobicContact CG2-CG2 4.24Å; P2342-I2442 HydrophobicContact CB-CD1 3.9Å; P2342-I2442 HydrophobicContact CB-CG1 4.2Å; P2342-I2442 HydrophobicContact CG-CD1 3.92Å; P2342-I2442 HydrophobicContact CG-CG1 4.03Å; M2366-I2442 CarbonylContact C-O 3.57Å; M2366-I2442 VanDerWaalsContact CA-O 3.29Å; M2366-I2442 WeakPolarHBondContact CA-O 3.37Å; M2366-I2442 WeakPolarHBondContact CE-O 3.48Å; D2367-I2442 HydrophobicContact CB-CB 3.88Å; D2367-I2442 HydrophobicContact CB-CD1 4.23Å; D2367-I2442 HydrophobicContact CB-CG1 4.33Å; D2367-I2442 WeakPolarHBondContact CB-O 3.28Å; D2367-I2442 PolarHBondContact N-O 3.03Å; D2367-I2442 WeakPolarHBondContact OD1-CA 3.39Å; D2367-I2442 WeakPolarHBondContact OD1-CB 3.25Å; D2367-I2442 PolarHBondContact OD1-N 2.69Å; D2367-I2442 VanDerWaalsContact OD1-O 3.13Å; D2367-I2442 WeakPolarHBondContact OD2-CB 3.45Å; D2367-I2442 WeakPolarHBondContact OD2-CG1 3.41Å; D2367-I2442 PolarHBondContact OD2-N 3.13Å; I2442-R2444 PolarHBondContact O-N 2.88Å; I2442-Y2461 WeakPolarHBondContact CA-OH 3.43Å; I2442-Y2461 HydrophobicContact CG2-CE1 4.17Å; I2442-Y2461 VanDerWaalsContact CG2-OH 3.26Å; I2442-Y2461 WeakPolarHBondContact CG2-OH 3.39Å
2443	V	71.5	Confident	78.4	Confident	5.33333 Å²	5.33333	42.7 Å²	42.7	3%	0.032	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	120.6	171.5	-178.3	0	0	0	0	108.4	A2344 I2347 E2365 M2366 I2418 N2445 V2446 I2459 Y2461	A2344-V2443 HydrophobicContact CB-CB 4.45Å; A2344-V2443 HydrophobicContact CB-CG2 3.72Å; I2347-V2443 HydrophobicContact CD1-CB 4.42Å; I2347-V2443 HydrophobicContact CD1-CG1 4.09Å; I2347-V2443 HydrophobicContact CD1-CG2 3.8Å; I2347-V2443 HydrophobicContact CG1-CG1 4.46Å; I2347-V2443 HydrophobicContact CG1-CG2 4.11Å; E2365-V2443 CarbonylContact O-C 3.54Å; M2366-V2443 HydrophobicContact CE-CG2 4.17Å; M2366-V2443 HydrophobicContact CG-CG2 4.38Å; M2366-V2443 HydrophobicContact SD-CB 4.43Å; M2366-V2443 HydrophobicContact SD-CG2 4.05Å; I2418-V2443 HydrophobicContact CD1-CG2 3.47Å; I2418-V2443 VanDerWaalsContact CD1-CG2 3.41Å; V2443-N2445 WeakPolarHBondContact CG1-O 3.47Å; V2443-V2446 HydrophobicContact CG1-CG2 3.5Å; V2443-V2446 VanDerWaalsContact CG1-CG2 3.45Å; V2443-I2459 HydrophobicContact CB-CD1 4.08Å; V2443-I2459 HydrophobicContact CB-CG2 4.12Å; V2443-I2459 HydrophobicContact CG1-CD1 3.65Å; V2443-I2459 HydrophobicContact CG1-CG1 4.28Å; V2443-I2459 HydrophobicContact CG2-CG2 4.44Å; V2443-Y2461 PolarHBondContact N-OH 2.9Å; V2443-Y2461 PolarHBondContact O-OH 3.05Å
2444	R	70.5	Confident	78.2	Confident	69.6667 Å²	69.6667	40.9 Å²	40.9	26%	0.263	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	-43.5	174.5	-70.8	-176.4	168.5	175.8	1.1	112	L2327 I2331 E2365 M2366 D2367 I2442 P2493	L2327-R2444 HydrophobicContact CD1-CB 4.31Å; L2327-R2444 HydrophobicContact CD1-CG 4.43Å; L2327-R2444 WeakPolarHBondContact CD1-O 3.3Å; I2331-R2444 HydrophobicContact CD1-CB 4.35Å; I2331-R2444 HydrophobicContact CD1-CG 3.81Å; I2331-R2444 HydrophobicContact CG1-CG 4.03Å; E2365-R2444 HydrophobicContact CB-CB 4.11Å; E2365-R2444 PolarHBondContact O-N 2.9Å; M2366-R2444 VanDerWaalsContact O-CD 3.28Å; M2366-R2444 WeakPolarHBondContact O-CD 3.37Å; M2366-R2444 WeakPolarHBondContact O-CG 3.35Å; M2366-R2444 PolarHBondContact O-NE 3.03Å; M2366-R2444 PolarHBondContact O-NH1 2.91Å; D2367-R2444 VanDerWaalsContact C-CZ 3.48Å; D2367-R2444 PolarHBondContact O-NE 2.77Å; D2367-R2444 PolarHBondContact O-NH1 3.33Å; D2367-R2444 PolarHBondContact O-NH2 2.71Å; I2442-R2444 PolarHBondContact O-N 2.88Å; R2444-P2493 WeakPolarHBondContact O-CG 3.28Å
2445	N	74.2	Confident	77.9	Confident	17 Å²	17	42.9 Å²	42.9	9%	0.091	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	151.4	-169	-171	20.9	0	0	0	109.8	Y2323 L2327 A2364 E2365 V2443 S2492	Y2323-N2445 PolarHBondContact OH-ND2 2.96Å; Y2323-N2445 PolarHBondContact OH-OD1 2.85Å; L2327-N2445 HydrophobicContact CD1-CB 4.29Å; A2364-N2445 VanDerWaalsContact CA-O 3.26Å; A2364-N2445 WeakPolarHBondContact CA-O 3.32Å; E2365-N2445 HydrophobicContact CB-CB 4.14Å; E2365-N2445 HydrophobicContact CG-CB 4.24Å; E2365-N2445 PolarHBondContact N-O 2.76Å; E2365-N2445 VanDerWaalsContact N-O 3.07Å; E2365-N2445 PolarHBondContact O-N 2.94Å; E2365-N2445 VanDerWaalsContact OE1-CB 3.27Å; E2365-N2445 WeakPolarHBondContact OE1-CB 3.29Å; E2365-N2445 PolarHBondContact OE1-ND2 2.86Å; E2365-N2445 WeakPolarHBondContact OE2-CB 3.24Å; E2365-N2445 PolarHBondContact OE2-ND2 3.24Å; V2443-N2445 WeakPolarHBondContact CG1-O 3.47Å; N2445-S2492 VanDerWaalsContact OD1-CB 3.26Å; N2445-S2492 WeakPolarHBondContact OD1-CB 3.46Å
2446	V	79.5	Confident	77.4	Confident	3.33333 Å²	3.33333	42.1 Å²	42.1	2%	0.02	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	126	168.3	-165.2	0	0	0	0	108.1	I2347 M2349 I2362 V2363 A2364 V2443 F2455 P2457 I2459	I2347-V2446 HydrophobicContact CD1-CG2 3.8Å; I2347-V2446 HydrophobicContact CG1-CG2 4.17Å; I2347-V2446 HydrophobicContact CG2-CG2 4.16Å; M2349-V2446 HydrophobicContact CE-CB 4.32Å; M2349-V2446 HydrophobicContact CE-CG1 3.52Å; M2349-V2446 HydrophobicContact CG-CG1 4.49Å; M2349-V2446 HydrophobicContact SD-CG1 3.85Å; I2362-V2446 HydrophobicContact CG2-CG1 4.05Å; V2363-V2446 CarbonylContact O-C 3.2Å; V2363-V2446 WeakPolarHBondContact O-CA 3.21Å; A2364-V2446 HydrophobicContact CB-CG1 4.3Å; A2364-V2446 HydrophobicContact CB-CG2 4.22Å; V2443-V2446 HydrophobicContact CG1-CG2 3.5Å; V2443-V2446 VanDerWaalsContact CG1-CG2 3.45Å; V2446-F2455 HydrophobicContact CG1-CE1 4.07Å; V2446-F2455 HydrophobicContact CG1-CZ 3.86Å; V2446-P2457 HydrophobicContact CB-CB 4.03Å; V2446-P2457 HydrophobicContact CG1-CB 4.28Å; V2446-I2459 HydrophobicContact CG2-CD1 4.29Å; V2446-I2459 HydrophobicContact CG2-CG1 4.39Å
2447	I	79.9	Confident	76.7	Confident	39.6667 Å²	39.6667	42.8 Å²	42.8	20%	0.203	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	149.3	-179	154.2	167.4	0	0	0	110.1	I2362 V2363 L2449 F2455	I2362-I2447 CarbonylContact C-O 3.54Å; I2362-I2447 WeakPolarHBondContact CA-O 3.41Å; V2363-I2447 HydrophobicContact CB-CD1 4.34Å; V2363-I2447 HydrophobicContact CB-CG1 3.85Å; V2363-I2447 HydrophobicContact CB-CG2 3.86Å; V2363-I2447 PolarHBondContact N-O 2.88Å; V2363-I2447 PolarHBondContact O-N 3.14Å; I2447-L2449 HydrophobicContact CD1-CD1 4.28Å; I2447-L2449 HydrophobicContact CD1-CD2 3.95Å; I2447-L2449 HydrophobicContact CD1-CG 4.3Å; I2447-L2449 HydrophobicContact CG1-CD2 3.84Å; I2447-L2449 HydrophobicContact CG1-CG 4.21Å; I2447-L2449 HydrophobicContact CG2-CG 4.48Å; I2447-F2455 HydrophobicContact CB-CZ 4.41Å; I2447-F2455 HydrophobicContact CG1-CE1 4.37Å; I2447-F2455 HydrophobicContact CG1-CE2 4.46Å; I2447-F2455 HydrophobicContact CG1-CZ 3.8Å
2448	A	81.1	Confident	75.5	Confident	12.6667 Å²	12.6667	38.9 Å²	38.9	11%	0.105	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	137.7	168.8	0	0	0	0	0	109.8	M2349 M2351 H2361 I2362 V2452 F2455	M2349-A2448 HydrophobicContact CE-CB 4.49Å; M2349-A2448 HydrophobicContact SD-CB 4.45Å; M2351-A2448 HydrophobicContact CE-CB 4.47Å; M2351-A2448 HydrophobicContact SD-CB 3.58Å; M2351-A2448 VanDerWaalsContact SD-CB 3.58Å; H2361-A2448 CarbonylContact O-C 3.53Å; H2361-A2448 VanDerWaalsContact O-CA 3.28Å; H2361-A2448 WeakPolarHBondContact O-CA 3.32Å; I2362-A2448 HydrophobicContact CG1-CB 4.44Å; A2448-V2452 HydrophobicContact CB-CB 4.48Å; A2448-V2452 HydrophobicContact CB-CG1 4.14Å; A2448-V2452 HydrophobicContact CB-CG2 4.09Å; A2448-F2455 HydrophobicContact CB-CB 4.07Å; A2448-F2455 HydrophobicContact CB-CD1 3.75Å; A2448-F2455 HydrophobicContact CB-CD2 3.99Å; A2448-F2455 HydrophobicContact CB-CE1 4.19Å; A2448-F2455 HydrophobicContact CB-CE2 3.87Å; A2448-F2455 HydrophobicContact CB-CG 3.66Å; A2448-F2455 HydrophobicContact CB-CZ 4.13Å; A2448-F2455 WeakPolarHBondContact O-CE1 3.34Å
2449	L	81.1	Confident	74.5	Confident	63 Å²	63	39.6 Å²	39.6	33%	0.33	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	155.6	-172.4	-59.4	174	0	0	0	110.3	I2309 I2313 F2360 H2361 V2363 I2447	I2309-L2449 HydrophobicContact CG2-CB 4.28Å; I2309-L2449 HydrophobicContact CG2-CD1 4.42Å; I2313-L2449 HydrophobicContact CG1-CD1 4.22Å; F2360-L2449 CarbonylContact C-O 3.49Å; F2360-L2449 VanDerWaalsContact CA-O 3.25Å; F2360-L2449 WeakPolarHBondContact CA-O 3.32Å; F2360-L2449 VanDerWaalsContact CB-O 3.31Å; F2360-L2449 WeakPolarHBondContact CB-O 3.42Å; H2361-L2449 HydrophobicContact CB-CB 4.4Å; H2361-L2449 PolarHBondContact N-O 3.01Å; H2361-L2449 PolarHBondContact O-N 2.91Å; V2363-L2449 HydrophobicContact CG2-CD1 4.07Å; I2447-L2449 HydrophobicContact CD1-CD1 4.28Å; I2447-L2449 HydrophobicContact CD1-CD2 3.95Å; I2447-L2449 HydrophobicContact CD1-CG 4.3Å; I2447-L2449 HydrophobicContact CG1-CD2 3.84Å; I2447-L2449 HydrophobicContact CG1-CG 4.21Å; I2447-L2449 HydrophobicContact CG2-CG 4.48Å
2450	G	83.4	Confident	73.4	Confident	39.3333 Å²	39.3333	36.7 Å²	36.7	41%	0.405	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	90.9	-141.5	-176.2	0	0	0	0	0	112.2	H2305 V2452	H2305-G2450 PolarHBondContact ND1-O 3.03Å; G2450-V2452 PolarHBondContact O-N 2.9Å
2451	D	84.5	Confident	72.5	Confident	48.3333 Å²	48.3333	37.9 Å²	37.9	26%	0.258	21%	0.207	S	C	.	.	S	Bend	trans	-78.1	43.4	-168.4	-57.9	-36.9	0	0	0	114.2	V2353 N2354 A2357 K2358 K2359	V2353-D2451 WeakPolarHBondContact CA-O 3.28Å; V2353-D2451 WeakPolarHBondContact CG1-O 3.49Å; N2354-D2451 HydrophobicContact CB-CB 4.48Å; N2354-D2451 PolarHBondContact N-O 3.12Å; N2354-D2451 VanDerWaalsContact ND2-C 3.33Å; N2354-D2451 PolarHBondContact ND2-O 3.42Å; A2357-D2451 HydrophobicContact CB-CB 3.4Å; A2357-D2451 VanDerWaalsContact CB-CB 3.43Å; K2358-D2451 WeakPolarHBondContact CA-OD2 3.41Å; K2358-D2451 PolarHBondContact N-OD2 2.89Å; K2359-D2451 PolarHBondContact N-OD2 2.99Å; K2359-D2451 WeakPolarHBondContact O-CB 3.31Å; K2359-D2451 VanDerWaalsContact O-CG 3.29Å; K2359-D2451 PolarHBondContact O-N 2.83Å; K2359-D2451 VanDerWaalsContact O-OD2 3.1Å
2452	V	79.8	Confident	71.7	Confident	17.3333 Å²	17.3333	39.7 Å²	39.7	11%	0.105	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	130.2	-179.2	-175.2	0	0	0	0	110.1	H2305 M2351 K2352 N2354 F2360 A2448 G2450 S2454 F2455	H2305-V2452 PolarHBondContact CE1-O 2.83Å; M2351-V2452 HydrophobicContact CB-CG1 4.32Å; M2351-V2452 HydrophobicContact CG-CG1 3.59Å; M2351-V2452 HydrophobicContact CG-CG2 4.43Å; M2351-V2452 HydrophobicContact SD-CB 4.4Å; M2351-V2452 HydrophobicContact SD-CG1 3.75Å; M2351-V2452 HydrophobicContact SD-CG2 3.68Å; K2352-V2452 WeakPolarHBondContact O-CG1 3.46Å; N2354-V2452 PolarHBondContact ND2-O 3.2Å; F2360-V2452 HydrophobicContact CB-CG2 3.52Å; F2360-V2452 HydrophobicContact CD1-CG2 4.49Å; F2360-V2452 HydrophobicContact CD2-CG2 4.29Å; F2360-V2452 HydrophobicContact CG-CG2 3.99Å; A2448-V2452 HydrophobicContact CB-CB 4.48Å; A2448-V2452 HydrophobicContact CB-CG1 4.14Å; A2448-V2452 HydrophobicContact CB-CG2 4.09Å; G2450-V2452 PolarHBondContact O-N 2.9Å; V2452-S2454 WeakPolarHBondContact CG1-O 3.22Å; V2452-F2455 HydrophobicContact CG1-CB 4.34Å; V2452-F2455 HydrophobicContact CG1-CD1 4.17Å
2453	E	78.4	Confident	70.3	Confident	52.3333 Å²	52.3333	43.2 Å²	43.2	25%	0.245	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	-46.6	175.3	-176.2	-161.7	110	0	0	110.7	E2312 I2313 K2314 K2352 N2354 I2497	E2312-E2453 WeakPolarHBondContact CA-OE2 3.32Å; E2312-E2453 WeakPolarHBondContact CB-OE2 3.36Å; E2312-E2453 VanDerWaalsContact CD-OE2 3.24Å; E2312-E2453 HydrophobicContact CG-CG 4.38Å; E2312-E2453 WeakPolarHBondContact CG-OE2 3.43Å; I2313-E2453 WeakPolarHBondContact O-CG 3.39Å; K2314-E2453 HydrophobicContact CG-CG 4.4Å; K2352-E2453 HydrophobicContact CB-CB 4.34Å; K2352-E2453 WeakPolarHBondContact CB-OE1 3.48Å; K2352-E2453 WeakPolarHBondContact CD-OE1 3.36Å; K2352-E2453 WeakPolarHBondContact CD-OE2 3.4Å; K2352-E2453 WeakPolarHBondContact CE-OE2 3.31Å; K2352-E2453 HydrophobicContact CG-CB 4.17Å; K2352-E2453 VanDerWaalsContact CG-CD 3.42Å; K2352-E2453 HydrophobicContact CG-CG 4.34Å; K2352-E2453 WeakPolarHBondContact CG-OE1 2.87Å; K2352-E2453 VanDerWaalsContact CG-OE2 3.27Å; K2352-E2453 WeakPolarHBondContact CG-OE2 3.19Å; K2352-E2453 IonicContact NZ-OE1 3.29Å; K2352-E2453 PolarHBondContact NZ-OE1 2.87Å; K2352-E2453 IonicContact NZ-OE2 3.53Å; K2352-E2453 PolarHBondContact NZ-OE2 2.95Å; K2352-E2453 WeakPolarHBondContact O-CB 3.34Å; K2352-E2453 PolarHBondContact O-N 2.89Å; N2354-E2453 WeakPolarHBondContact OD1-CA 3.22Å; N2354-E2453 WeakPolarHBondContact OD1-CB 3.27Å; N2354-E2453 PolarHBondContact OD1-N 2.8Å; E2453-I2497 WeakPolarHBondContact O-CD1 3.14Å
2454	S	76.5	Confident	68.7	Low	36.3333 Å²	36.3333	48.2 Å²	48.2	25%	0.254	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	153.2	177.6	58	0	0	0	0	112.1	M2351 K2352 V2452	M2351-S2454 CarbonylContact C-O 3.51Å; M2351-S2454 WeakPolarHBondContact CA-O 3.38Å; M2351-S2454 WeakPolarHBondContact CB-O 3.44Å; M2351-S2454 WeakPolarHBondContact CG-O 3.38Å; K2352-S2454 WeakPolarHBondContact CB-OG 3.43Å; K2352-S2454 PolarHBondContact N-O 2.99Å; K2352-S2454 PolarHBondContact O-N 2.85Å; V2452-S2454 WeakPolarHBondContact CG1-O 3.22Å
2455	F	75.1	Confident	67	Low	50.6667 Å²	50.6667	48.1 Å²	48.1	22%	0.222	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	139.2	175.9	97.7	-94.4	0	0	0	112.5	M2349 T2350 M2351 I2362 V2446 I2447 A2448 V2452 P2457	M2349-F2455 HydrophobicContact CB-CE2 3.9Å; M2349-F2455 HydrophobicContact CB-CZ 4.24Å; M2349-F2455 HydrophobicContact CE-CD2 3.91Å; M2349-F2455 HydrophobicContact CG-CB 4.3Å; M2349-F2455 HydrophobicContact CG-CE2 4.02Å; M2349-F2455 HydrophobicContact CG-CZ 3.84Å; M2349-F2455 HydrophobicContact SD-CB 4.16Å; M2349-F2455 HydrophobicContact SD-CE2 4.22Å; M2349-F2455 HydrophobicContact SD-CZ 3.9Å; T2350-F2455 CarbonylContact O-C 3.54Å; T2350-F2455 WeakPolarHBondContact O-CA 3.34Å; M2351-F2455 HydrophobicContact CB-CB 3.98Å; M2351-F2455 HydrophobicContact CB-CD2 4.15Å; M2351-F2455 HydrophobicContact CE-CD2 3.85Å; M2351-F2455 HydrophobicContact CE-CE2 3.86Å; M2351-F2455 HydrophobicContact CG-CB 4.04Å; M2351-F2455 HydrophobicContact SD-CB 4.41Å; I2362-F2455 HydrophobicContact CG2-CZ 4.18Å; V2446-F2455 HydrophobicContact CG1-CE1 4.07Å; V2446-F2455 HydrophobicContact CG1-CZ 3.86Å; I2447-F2455 HydrophobicContact CB-CZ 4.41Å; I2447-F2455 HydrophobicContact CG1-CE1 4.37Å; I2447-F2455 HydrophobicContact CG1-CE2 4.46Å; I2447-F2455 HydrophobicContact CG1-CZ 3.8Å; A2448-F2455 HydrophobicContact CB-CB 4.07Å; A2448-F2455 HydrophobicContact CB-CD1 3.75Å; A2448-F2455 HydrophobicContact CB-CD2 3.99Å; A2448-F2455 HydrophobicContact CB-CE1 4.19Å; A2448-F2455 HydrophobicContact CB-CE2 3.87Å; A2448-F2455 HydrophobicContact CB-CG 3.66Å; A2448-F2455 HydrophobicContact CB-CZ 4.13Å; A2448-F2455 WeakPolarHBondContact O-CE1 3.34Å; V2452-F2455 HydrophobicContact CG1-CB 4.34Å; V2452-F2455 HydrophobicContact CG1-CD1 4.17Å; F2455-P2457 HydrophobicContact CD1-CB 4.47Å; F2455-P2457 HydrophobicContact CD1-CG 3.94Å; F2455-P2457 HydrophobicContact CD2-CG 4.12Å; F2455-P2457 HydrophobicContact CE1-CB 3.76Å; F2455-P2457 HydrophobicContact CE1-CG 3.61Å; F2455-P2457 HydrophobicContact CE2-CG 4.1Å; F2455-P2457 HydrophobicContact CZ-CB 4.04Å; F2455-P2457 HydrophobicContact CZ-CG 4.37Å
2456	E	69.5	Low	65.1	Low	112.333 Å²	112.333	54.3 Å²	54.3	53%	0.525	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	94.1	-178.8	-66.7	-178.4	164.7	0	0	110.8	M2349 T2350 T2458 K2501 K2667	M2349-E2456 WeakPolarHBondContact CA-O 3.37Å; T2350-E2456 PolarHBondContact N-O 2.96Å; T2350-E2456 VanDerWaalsContact N-O 3.12Å; T2350-E2456 PolarHBondContact O-N 3Å; T2350-E2456 PolarHBondContact OG1-OE2 3.02Å; T2350-E2456 VanDerWaalsContact OG1-OE2 3.11Å; E2456-T2458 PolarHBondContact O-N 2.85Å; E2456-K2501 VanDerWaalsContact OE1-CE 3.25Å; E2456-K2501 WeakPolarHBondContact OE1-CE 3.47Å; E2456-K2501 IonicContact OE1-NZ 3.99Å; E2456-K2501 PolarHBondContact OE1-NZ 3.23Å; E2456-K2667 IonicContact OE2-NZ 3.76Å; E2456-K2667 PolarHBondContact OE2-NZ 2.79Å
2457	P	69.6	Low	63	Low	27 Å²	27	59 Å²	59	18%	0.175	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	123	178.7	32.8	-29.5	0	0	0	112	F2348 M2349 V2446 F2455 G2491	F2348-P2457 CarbonylContact O-C 3.49Å; F2348-P2457 WeakPolarHBondContact O-CA 3.32Å; M2349-P2457 HydrophobicContact CE-CB 3.98Å; M2349-P2457 HydrophobicContact CG-CB 4.19Å; V2446-P2457 HydrophobicContact CB-CB 4.03Å; V2446-P2457 HydrophobicContact CG1-CB 4.28Å; F2455-P2457 HydrophobicContact CD1-CB 4.47Å; F2455-P2457 HydrophobicContact CD1-CG 3.94Å; F2455-P2457 HydrophobicContact CD2-CG 4.12Å; F2455-P2457 HydrophobicContact CE1-CB 3.76Å; F2455-P2457 HydrophobicContact CE1-CG 3.61Å; F2455-P2457 HydrophobicContact CE2-CG 4.1Å; F2455-P2457 HydrophobicContact CZ-CB 4.04Å; F2455-P2457 HydrophobicContact CZ-CG 4.37Å; P2457-G2491 PolarHBondContact O-N 3.36Å
2458	T	60.2	Low	61.1	Low	56 Å²	56	60.8 Å²	60.8	34%	0.344	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	120.6	174.3	-61.6	0	0	0	0	109.5	I2347 F2348 E2456 V2460 I2488	I2347-T2458 CarbonylContact C-O 3.52Å; I2347-T2458 WeakPolarHBondContact CA-O 3.48Å; F2348-T2458 PolarHBondContact N-O 2.96Å; F2348-T2458 PolarHBondContact O-N 3.47Å; E2456-T2458 PolarHBondContact O-N 2.85Å; T2458-V2460 HydrophobicContact CG2-CG2 4.39Å; T2458-I2488 HydrophobicContact CG2-CG2 3.82Å
2459	I	62.5	Low	59.2	Low	18.3333 Å²	18.3333	67.6 Å²	67.6	9%	0.094	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	125.1	179.8	-50	165	0	0	0	108.9	A2344 M2346 I2347 V2443 V2446 Y2461 N2489 P2493	A2344-I2459 HydrophobicContact CB-CG2 4.29Å; M2346-I2459 CarbonylContact O-C 3.55Å; I2347-I2459 HydrophobicContact CG1-CG1 4.47Å; I2347-I2459 HydrophobicContact CG1-CG2 4.5Å; I2347-I2459 HydrophobicContact CG2-CG1 4.37Å; V2443-I2459 HydrophobicContact CB-CD1 4.08Å; V2443-I2459 HydrophobicContact CB-CG2 4.12Å; V2443-I2459 HydrophobicContact CG1-CD1 3.65Å; V2443-I2459 HydrophobicContact CG1-CG1 4.28Å; V2443-I2459 HydrophobicContact CG2-CG2 4.44Å; V2446-I2459 HydrophobicContact CG2-CD1 4.29Å; V2446-I2459 HydrophobicContact CG2-CG1 4.39Å; I2459-Y2461 HydrophobicContact CB-CE2 4.31Å; I2459-Y2461 HydrophobicContact CG2-CD2 4.16Å; I2459-Y2461 HydrophobicContact CG2-CE2 3.44Å; I2459-Y2461 VanDerWaalsContact CG2-CE2 3.44Å; I2459-N2489 HydrophobicContact CB-CB 4.33Å; I2459-N2489 WeakPolarHBondContact CB-O 3.4Å; I2459-N2489 PolarHBondContact N-O 2.89Å; I2459-N2489 PolarHBondContact O-N 2.89Å; I2459-P2493 HydrophobicContact CD1-CG 4.27Å
2460	V	55.3	Low	57.5	Low	20.3333 Å²	20.3333	73.1 Å²	73.1	12%	0.123	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	128.5	-178.9	-177.8	0	0	0	0	109.7	G2345 M2346 F2348 T2458 L2486 I2487 I2488 V2639 W2641	G2345-V2460 CarbonylContact C-O 3.59Å; G2345-V2460 WeakPolarHBondContact CA-O 3.49Å; G2345-V2460 PolarHBondContact N-O 2.84Å; M2346-V2460 HydrophobicContact CB-CB 4.25Å; M2346-V2460 HydrophobicContact CB-CG2 4.37Å; M2346-V2460 HydrophobicContact CE-CG2 4.43Å; M2346-V2460 PolarHBondContact N-O 3.03Å; M2346-V2460 PolarHBondContact O-N 2.84Å; F2348-V2460 HydrophobicContact CD2-CB 4.32Å; F2348-V2460 HydrophobicContact CD2-CG2 3.72Å; F2348-V2460 HydrophobicContact CE2-CB 3.92Å; F2348-V2460 HydrophobicContact CE2-CG2 3.61Å; T2458-V2460 HydrophobicContact CG2-CG2 4.39Å; V2460-L2486 HydrophobicContact CG1-CD2 3.74Å; V2460-I2487 CarbonylContact C-O 3.5Å; V2460-I2487 VanDerWaalsContact CA-O 3.29Å; V2460-I2487 WeakPolarHBondContact CA-O 3.44Å; V2460-I2488 HydrophobicContact CG2-CG1 4.4Å; V2460-V2639 HydrophobicContact CG1-CG1 3.92Å; V2460-W2641 HydrophobicContact CG1-CZ3 4.43Å; V2460-W2641 HydrophobicContact CG2-CE3 4.31Å; V2460-W2641 HydrophobicContact CG2-CZ3 3.87Å
2461	Y	55.3	Low	55.8	Low	26 Å²	26	77.4 Å²	77.4	10%	0.102	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	146.3	173.7	-68.2	-90.6	0	0	0	110.4	I2334 M2338 P2342 A2344 I2442 V2443 I2459 I2487 A2490	I2334-Y2461 HydrophobicContact CG2-CE1 4.28Å; M2338-Y2461 HydrophobicContact CE-CD1 3.89Å; M2338-Y2461 HydrophobicContact CE-CG 4.19Å; P2342-Y2461 WeakPolarHBondContact O-CD1 3.47Å; P2342-Y2461 WeakPolarHBondContact O-CE1 3.3Å; A2344-Y2461 HydrophobicContact CB-CD1 4.16Å; A2344-Y2461 HydrophobicContact CB-CE1 3.83Å; I2442-Y2461 WeakPolarHBondContact CA-OH 3.43Å; I2442-Y2461 HydrophobicContact CG2-CE1 4.17Å; I2442-Y2461 VanDerWaalsContact CG2-OH 3.26Å; I2442-Y2461 WeakPolarHBondContact CG2-OH 3.39Å; V2443-Y2461 PolarHBondContact N-OH 2.9Å; V2443-Y2461 PolarHBondContact O-OH 3.05Å; I2459-Y2461 HydrophobicContact CB-CE2 4.31Å; I2459-Y2461 HydrophobicContact CG2-CD2 4.16Å; I2459-Y2461 HydrophobicContact CG2-CE2 3.44Å; I2459-Y2461 VanDerWaalsContact CG2-CE2 3.44Å; Y2461-I2487 PolarHBondContact N-O 2.94Å; Y2461-I2487 WeakPolarHBondContact O-CB 3.49Å; Y2461-I2487 PolarHBondContact O-N 2.95Å; Y2461-A2490 HydrophobicContact CD2-CB 4.18Å; Y2461-A2490 HydrophobicContact CE2-CB 3.99Å
2462	W	49.5	Very low	53.9	Low	82.6667 Å²	82.6667	83.4 Å²	83.4	31%	0.313	42%	0.416	S	S	.	.			trans	-93	127	179.5	-63.9	52.3	0	0	0	110.6	P2342 S2343 G2345 I2418 H2419 N2464 I2481 V2639	P2342-W2462 HydrophobicContact CB-CH2 4.27Å; P2342-W2462 HydrophobicContact CB-CZ3 4.23Å; S2343-W2462 PolarHBondContact O-NE1 3.31Å; G2345-W2462 VanDerWaalsContact CA-CD1 3.45Å; G2345-W2462 VanDerWaalsContact CA-CD2 3.43Å; G2345-W2462 VanDerWaalsContact CA-CE2 3.42Å; G2345-W2462 WeakPolarHBondContact O-CH2 3.23Å; G2345-W2462 VanDerWaalsContact O-CZ2 3.29Å; G2345-W2462 WeakPolarHBondContact O-CZ2 3.48Å; I2418-W2462 WeakPolarHBondContact O-CH2 3.43Å; I2418-W2462 WeakPolarHBondContact O-CZ3 3.48Å; H2419-W2462 HydrophobicContact CB-CZ3 4.32Å; H2419-W2462 AromaticContact CD2-CZ3 3.81Å; W2462-N2464 PolarHBondContact O-N 2.96Å; W2462-N2464 VanDerWaalsContact O-N 3.11Å; W2462-I2481 HydrophobicContact CH2-CD1 4.16Å; W2462-I2481 HydrophobicContact CZ3-CD1 4.39Å; W2462-V2639 VanDerWaalsContact CD1-CG2 3.43Å; W2462-V2639 HydrophobicContact CG-CG2 4.14Å
2463	K	40.1	Very low	52.5	Low	109 Å²	109	86.8 Å²	86.8	47%	0.474	43%	0.434	S	S	.	.			trans	-92.4	117.6	169.7	-167.1	171.2	-175.5	177.8	0	108.9	S2465 E2485 I2487 S2495	K2463-S2465 PolarHBondContact O-N 2.7Å; K2463-E2485 WeakPolarHBondContact CB-O 3.32Å; K2463-E2485 PolarHBondContact N-O 2.67Å; K2463-E2485 IonicContact NZ-OE2 3.68Å; K2463-E2485 PolarHBondContact NZ-OE2 2.96Å; K2463-I2487 HydrophobicContact CB-CD1 4.05Å; K2463-I2487 HydrophobicContact CB-CG1 4.06Å; K2463-I2487 HydrophobicContact CD-CD1 4.28Å; K2463-I2487 HydrophobicContact CD-CG1 4.06Å; K2463-I2487 HydrophobicContact CG-CD1 3.99Å; K2463-I2487 HydrophobicContact CG-CG1 4.21Å; K2463-S2495 PolarHBondContact NZ-O 3.44Å
2464	N	37.4	Very low	50.9	Low	110.333 Å²	110.333	85.5 Å²	85.5	59%	0.59	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-36.4	107.8	178.4	-65.6	-38.3	0	0	0	111.7	S2341 W2462 K2466 R2637	S2341-N2464 WeakPolarHBondContact CB-ND2 3.49Å; S2341-N2464 PolarHBondContact OG-ND2 2.82Å; W2462-N2464 PolarHBondContact O-N 2.96Å; W2462-N2464 VanDerWaalsContact O-N 3.11Å; N2464-K2466 PolarHBondContact O-N 3.19Å; N2464-R2637 WeakPolarHBondContact OD1-CD 3.31Å; N2464-R2637 PolarHBondContact OD1-NE 2.91Å
2465	S	34.6	Very low	49.5	Very low	69 Å²	69	85.2 Å²	85.2	48%	0.483	43%	0.433	S	S	.	.			trans	-81.6	130.5	161.6	-168.1	0	0	0	0	109.8	K2463 Q2478 T2479 I2636	K2463-S2465 PolarHBondContact O-N 2.7Å; S2465-Q2478 VanDerWaalsContact OG-CG 3.3Å; S2465-Q2478 WeakPolarHBondContact OG-CG 3.32Å; S2465-T2479 PolarHBondContact OG-OG1 2.92Å; S2465-I2636 VanDerWaalsContact CB-O 3.3Å; S2465-I2636 WeakPolarHBondContact CB-O 3.38Å
2466	K	34.7	Very low	48.2	Very low	146.333 Å²	146.333	87.9 Å²	87.9	64%	0.636	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-75.6	151.4	170.4	-62.8	-173.7	-178.3	176.8	0	109.4	D2340 N2464 P2493 S2494	D2340-K2466 WeakPolarHBondContact OD1-CE 3.42Å; D2340-K2466 IonicContact OD1-NZ 3.54Å; D2340-K2466 WeakPolarHBondContact OD2-CE 3.3Å; D2340-K2466 IonicContact OD2-NZ 2.74Å; N2464-K2466 PolarHBondContact O-N 3.19Å; K2466-P2493 HydrophobicContact CD-CG 3.88Å; K2466-P2493 WeakPolarHBondContact CE-O 3.4Å; K2466-P2493 PolarHBondContact NZ-O 3.04Å; K2466-S2494 PolarHBondContact NZ-OG 3.46Å
2467	S	35.4	Very low	47	Very low	103 Å²	103	84.2 Å²	84.2	72%	0.72	44%	0.437	S	S	*	.	S	Bend	trans	-55.5	143.3	177.7	23.1	0	0	0	0	111.7	Q2469	S2467-Q2469 PolarHBondContact O-N 2.7Å
2468	P	39.2	Very low	45.7	Very low	77.3333 Å²	77.3333	88.2 Å²	88.2	50%	0.502	45%	0.453	S	S	.	.	P	Polyproline II helix	trans	-56.4	135.9	178.4	8	-11.8	0	0	0	110.7	R2470 F2476 G2477 V2633 I2636	P2468-R2470 PolarHBondContact O-N 2.95Å; P2468-F2476 HydrophobicContact CB-CB 4.38Å; P2468-F2476 HydrophobicContact CB-CE1 4.02Å; P2468-F2476 HydrophobicContact CG-CD1 4.38Å; P2468-G2477 WeakPolarHBondContact CA-O 3.01Å; P2468-V2633 WeakPolarHBondContact CG-O 3.33Å; P2468-I2636 HydrophobicContact CB-CD1 4.18Å; P2468-I2636 HydrophobicContact CB-CG1 4.17Å
2469	Q	41	Very low	44.7	Very low	155.333 Å²	155.333	90.5 Å²	90.5	73%	0.726	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-75.4	130.5	176.7	-67.5	-176.5	-83.3	0	0	109.2	S2467 G2477	S2467-Q2469 PolarHBondContact O-N 2.7Å; Q2469-G2477 PolarHBondContact N-O 2.87Å; Q2469-G2477 PolarHBondContact O-N 2.93Å
2470	R	45	Very low	43.5	Very low	177.333 Å²	177.333	97.9 Å²	97.9	67%	0.669	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-74.4	135.6	161.1	-117	179	175.8	178.6	-3.2	108.2	P2468 G2474 S2475 F2476	P2468-R2470 PolarHBondContact O-N 2.95Å; R2470-G2474 WeakPolarHBondContact CG-O 3.39Å; R2470-G2474 PolarHBondContact NE-O 2.77Å; R2470-S2475 CarbonylContact C-O 3.55Å; R2470-S2475 VanDerWaalsContact CA-O 3.31Å; R2470-S2475 WeakPolarHBondContact CA-O 3.43Å; R2470-F2476 HydrophobicContact CB-CE1 4.4Å; R2470-F2476 HydrophobicContact CG-CE1 4.3Å; R2470-F2476 HydrophobicContact CG-CE2 4.48Å; R2470-F2476 HydrophobicContact CG-CZ 4.27Å
2471	Y	47.4	Very low	42.6	Very low	130.667 Å²	130.667	100.3 Å²	100.3	51%	0.512	51%	0.51	S	S	.	.	P	Polyproline II helix	trans	-79.1	162.2	160.3	-67.4	-72.8	0	0	0	109.9	D2473 G2474 S2475 Q2624 T2626	Y2471-D2473 WeakPolarHBondContact CB-OD1 3.39Å; Y2471-D2473 WeakPolarHBondContact CB-OD2 3.3Å; Y2471-D2473 PolarHBondContact O-N 2.97Å; Y2471-D2473 VanDerWaalsContact O-N 3.17Å; Y2471-G2474 WeakPolarHBondContact O-CA 3.34Å; Y2471-G2474 PolarHBondContact O-N 3Å; Y2471-S2475 PolarHBondContact N-O 3.18Å; Y2471-Q2624 PolarHBondContact OH-NE2 3.1Å; Y2471-Q2624 VanDerWaalsContact OH-NE2 3.13Å; Y2471-T2626 HydrophobicContact CD2-CG2 4.39Å; Y2471-T2626 HydrophobicContact CE2-CG2 3.75Å
2472	D	45.2	Very low	41.5	Very low	174 Å²	174	106.7 Å²	106.7	93%	0.93	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-16.9	-178.1	-58.1	-50.4	0	0	0	113	G2474	D2472-G2474 VanDerWaalsContact C-N 3.26Å; D2472-G2474 PolarHBondContact O-N 3.05Å
2473	D	50.4	Low	40.7	Very low	88 Å²	88	106.7 Å²	106.7	47%	0.471	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-8.9	168.5	52.2	39.9	0	0	0	114.2	Y2471 S2475	Y2471-D2473 WeakPolarHBondContact CB-OD1 3.39Å; Y2471-D2473 WeakPolarHBondContact CB-OD2 3.3Å; Y2471-D2473 PolarHBondContact O-N 2.97Å; Y2471-D2473 VanDerWaalsContact O-N 3.17Å; D2473-S2475 VanDerWaalsContact C-N 3.32Å; D2473-S2475 PolarHBondContact O-N 3.14Å; D2473-S2475 WeakPolarHBondContact OD1-CB 3.31Å; D2473-S2475 PolarHBondContact OD1-N 3.08Å; D2473-S2475 PolarHBondContact OD1-OG 3.25Å; D2473-S2475 PolarHBondContact OD2-OG 2.98Å
2474	G	45.7	Very low	40.3	Very low	26.3333 Å²	26.3333	107.3 Å²	107.3	27%	0.271	55%	0.55	S	S	.	.			trans	76.1	0.2	-174.3	0	0	0	0	0	115.3	R2470 Y2471 D2472	R2470-G2474 WeakPolarHBondContact CG-O 3.39Å; R2470-G2474 PolarHBondContact NE-O 2.77Å; Y2471-G2474 WeakPolarHBondContact O-CA 3.34Å; Y2471-G2474 PolarHBondContact O-N 3Å; D2472-G2474 VanDerWaalsContact C-N 3.26Å; D2472-G2474 PolarHBondContact O-N 3.05Å
2475	S	47.5	Very low	40	Very low	30 Å²	30	106.7 Å²	106.7	21%	0.21	54%	0.543	C	S	.	.			trans	-73.8	155.6	-176	75.3	0	0	0	0	113.7	R2470 Y2471 D2473 I2627	R2470-S2475 CarbonylContact C-O 3.55Å; R2470-S2475 VanDerWaalsContact CA-O 3.31Å; R2470-S2475 WeakPolarHBondContact CA-O 3.43Å; Y2471-S2475 PolarHBondContact N-O 3.18Å; D2473-S2475 VanDerWaalsContact C-N 3.32Å; D2473-S2475 PolarHBondContact O-N 3.14Å; D2473-S2475 WeakPolarHBondContact OD1-CB 3.31Å; D2473-S2475 PolarHBondContact OD1-N 3.08Å; D2473-S2475 PolarHBondContact OD1-OG 3.25Å; D2473-S2475 PolarHBondContact OD2-OG 2.98Å; S2475-I2627 WeakPolarHBondContact CA-O 3.32Å; S2475-I2627 WeakPolarHBondContact CB-O 3.5Å
2476	F	46.7	Very low	39.9	Very low	105.667 Å²	105.667	105.7 Å²	105.7	46%	0.463	53%	0.532	S	S	.	.			trans	-119.3	91.9	180	-85.2	-90.4	0	0	0	110.3	P2468 R2470 Q2478 T2626 I2627 V2631 V2633 I2636	P2468-F2476 HydrophobicContact CB-CB 4.38Å; P2468-F2476 HydrophobicContact CB-CE1 4.02Å; P2468-F2476 HydrophobicContact CG-CD1 4.38Å; R2470-F2476 HydrophobicContact CB-CE1 4.4Å; R2470-F2476 HydrophobicContact CG-CE1 4.3Å; R2470-F2476 HydrophobicContact CG-CE2 4.48Å; R2470-F2476 HydrophobicContact CG-CZ 4.27Å; F2476-Q2478 PolarHBondContact O-N 3.41Å; F2476-T2626 CarbonylContact O-C 3.54Å; F2476-T2626 VanDerWaalsContact O-CA 3.26Å; F2476-T2626 WeakPolarHBondContact O-CA 3.24Å; F2476-I2627 PolarHBondContact N-O 2.83Å; F2476-I2627 PolarHBondContact O-N 2.93Å; F2476-V2631 WeakPolarHBondContact CE2-O 3.21Å; F2476-V2633 HydrophobicContact CB-CB 3.67Å; F2476-V2633 HydrophobicContact CB-CG1 4.29Å; F2476-V2633 HydrophobicContact CB-CG2 3.91Å; F2476-V2633 HydrophobicContact CD1-CB 3.94Å; F2476-V2633 HydrophobicContact CD2-CB 4.05Å; F2476-V2633 HydrophobicContact CD2-CG2 3.84Å; F2476-V2633 HydrophobicContact CG-CB 3.62Å; F2476-V2633 HydrophobicContact CG-CG2 3.89Å; F2476-I2636 HydrophobicContact CB-CD1 4.44Å; F2476-I2636 VanDerWaalsContact O-CD1 3.28Å; F2476-I2636 WeakPolarHBondContact O-CD1 3.49Å
2477	G	44.3	Very low	39.6	Very low	35.3333 Å²	35.3333	102.5 Å²	102.5	36%	0.364	52%	0.521	S	S	.	.			trans	-78.4	118	-177.9	0	0	0	0	0	114.4	P2468 Q2469 T2479	P2468-G2477 WeakPolarHBondContact CA-O 3.01Å; Q2469-G2477 PolarHBondContact N-O 2.87Å; Q2469-G2477 PolarHBondContact O-N 2.93Å; G2477-T2479 PolarHBondContact O-N 3.44Å
2478	Q	43.2	Very low	39.4	Very low	111 Å²	111	101.6 Å²	101.6	52%	0.519	51%	0.507	S	S	.	.			trans	-81.4	109.8	172.6	-135.8	-174.2	7.8	0	0	111.2	S2465 F2476 K2480 V2625 I2636 T2638	S2465-Q2478 VanDerWaalsContact OG-CG 3.3Å; S2465-Q2478 WeakPolarHBondContact OG-CG 3.32Å; F2476-Q2478 PolarHBondContact O-N 3.41Å; Q2478-K2480 PolarHBondContact O-N 3.07Å; Q2478-V2625 PolarHBondContact N-O 3.15Å; Q2478-I2636 HydrophobicContact CB-CB 4.48Å; Q2478-I2636 HydrophobicContact CB-CG2 4.06Å; Q2478-I2636 HydrophobicContact CG-CG2 4.47Å; Q2478-T2638 PolarHBondContact OE1-OG1 2.96Å
2479	T	37.8	Very low	39	Very low	104 Å²	104	101.9 Å²	101.9	64%	0.638	51%	0.505	S	S	*	.			trans	-82.3	117.4	170.6	12	0	0	0	0	110.9	S2465 G2477 I2481	S2465-T2479 PolarHBondContact OG-OG1 2.92Å; G2477-T2479 PolarHBondContact O-N 3.44Å; T2479-I2481 VanDerWaalsContact C-N 3.27Å; T2479-I2481 PolarHBondContact O-N 2.83Å; T2479-I2481 VanDerWaalsContact O-N 3.14Å
2480	K	37.3	Very low	38.6	Very low	173.333 Å²	173.333	97.5 Å²	97.5	75%	0.754	50%	0.495	S	S	*	.			trans	-35.8	87.9	175.8	-167.4	177	-175	175.7	0	112.4	Q2478 R2482	Q2478-K2480 PolarHBondContact O-N 3.07Å; K2480-R2482 PolarHBondContact O-N 3.4Å
2481	I	38.1	Very low	37.8	Very low	70.6667 Å²	70.6667	91.1 Å²	91.1	36%	0.362	48%	0.484	S	S	.	.			trans	-63.4	130.6	-171.6	-49.8	174.3	0	0	0	110.7	T2335 W2462 T2479 E2485 L2486 T2638 Y2640	T2335-I2481 HydrophobicContact CG2-CD1 4.1Å; W2462-I2481 HydrophobicContact CH2-CD1 4.16Å; W2462-I2481 HydrophobicContact CZ3-CD1 4.39Å; T2479-I2481 VanDerWaalsContact C-N 3.27Å; T2479-I2481 PolarHBondContact O-N 2.83Å; T2479-I2481 VanDerWaalsContact O-N 3.14Å; I2481-E2485 HydrophobicContact CG2-CB 3.84Å; I2481-L2486 HydrophobicContact CB-CD2 4.24Å; I2481-L2486 HydrophobicContact CD1-CD2 4.36Å; I2481-L2486 HydrophobicContact CG2-CD2 3.42Å; I2481-L2486 VanDerWaalsContact CG2-CD2 3.42Å; I2481-L2486 HydrophobicContact CG2-CG 4.08Å; I2481-T2638 HydrophobicContact CD1-CG2 4.12Å; I2481-Y2640 HydrophobicContact CD1-CE2 4.02Å
2482	R	32.2	Very low	37	Very low	160.333 Å²	160.333	87.5 Å²	87.5	61%	0.605	48%	0.478	S	S	*	.			trans	-86.3	153.6	178.7	-62.5	-174.9	-178	-166.9	1.4	111.6	K2480 E2484 E2485 L2486	K2480-R2482 PolarHBondContact O-N 3.4Å; R2482-E2484 HydrophobicContact CB-CB 4.37Å; R2482-E2484 WeakPolarHBondContact CB-OE2 3.21Å; R2482-E2484 WeakPolarHBondContact CD-OE1 3.36Å; R2482-E2484 IonicContact NH1-OE1 2.69Å; R2482-E2484 PolarHBondContact O-N 2.92Å; R2482-E2485 HydrophobicContact CB-CG 4.2Å; R2482-E2485 VanDerWaalsContact CB-OE1 3.32Å; R2482-E2485 WeakPolarHBondContact CB-OE1 3.46Å; R2482-E2485 VanDerWaalsContact CG-OE1 3.25Å; R2482-E2485 WeakPolarHBondContact CG-OE1 3.34Å; R2482-E2485 PolarHBondContact N-OE1 2.75Å; R2482-E2485 PolarHBondContact N-OE2 2.99Å; R2482-E2485 WeakPolarHBondContact O-CB 3.39Å; R2482-E2485 PolarHBondContact O-N 3.12Å; R2482-E2485 VanDerWaalsContact O-N 3.09Å; R2482-L2486 WeakPolarHBondContact O-CG 2.99Å
2483	P	31.4	Very low	36.3	Very low	82.6667 Å²	82.6667	81.8 Å²	81.8	54%	0.537	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-55.5	-21.5	177.6	-27.8	36.5	0	0	0	115.4	E2485	P2483-E2485 VanDerWaalsContact C-N 3.3Å; P2483-E2485 PolarHBondContact O-N 3.35Å
2484	E	31.4	Very low	35.3	Very low	123.333 Å²	123.333	80.8 Å²	80.8	58%	0.576	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-74.8	-23.5	-178.6	-58.4	122	-107.7	0	0	113.9	W2317 R2482 L2486	W2317-E2484 HydrophobicContact CH2-CG 4.02Å; R2482-E2484 HydrophobicContact CB-CB 4.37Å; R2482-E2484 WeakPolarHBondContact CB-OE2 3.21Å; R2482-E2484 WeakPolarHBondContact CD-OE1 3.36Å; R2482-E2484 IonicContact NH1-OE1 2.69Å; R2482-E2484 PolarHBondContact O-N 2.92Å; E2484-L2486 PolarHBondContact O-N 3.1Å
2485	E	31.4	Very low	34.7	Very low	96.3333 Å²	96.3333	82.5 Å²	82.5	45%	0.45	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-93.3	-0.3	-166.3	-66.5	177.3	160	0	0	114.7	K2463 I2481 R2482 P2483 I2487	K2463-E2485 WeakPolarHBondContact CB-O 3.32Å; K2463-E2485 PolarHBondContact N-O 2.67Å; K2463-E2485 IonicContact NZ-OE2 3.68Å; K2463-E2485 PolarHBondContact NZ-OE2 2.96Å; I2481-E2485 HydrophobicContact CG2-CB 3.84Å; R2482-E2485 HydrophobicContact CB-CG 4.2Å; R2482-E2485 VanDerWaalsContact CB-OE1 3.32Å; R2482-E2485 WeakPolarHBondContact CB-OE1 3.46Å; R2482-E2485 VanDerWaalsContact CG-OE1 3.25Å; R2482-E2485 WeakPolarHBondContact CG-OE1 3.34Å; R2482-E2485 PolarHBondContact N-OE1 2.75Å; R2482-E2485 PolarHBondContact N-OE2 2.99Å; R2482-E2485 WeakPolarHBondContact O-CB 3.39Å; R2482-E2485 PolarHBondContact O-N 3.12Å; R2482-E2485 VanDerWaalsContact O-N 3.09Å; P2483-E2485 VanDerWaalsContact C-N 3.3Å; P2483-E2485 PolarHBondContact O-N 3.35Å; E2485-I2487 VanDerWaalsContact C-N 3.33Å; E2485-I2487 PolarHBondContact O-N 2.97Å
2486	L	31.7	Very low	33.8	Very low	49.3333 Å²	49.3333	84.7 Å²	84.7	26%	0.258	48%	0.478	S	S	.	.	G	3₁₀ helix	trans	-92.6	69.1	-170.5	-88.2	167.1	0	0	0	113.1	V2460 I2481 R2482 E2484 I2488 R2522 Y2640	V2460-L2486 HydrophobicContact CG1-CD2 3.74Å; I2481-L2486 HydrophobicContact CB-CD2 4.24Å; I2481-L2486 HydrophobicContact CD1-CD2 4.36Å; I2481-L2486 HydrophobicContact CG2-CD2 3.42Å; I2481-L2486 VanDerWaalsContact CG2-CD2 3.42Å; I2481-L2486 HydrophobicContact CG2-CG 4.08Å; R2482-L2486 WeakPolarHBondContact O-CG 2.99Å; E2484-L2486 PolarHBondContact O-N 3.1Å; L2486-I2488 HydrophobicContact CD2-CD1 4.43Å; L2486-I2488 HydrophobicContact CD2-CG1 4.24Å; L2486-I2488 PolarHBondContact O-N 3.05Å; L2486-R2522 VanDerWaalsContact CD1-NH1 3.27Å; L2486-Y2640 HydrophobicContact CD1-CE1 4.13Å; L2486-Y2640 HydrophobicContact CD1-CE2 4.14Å; L2486-Y2640 HydrophobicContact CD2-CD2 3.59Å; L2486-Y2640 HydrophobicContact CD2-CE2 3.23Å; L2486-Y2640 HydrophobicContact CD2-CG 4.41Å; L2486-Y2640 HydrophobicContact CG-CE2 4.27Å
2487	I	29.7	Very low	33	Very low	79.3333 Å²	79.3333	84.9 Å²	84.9	41%	0.407	48%	0.483	S	S	.	.			trans	-99.2	93.7	-178.6	-50.6	176	0	0	0	111	V2460 Y2461 K2463 E2485 N2489 I2505	V2460-I2487 CarbonylContact C-O 3.5Å; V2460-I2487 VanDerWaalsContact CA-O 3.29Å; V2460-I2487 WeakPolarHBondContact CA-O 3.44Å; Y2461-I2487 PolarHBondContact N-O 2.94Å; Y2461-I2487 WeakPolarHBondContact O-CB 3.49Å; Y2461-I2487 PolarHBondContact O-N 2.95Å; K2463-I2487 HydrophobicContact CB-CD1 4.05Å; K2463-I2487 HydrophobicContact CB-CG1 4.06Å; K2463-I2487 HydrophobicContact CD-CD1 4.28Å; K2463-I2487 HydrophobicContact CD-CG1 4.06Å; K2463-I2487 HydrophobicContact CG-CD1 3.99Å; K2463-I2487 HydrophobicContact CG-CG1 4.21Å; E2485-I2487 VanDerWaalsContact C-N 3.33Å; E2485-I2487 PolarHBondContact O-N 2.97Å; I2487-N2489 HydrophobicContact CG2-CB 4.45Å; I2487-N2489 WeakPolarHBondContact CG2-ND2 3.15Å; I2487-N2489 PolarHBondContact O-N 3.24Å; I2487-I2505 HydrophobicContact CB-CG2 4.5Å; I2487-I2505 HydrophobicContact CG2-CG2 3.58Å
2488	I	31.5	Very low	32.4	Very low	82.3333 Å²	82.3333	84.7 Å²	84.7	42%	0.422	48%	0.481	S	S	.	.			trans	-107.4	101	168.9	-58	175.5	0	0	0	109.5	A2337 M2338 T2458 V2460 L2486	A2337-I2488 HydrophobicContact CB-CD1 4.23Å; M2338-I2488 HydrophobicContact CE-CD1 4.36Å; M2338-I2488 HydrophobicContact CG-CD1 3.94Å; M2338-I2488 HydrophobicContact SD-CD1 3.92Å; T2458-I2488 HydrophobicContact CG2-CG2 3.82Å; V2460-I2488 HydrophobicContact CG2-CG1 4.4Å; L2486-I2488 HydrophobicContact CD2-CD1 4.43Å; L2486-I2488 HydrophobicContact CD2-CG1 4.24Å; L2486-I2488 PolarHBondContact O-N 3.05Å
2489	N	30.9	Very low	31.8	Very low	84 Å²	84	85.7 Å²	85.7	45%	0.449	48%	0.48	S	S	.	.			trans	-102.7	120.8	169.3	-106.3	-20.8	0	0	0	110.1	I2459 I2487 G2491 N2642	I2459-N2489 HydrophobicContact CB-CB 4.33Å; I2459-N2489 WeakPolarHBondContact CB-O 3.4Å; I2459-N2489 PolarHBondContact N-O 2.89Å; I2459-N2489 PolarHBondContact O-N 2.89Å; I2487-N2489 HydrophobicContact CG2-CB 4.45Å; I2487-N2489 WeakPolarHBondContact CG2-ND2 3.15Å; I2487-N2489 PolarHBondContact O-N 3.24Å; N2489-G2491 VanDerWaalsContact C-N 3.31Å; N2489-G2491 PolarHBondContact O-N 2.87Å; N2489-N2642 PolarHBondContact ND2-O 3.08Å
2490	A	31	Very low	31.6	Very low	63.3333 Å²	63.3333	84.3 Å²	84.3	52%	0.523	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	98.8	179.6	0	0	0	0	0	112.1	Y2461 S2492	Y2461-A2490 HydrophobicContact CD2-CB 4.18Å; Y2461-A2490 HydrophobicContact CE2-CB 3.99Å; A2490-S2492 PolarHBondContact O-N 2.93Å
2491	G	29.8	Very low	31.4	Very low	43 Å²	43	79.3 Å²	79.3	44%	0.443	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	141.6	177.3	0	0	0	0	0	114.1	P2457 N2489 P2493	P2457-G2491 PolarHBondContact O-N 3.36Å; N2489-G2491 VanDerWaalsContact C-N 3.31Å; N2489-G2491 PolarHBondContact O-N 2.87Å; G2491-P2493 VanDerWaalsContact O-N 3.16Å
2492	S	30.3	Very low	31	Very low	54.6667 Å²	54.6667	78.6 Å²	78.6	38%	0.382	45%	0.454	S	S	.	.			trans	-48.7	132.8	-175.6	-167.8	0	0	0	0	115	N2445 A2490 S2494 S2495 R2637	N2445-S2492 VanDerWaalsContact OD1-CB 3.26Å; N2445-S2492 WeakPolarHBondContact OD1-CB 3.46Å; A2490-S2492 PolarHBondContact O-N 2.93Å; S2492-S2494 PolarHBondContact O-N 3.16Å; S2492-S2494 PolarHBondContact OG-OG 2.89Å; S2492-S2495 WeakPolarHBondContact O-CB 3.26Å; S2492-S2495 PolarHBondContact O-N 2.87Å; S2492-S2495 VanDerWaalsContact O-N 3.15Å; S2492-S2495 PolarHBondContact O-OG 2.78Å; S2492-R2637 PolarHBondContact OG-NH2 2.9Å
2493	P	29.4	Very low	31.1	Very low	54 Å²	54	74.2 Å²	74.2	35%	0.351	45%	0.445	S	S	.	.			trans	-110	90.8	165.1	10.7	6	0	0	0	115	R2444 I2459 K2466 G2491 S2495 I2636	R2444-P2493 WeakPolarHBondContact O-CG 3.28Å; I2459-P2493 HydrophobicContact CD1-CG 4.27Å; K2466-P2493 HydrophobicContact CD-CG 3.88Å; K2466-P2493 WeakPolarHBondContact CE-O 3.4Å; K2466-P2493 PolarHBondContact NZ-O 3.04Å; G2491-P2493 VanDerWaalsContact O-N 3.16Å; P2493-S2495 PolarHBondContact O-N 2.82Å; P2493-I2636 WeakPolarHBondContact CG-O 3.38Å
2494	S	29.8	Very low	31.1	Very low	67.6667 Å²	67.6667	75.2 Å²	75.2	47%	0.473	44%	0.442	S	S	.	.			trans	-112.3	36.1	173	66.7	0	0	0	0	117.5	K2301 K2466 S2492 R2634	K2301-S2494 PolarHBondContact NZ-O 3.36Å; K2466-S2494 PolarHBondContact NZ-OG 3.46Å; S2492-S2494 PolarHBondContact O-N 3.16Å; S2492-S2494 PolarHBondContact OG-OG 2.89Å; S2494-R2634 WeakPolarHBondContact CB-O 3.48Å
2495	S	32.7	Very low	31.2	Very low	62.3333 Å²	62.3333	74 Å²	74	44%	0.436	44%	0.439	S	S	.	.	S	Bend	trans	-94.8	131	166.4	64.4	0	0	0	0	115.4	K2463 S2492 P2493 I2497 G2498 R2499	K2463-S2495 PolarHBondContact NZ-O 3.44Å; S2492-S2495 WeakPolarHBondContact O-CB 3.26Å; S2492-S2495 PolarHBondContact O-N 2.87Å; S2492-S2495 VanDerWaalsContact O-N 3.15Å; S2492-S2495 PolarHBondContact O-OG 2.78Å; P2493-S2495 PolarHBondContact O-N 2.82Å; S2495-I2497 PolarHBondContact O-N 3.21Å; S2495-I2497 VanDerWaalsContact O-N 3.1Å; S2495-G2498 PolarHBondContact O-N 2.92Å; S2495-G2498 WeakPolarHBondContact OG-CA 3.39Å; S2495-G2498 PolarHBondContact OG-N 3.32Å; S2495-R2499 PolarHBondContact O-N 3.34Å
2496	A	30.1	Very low	31.3	Very low	76 Å²	76	73.7 Å²	73.7	63%	0.628	44%	0.44	S	S	*	.	H	α-helix	trans	-31.6	-1.8	161.6	0	0	0	0	0	115.5	G2498 R2499 A2500	A2496-G2498 PolarHBondContact O-N 3.02Å; A2496-R2499 WeakPolarHBondContact O-CB 3.42Å; A2496-R2499 PolarHBondContact O-N 3.38Å; A2496-A2500 PolarHBondContact O-N 2.89Å
2497	I	29.7	Very low	31.5	Very low	110.333 Å²	110.333	78 Å²	78	57%	0.566	46%	0.459	S	S	*	.	H	α-helix	trans	-38.1	-2.2	159.5	-64	167.9	0	0	0	114.4	E2453 S2495 R2499 A2500 K2501	E2453-I2497 WeakPolarHBondContact O-CD1 3.14Å; S2495-I2497 PolarHBondContact O-N 3.21Å; S2495-I2497 VanDerWaalsContact O-N 3.1Å; I2497-R2499 VanDerWaalsContact C-N 3.28Å; I2497-R2499 PolarHBondContact O-N 2.94Å; I2497-A2500 HydrophobicContact CG2-CB 4.46Å; I2497-A2500 WeakPolarHBondContact O-CA 3.44Å; I2497-A2500 PolarHBondContact O-N 2.93Å; I2497-K2501 WeakPolarHBondContact O-CB 3.25Å; I2497-K2501 PolarHBondContact O-N 3.06Å
2498	G	30.8	Very low	31.7	Very low	31 Å²	31	78.8 Å²	78.8	32%	0.32	47%	0.467	S	S	.	.	H	α-helix	trans	-77.4	-0.4	152.2	0	0	0	0	0	115.4	Y2333 S2495 A2496 L2502	Y2333-G2498 PolarHBondContact OH-O 2.9Å; Y2333-G2498 VanDerWaalsContact OH-O 3.05Å; S2495-G2498 PolarHBondContact O-N 2.92Å; S2495-G2498 WeakPolarHBondContact OG-CA 3.39Å; S2495-G2498 PolarHBondContact OG-N 3.32Å; A2496-G2498 PolarHBondContact O-N 3.02Å; G2498-L2502 WeakPolarHBondContact O-CB 3.48Å; G2498-L2502 PolarHBondContact O-N 2.82Å
2499	R	31	Very low	31.6	Very low	131.333 Å²	131.333	79 Å²	79	50%	0.496	48%	0.475	S	S	.	.	H	α-helix	trans	-102.4	-28.4	154.5	-86.9	-178.7	-156.8	174.3	-3.8	114.3	Y2333 S2495 A2496 I2497 K2501 L2502 T2503	Y2333-R2499 VanDerWaalsContact CE1-CZ 3.46Å; S2495-R2499 PolarHBondContact O-N 3.34Å; A2496-R2499 WeakPolarHBondContact O-CB 3.42Å; A2496-R2499 PolarHBondContact O-N 3.38Å; I2497-R2499 VanDerWaalsContact C-N 3.28Å; I2497-R2499 PolarHBondContact O-N 2.94Å; R2499-K2501 PolarHBondContact O-N 3.06Å; R2499-L2502 HydrophobicContact CG-CD1 4.14Å; R2499-L2502 HydrophobicContact CG-CD2 4.34Å; R2499-L2502 PolarHBondContact O-N 3.01Å; R2499-T2503 PolarHBondContact O-N 3.03Å; R2499-T2503 VanDerWaalsContact O-N 3.16Å; R2499-T2503 PolarHBondContact O-OG1 3.16Å
2500	A	32.6	Very low	31.7	Very low	74 Å²	74	83.1 Å²	83.1	61%	0.612	49%	0.489	S	S	*	.	H	α-helix	trans	-75.1	-18.3	178	0	0	0	0	0	113.3	A2496 I2497 L2502 T2503 E2504	A2496-A2500 PolarHBondContact O-N 2.89Å; I2497-A2500 HydrophobicContact CG2-CB 4.46Å; I2497-A2500 WeakPolarHBondContact O-CA 3.44Å; I2497-A2500 PolarHBondContact O-N 2.93Å; A2500-L2502 VanDerWaalsContact C-N 3.32Å; A2500-L2502 PolarHBondContact O-N 2.9Å; A2500-T2503 CarbonylContact O-C 3.57Å; A2500-T2503 WeakPolarHBondContact O-CA 3.4Å; A2500-T2503 WeakPolarHBondContact O-CB 3.38Å; A2500-T2503 PolarHBondContact O-N 2.93Å; A2500-T2503 VanDerWaalsContact O-N 3.12Å; A2500-E2504 PolarHBondContact O-N 2.99Å
2501	K	33.9	Very low	31.8	Very low	69.3333 Å²	69.3333	83.4 Å²	83.4	30%	0.301	49%	0.492	S	S	.	.	H	α-helix	trans	-97.9	-8.8	-176	-142.8	163.2	-173.3	164.4	0	113.4	E2456 I2497 R2499 T2503 E2504 I2505 E2519 L2644 T2645	E2456-K2501 VanDerWaalsContact OE1-CE 3.25Å; E2456-K2501 WeakPolarHBondContact OE1-CE 3.47Å; E2456-K2501 IonicContact OE1-NZ 3.99Å; E2456-K2501 PolarHBondContact OE1-NZ 3.23Å; I2497-K2501 WeakPolarHBondContact O-CB 3.25Å; I2497-K2501 PolarHBondContact O-N 3.06Å; R2499-K2501 PolarHBondContact O-N 3.06Å; K2501-T2503 VanDerWaalsContact C-N 3.32Å; K2501-E2504 WeakPolarHBondContact CE-OE2 3.44Å; K2501-E2504 HydrophobicContact CG-CB 4.16Å; K2501-E2504 WeakPolarHBondContact CG-OE2 3.4Å; K2501-E2504 PolarHBondContact O-N 3.02Å; K2501-I2505 HydrophobicContact CG-CD1 4.45Å; K2501-I2505 WeakPolarHBondContact O-CB 3.41Å; K2501-I2505 VanDerWaalsContact O-CD1 3.27Å; K2501-I2505 WeakPolarHBondContact O-CD1 3.34Å; K2501-I2505 VanDerWaalsContact O-CG1 3.24Å; K2501-I2505 WeakPolarHBondContact O-CG1 3.3Å; K2501-I2505 PolarHBondContact O-N 2.91Å; K2501-I2505 VanDerWaalsContact O-N 3.09Å; K2501-E2519 IonicContact NZ-OE1 3.19Å; K2501-L2644 HydrophobicContact CD-CD1 4.28Å; K2501-T2645 PolarHBondContact NZ-O 3.24Å
2502	L	30.4	Very low	32	Very low	55 Å²	55	86.5 Å²	86.5	29%	0.288	50%	0.504	S	S	.	.	H	α-helix	trans	-74.2	-33.8	173.2	-150.3	77.8	0	0	0	112.2	G2498 R2499 A2500 E2504 I2505 L2506 Q2624	G2498-L2502 WeakPolarHBondContact O-CB 3.48Å; G2498-L2502 PolarHBondContact O-N 2.82Å; R2499-L2502 HydrophobicContact CG-CD1 4.14Å; R2499-L2502 HydrophobicContact CG-CD2 4.34Å; R2499-L2502 PolarHBondContact O-N 3.01Å; A2500-L2502 VanDerWaalsContact C-N 3.32Å; A2500-L2502 PolarHBondContact O-N 2.9Å; L2502-E2504 VanDerWaalsContact C-N 3.3Å; L2502-E2504 PolarHBondContact O-N 3.33Å; L2502-I2505 PolarHBondContact O-N 3.01Å; L2502-L2506 HydrophobicContact CD2-CD1 3.99Å; L2502-L2506 HydrophobicContact CG-CD1 3.82Å; L2502-L2506 HydrophobicContact CG-CG 4.11Å; L2502-L2506 WeakPolarHBondContact O-CB 3.34Å; L2502-L2506 WeakPolarHBondContact O-CG 3.45Å; L2502-L2506 PolarHBondContact O-N 3.33Å; L2502-Q2624 HydrophobicContact CD2-CG 3.96Å
2503	T	32.9	Very low	32.1	Very low	68 Å²	68	89.3 Å²	89.3	42%	0.417	52%	0.521	S	S	.	.	H	α-helix	trans	-66.8	-44.4	173.9	-49	0	0	0	0	111.5	R2499 A2500 K2501 I2505 L2506 E2507	R2499-T2503 PolarHBondContact O-N 3.03Å; R2499-T2503 VanDerWaalsContact O-N 3.16Å; R2499-T2503 PolarHBondContact O-OG1 3.16Å; A2500-T2503 CarbonylContact O-C 3.57Å; A2500-T2503 WeakPolarHBondContact O-CA 3.4Å; A2500-T2503 WeakPolarHBondContact O-CB 3.38Å; A2500-T2503 PolarHBondContact O-N 2.93Å; A2500-T2503 VanDerWaalsContact O-N 3.12Å; K2501-T2503 VanDerWaalsContact C-N 3.32Å; T2503-I2505 PolarHBondContact O-N 3.33Å; T2503-L2506 CarbonylContact O-C 3.6Å; T2503-L2506 VanDerWaalsContact O-CA 3.3Å; T2503-L2506 WeakPolarHBondContact O-CA 3.36Å; T2503-L2506 VanDerWaalsContact O-CB 3.31Å; T2503-L2506 WeakPolarHBondContact O-CB 3.1Å; T2503-L2506 PolarHBondContact O-N 2.85Å; T2503-E2507 HydrophobicContact CG2-CG 4.29Å; T2503-E2507 WeakPolarHBondContact O-CG 3.21Å; T2503-E2507 PolarHBondContact O-N 3Å
2504	E	32.9	Very low	32.3	Very low	105 Å²	105	93.8 Å²	93.8	49%	0.491	54%	0.535	S	S	.	.	H	α-helix	trans	-62	-30.8	178.5	-141.6	177.4	-168.8	0	0	113.1	A2500 K2501 L2502 L2506 E2507 V2508	A2500-E2504 PolarHBondContact O-N 2.99Å; K2501-E2504 WeakPolarHBondContact CE-OE2 3.44Å; K2501-E2504 HydrophobicContact CG-CB 4.16Å; K2501-E2504 WeakPolarHBondContact CG-OE2 3.4Å; K2501-E2504 PolarHBondContact O-N 3.02Å; L2502-E2504 VanDerWaalsContact C-N 3.3Å; L2502-E2504 PolarHBondContact O-N 3.33Å; E2504-L2506 VanDerWaalsContact C-N 3.33Å; E2504-L2506 PolarHBondContact O-N 2.92Å; E2504-E2507 CarbonylContact O-C 3.54Å; E2504-E2507 PolarHBondContact O-N 3.21Å; E2504-V2508 VanDerWaalsContact O-CG2 3.24Å; E2504-V2508 WeakPolarHBondContact O-CG2 3.35Å; E2504-V2508 PolarHBondContact O-N 3.22Å
2505	I	32.9	Very low	32.3	Very low	98 Å²	98	99.4 Å²	99.4	50%	0.503	55%	0.551	S	S	.	*	H	α-helix	trans	-76.3	-28	176.5	-70.4	172.9	0	0	0	112.2	I2487 K2501 L2502 T2503 V2508 S2509	I2487-I2505 HydrophobicContact CB-CG2 4.5Å; I2487-I2505 HydrophobicContact CG2-CG2 3.58Å; K2501-I2505 HydrophobicContact CG-CD1 4.45Å; K2501-I2505 WeakPolarHBondContact O-CB 3.41Å; K2501-I2505 VanDerWaalsContact O-CD1 3.27Å; K2501-I2505 WeakPolarHBondContact O-CD1 3.34Å; K2501-I2505 VanDerWaalsContact O-CG1 3.24Å; K2501-I2505 WeakPolarHBondContact O-CG1 3.3Å; K2501-I2505 PolarHBondContact O-N 2.91Å; K2501-I2505 VanDerWaalsContact O-N 3.09Å; L2502-I2505 PolarHBondContact O-N 3.01Å; T2503-I2505 PolarHBondContact O-N 3.33Å; I2505-V2508 PolarHBondContact O-N 2.57Å; I2505-S2509 WeakPolarHBondContact O-CB 3.24Å; I2505-S2509 PolarHBondContact O-N 2.88Å
2506	L	33	Very low	32.3	Very low	90.6667 Å²	90.6667	99.7 Å²	99.7	48%	0.475	56%	0.564	S	S	.	*	H	α-helix	trans	-76.9	-26.9	176.9	-76.7	164.3	0	0	0	113.1	Y2333 L2502 T2503 E2504 S2509 K2510	Y2333-L2506 HydrophobicContact CD1-CD2 4.26Å; Y2333-L2506 HydrophobicContact CE1-CD2 3.34Å; Y2333-L2506 HydrophobicContact CE2-CD2 4.49Å; Y2333-L2506 VanDerWaalsContact CZ-CD2 3.48Å; Y2333-L2506 WeakPolarHBondContact OH-CD2 3.44Å; L2502-L2506 HydrophobicContact CD2-CD1 3.99Å; L2502-L2506 HydrophobicContact CG-CD1 3.82Å; L2502-L2506 HydrophobicContact CG-CG 4.11Å; L2502-L2506 WeakPolarHBondContact O-CB 3.34Å; L2502-L2506 WeakPolarHBondContact O-CG 3.45Å; L2502-L2506 PolarHBondContact O-N 3.33Å; T2503-L2506 CarbonylContact O-C 3.6Å; T2503-L2506 VanDerWaalsContact O-CA 3.3Å; T2503-L2506 WeakPolarHBondContact O-CA 3.36Å; T2503-L2506 VanDerWaalsContact O-CB 3.31Å; T2503-L2506 WeakPolarHBondContact O-CB 3.1Å; T2503-L2506 PolarHBondContact O-N 2.85Å; E2504-L2506 VanDerWaalsContact C-N 3.33Å; E2504-L2506 PolarHBondContact O-N 2.92Å; L2506-S2509 PolarHBondContact O-OG 3.46Å; L2506-K2510 PolarHBondContact O-N 3.13Å
2507	E	35.4	Very low	32.4	Very low	139 Å²	139	102.3 Å²	102.3	65%	0.65	56%	0.563	S	S	*	*	H	α-helix	trans	-89.4	-30.9	176.1	-68.5	-147.1	144.3	0	0	113.3	T2503 E2504 S2509 K2510 A2511	T2503-E2507 HydrophobicContact CG2-CG 4.29Å; T2503-E2507 WeakPolarHBondContact O-CG 3.21Å; T2503-E2507 PolarHBondContact O-N 3Å; E2504-E2507 CarbonylContact O-C 3.54Å; E2504-E2507 PolarHBondContact O-N 3.21Å; E2507-S2509 VanDerWaalsContact C-N 3.34Å; E2507-S2509 PolarHBondContact O-N 3.04Å; E2507-S2509 VanDerWaalsContact O-N 3.1Å; E2507-K2510 VanDerWaalsContact O-CB 3.28Å; E2507-K2510 WeakPolarHBondContact O-CB 3.39Å; E2507-K2510 WeakPolarHBondContact O-CD 3.3Å; E2507-K2510 WeakPolarHBondContact O-CG 3.34Å; E2507-K2510 PolarHBondContact O-N 3.15Å; E2507-K2510 VanDerWaalsContact OE1-CE 3.24Å; E2507-K2510 WeakPolarHBondContact OE1-CE 3.46Å; E2507-K2510 IonicContact OE1-NZ 2.78Å; E2507-K2510 PolarHBondContact OE1-NZ 3.39Å; E2507-K2510 IonicContact OE2-NZ 3.5Å; E2507-K2510 PolarHBondContact OE2-NZ 2.79Å; E2507-A2511 PolarHBondContact O-N 3.11Å
2508	V	34.4	Very low	32.5	Very low	95.6667 Å²	95.6667	105.5 Å²	105.5	58%	0.58	58%	0.576	S	S	*	*	H	α-helix	trans	-71.6	-4.6	177.2	180	0	0	0	0	111.7	E2504 I2505 K2510 A2511	E2504-V2508 VanDerWaalsContact O-CG2 3.24Å; E2504-V2508 WeakPolarHBondContact O-CG2 3.35Å; E2504-V2508 PolarHBondContact O-N 3.22Å; I2505-V2508 PolarHBondContact O-N 2.57Å; V2508-K2510 PolarHBondContact O-N 2.82Å; V2508-K2510 VanDerWaalsContact O-N 3.12Å; V2508-A2511 PolarHBondContact O-N 2.96Å
2509	S	30.4	Very low	32.6	Very low	85.6667 Å²	85.6667	111 Å²	111	60%	0.599	59%	0.593	S	S	*	*	H	α-helix	trans	-67.3	5.2	174.8	94.7	0	0	0	0	114.3	I2505 L2506 E2507 A2511	I2505-S2509 WeakPolarHBondContact O-CB 3.24Å; I2505-S2509 PolarHBondContact O-N 2.88Å; L2506-S2509 PolarHBondContact O-OG 3.46Å; E2507-S2509 VanDerWaalsContact C-N 3.34Å; E2507-S2509 PolarHBondContact O-N 3.04Å; E2507-S2509 VanDerWaalsContact O-N 3.1Å; S2509-A2511 VanDerWaalsContact C-N 3.26Å; S2509-A2511 PolarHBondContact O-N 3.35Å
2510	K	32.4	Very low	32.8	Very low	171 Å²	171	112.4 Å²	112.4	74%	0.743	60%	0.603	S	S	*	*	H	α-helix	trans	-105	1.4	-178.6	-83.5	168.2	-175.5	178.2	0	115.5	L2506 E2507 V2508	L2506-K2510 PolarHBondContact O-N 3.13Å; E2507-K2510 VanDerWaalsContact O-CB 3.28Å; E2507-K2510 WeakPolarHBondContact O-CB 3.39Å; E2507-K2510 WeakPolarHBondContact O-CD 3.3Å; E2507-K2510 WeakPolarHBondContact O-CG 3.34Å; E2507-K2510 PolarHBondContact O-N 3.15Å; E2507-K2510 VanDerWaalsContact OE1-CE 3.24Å; E2507-K2510 WeakPolarHBondContact OE1-CE 3.46Å; E2507-K2510 IonicContact OE1-NZ 2.78Å; E2507-K2510 PolarHBondContact OE1-NZ 3.39Å; E2507-K2510 IonicContact OE2-NZ 3.5Å; E2507-K2510 PolarHBondContact OE2-NZ 2.79Å; V2508-K2510 PolarHBondContact O-N 2.82Å; V2508-K2510 VanDerWaalsContact O-N 3.12Å
2511	A	33.8	Very low	32.9	Very low	69.3333 Å²	69.3333	114.2 Å²	114.2	57%	0.573	60%	0.601	S	S	*	*	S	Bend	trans	-114.9	130.5	170.1	0	0	0	0	0	111.7	E2507 V2508 S2509	E2507-A2511 PolarHBondContact O-N 3.11Å; V2508-A2511 PolarHBondContact O-N 2.96Å; S2509-A2511 VanDerWaalsContact C-N 3.26Å; S2509-A2511 PolarHBondContact O-N 3.35Å
2512	P	32.8	Very low	33.4	Very low	107.667 Å²	107.667	116.7 Å²	116.7	70%	0.699	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-73.5	134.7	179.4	28.5	-33.5	0	0	0	112	K2514	P2512-K2514 PolarHBondContact O-N 3.29Å
2513	P	32.5	Very low	34.4	Very low	114.333 Å²	114.333	116.9 Å²	116.9	74%	0.742	61%	0.61	S	S	*	*	P	Polyproline II helix	trans	-70.8	145.6	-176.4	27.5	-34.5	0	0	0	112.7	K2515	P2513-K2515 PolarHBondContact O-N 3.27Å
2514	K	34	Very low	35.5	Very low	149.333 Å²	149.333	114.2 Å²	114.2	65%	0.649	59%	0.593	S	S	*	*	P	Polyproline II helix	trans	-73.8	134.8	179.7	-68.6	178.2	-178.3	170.3	0	110.9	E2319 P2512 G2516 Q2517	E2319-K2514 WeakPolarHBondContact O-CD 3.31Å; E2319-K2514 PolarHBondContact O-NZ 3.33Å; E2319-K2514 IonicContact OE2-NZ 3.69Å; E2319-K2514 PolarHBondContact OE2-NZ 2.69Å; P2512-K2514 PolarHBondContact O-N 3.29Å; K2514-G2516 PolarHBondContact O-N 2.86Å; K2514-Q2517 PolarHBondContact O-N 3.27Å
2515	K	30.3	Very low	37	Very low	184.333 Å²	184.333	110.2 Å²	110.2	80%	0.801	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.1	125	175.7	-80.4	-176.2	177.2	179.9	0	111.1	Q1894 Y1895 L1896 P2513	Q1894-K2515 PolarHBondContact O-NZ 2.85Å; Q1894-K2515 VanDerWaalsContact O-NZ 3.11Å; Y1895-K2515 WeakPolarHBondContact O-CE 3.43Å; Y1895-K2515 PolarHBondContact O-NZ 2.79Å; L1896-K2515 HydrophobicContact CD1-CG 4.5Å; L1896-K2515 HydrophobicContact CG-CD 4.48Å; P2513-K2515 PolarHBondContact O-N 3.27Å
2516	G	32.7	Very low	38.7	Very low	69.6667 Å²	69.6667	105.7 Å²	105.7	72%	0.718	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	126.7	-15.1	170	0	0	0	0	0	115.9	K2514 Q2518	K2514-G2516 PolarHBondContact O-N 2.86Å; G2516-Q2518 PolarHBondContact O-N 2.99Å
2517	Q	30.9	Very low	40.8	Very low	130 Å²	130	101.5 Å²	101.5	61%	0.607	53%	0.53	S	S	*	.			trans	-103.7	108.8	-178.6	-97.6	174.8	-34.8	0	0	111.7	E2318 K2514	E2318-Q2517 PolarHBondContact O-NE2 2.88Å; K2514-Q2517 PolarHBondContact O-N 3.27Å
2518	Q	31.6	Very low	42.9	Very low	176.333 Å²	176.333	97.7 Å²	97.7	82%	0.824	51%	0.512	S	S	*	.			trans	-83.7	112.2	160.8	-74.9	-177.1	-44.4	0	0	108.5	G2516 K2520	G2516-Q2518 PolarHBondContact O-N 2.99Å; Q2518-K2520 PolarHBondContact O-N 3.03Å; Q2518-K2520 VanDerWaalsContact O-N 3.15Å
2519	E	34.7	Very low	44.9	Very low	147 Å²	147	93.2 Å²	93.2	69%	0.687	49%	0.485	S	S	*	.			trans	-76.6	130.4	171.8	-66.5	-171.4	149.7	0	0	109.7	K2501 L2521	K2501-E2519 IonicContact NZ-OE1 3.19Å; E2519-L2521 PolarHBondContact O-N 2.88Å; E2519-L2521 VanDerWaalsContact O-N 3.09Å
2520	K	33.4	Very low	47.4	Very low	161.333 Å²	161.333	90.9 Å²	90.9	70%	0.701	47%	0.467	S	S	*	.			trans	-74.4	107.7	179.5	-107.4	-174.8	170.6	-137.8	0	110	Q2518 R2522 E2620	Q2518-K2520 PolarHBondContact O-N 3.03Å; Q2518-K2520 VanDerWaalsContact O-N 3.15Å; K2520-R2522 PolarHBondContact O-N 2.76Å; K2520-E2620 IonicContact NZ-OE1 2.71Å; K2520-E2620 PolarHBondContact NZ-OE1 2.87Å; K2520-E2620 VanDerWaalsContact NZ-OE1 3.11Å; K2520-E2620 IonicContact NZ-OE2 2.77Å; K2520-E2620 PolarHBondContact NZ-OE2 3.4Å
2521	L	34.9	Very low	49.9	Very low	111 Å²	111	82.7 Å²	82.7	58%	0.581	43%	0.432	S	S	*	.			trans	-88.2	119.7	175.8	-72.7	171.7	0	0	0	110.7	E2519 D2523 K2623 N2642	E2519-L2521 PolarHBondContact O-N 2.88Å; E2519-L2521 VanDerWaalsContact O-N 3.09Å; L2521-D2523 WeakPolarHBondContact CB-OD1 3.18Å; L2521-D2523 PolarHBondContact O-N 3.14Å; L2521-K2623 HydrophobicContact CD1-CG 4.49Å; L2521-N2642 PolarHBondContact O-OD1 2.96Å
2522	R	46.1	Very low	52.6	Low	122.333 Å²	122.333	83.9 Å²	83.9	46%	0.462	42%	0.421	S	S	.	.			trans	-124.4	95	-179.9	-80	-169.9	-162.8	-126.4	2.4	109.5	L2486 K2520 Y2640 N2642	L2486-R2522 VanDerWaalsContact CD1-NH1 3.27Å; K2520-R2522 PolarHBondContact O-N 2.76Å; R2522-Y2640 HydrophobicContact CB-CD1 3.98Å; R2522-Y2640 HydrophobicContact CB-CG 4.27Å; R2522-Y2640 VanDerWaalsContact O-CD1 3.31Å; R2522-Y2640 WeakPolarHBondContact O-CD1 3.22Å; R2522-N2642 PolarHBondContact NH1-OD1 2.83Å
2523	D	50.9	Low	55.3	Low	59 Å²	59	78.8 Å²	78.8	32%	0.316	39%	0.388	S	S	.	.			trans	-87.3	-40.9	-172.7	-60.8	-30.2	0	0	0	112.2	L2521 I2599 S2621 Y2640 W2641	L2521-D2523 WeakPolarHBondContact CB-OD1 3.18Å; L2521-D2523 PolarHBondContact O-N 3.14Å; D2523-I2599 WeakPolarHBondContact O-CG1 3.12Å; D2523-S2621 VanDerWaalsContact CB-CB 3.48Å; D2523-S2621 WeakPolarHBondContact OD1-CB 3.45Å; D2523-S2621 PolarHBondContact OD1-OG 2.98Å; D2523-Y2640 CarbonylContact O-C 3.5Å; D2523-Y2640 WeakPolarHBondContact O-CA 3.38Å; D2523-W2641 HydrophobicContact CB-CB 4.16Å; D2523-W2641 VanDerWaalsContact CB-CD1 3.44Å; D2523-W2641 HydrophobicContact CB-CG 3.98Å; D2523-W2641 VanDerWaalsContact O-CD1 3.29Å; D2523-W2641 PolarHBondContact O-N 3.27Å
2524	M	55.7	Low	58.1	Low	11 Å²	11	78.1 Å²	78.1	5%	0.054	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	134.3	179.6	-146.9	170.6	-170.5	0	0	111.9	I2527 I2544 I2596 I2597 D2598 A2622 K2623 T2638 Y2640 W2641 I2665	M2524-I2527 HydrophobicContact CE-CD1 3.92Å; M2524-I2527 HydrophobicContact CE-CG1 3.71Å; M2524-I2527 HydrophobicContact SD-CG1 4.27Å; M2524-I2544 HydrophobicContact CE-CG2 4.3Å; M2524-I2596 HydrophobicContact CE-CG2 3.45Å; M2524-I2596 VanDerWaalsContact CE-CG2 3.45Å; M2524-I2596 HydrophobicContact CG-CG2 4.28Å; M2524-I2596 HydrophobicContact SD-CG2 3.66Å; M2524-I2597 CarbonylContact C-O 3.56Å; M2524-I2597 WeakPolarHBondContact CA-O 3.44Å; M2524-I2597 HydrophobicContact CB-CD1 4.41Å; M2524-I2597 HydrophobicContact CE-CD1 3.37Å; M2524-I2597 HydrophobicContact CG-CD1 4.28Å; M2524-I2597 WeakPolarHBondContact CG-O 3.49Å; M2524-I2597 WeakPolarHBondContact O-CB 3.4Å; M2524-I2597 WeakPolarHBondContact O-CG2 3.45Å; M2524-D2598 HydrophobicContact CE-CB 3.49Å; M2524-D2598 VanDerWaalsContact CE-CB 3.49Å; M2524-A2622 HydrophobicContact CB-CB 4.16Å; M2524-A2622 VanDerWaalsContact CG-O 3.27Å; M2524-A2622 WeakPolarHBondContact CG-O 3.49Å; M2524-A2622 HydrophobicContact SD-CB 4.12Å; M2524-K2623 WeakPolarHBondContact CE-O 3.36Å; M2524-T2638 HydrophobicContact CE-CG2 3.88Å; M2524-T2638 HydrophobicContact CG-CG2 4.44Å; M2524-T2638 HydrophobicContact SD-CG2 3.73Å; M2524-Y2640 HydrophobicContact CE-CE1 3.85Å; M2524-Y2640 WeakPolarHBondContact CE-OH 3.37Å; M2524-Y2640 HydrophobicContact CG-CD1 3.85Å; M2524-Y2640 HydrophobicContact CG-CE1 3.5Å; M2524-Y2640 VanDerWaalsContact CG-CE1 3.5Å; M2524-W2641 HydrophobicContact CB-CB 4.09Å; M2524-W2641 HydrophobicContact CG-CB 4.37Å; M2524-W2641 HydrophobicContact CG-CG 4.27Å; M2524-W2641 PolarHBondContact N-O 3.08Å; M2524-W2641 PolarHBondContact O-N 2.8Å; M2524-I2665 HydrophobicContact CB-CD1 3.72Å; M2524-I2665 HydrophobicContact CE-CD1 3.84Å; M2524-I2665 HydrophobicContact CE-CG1 4.24Å; M2524-I2665 HydrophobicContact CE-CG2 3.64Å; M2524-I2665 HydrophobicContact CG-CD1 4.25Å; M2524-I2665 HydrophobicContact SD-CB 4.45Å; M2524-I2665 HydrophobicContact SD-CD1 3.59Å; M2524-I2665 VanDerWaalsContact SD-CD1 3.59Å; M2524-I2665 HydrophobicContact SD-CG1 3.66Å; M2524-I2665 HydrophobicContact SD-CG2 3.9Å
2525	Q	64.2	Low	60.6	Low	22 Å²	22	75.1 Å²	75.1	10%	0.103	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	-44.8	177.1	-173.8	-174.1	22.2	0	0	111.5	I2597 A2622 T2638 V2639 Y2640 W2641 G2646	Q2525-I2597 HydrophobicContact CB-CB 4.11Å; Q2525-I2597 HydrophobicContact CB-CG2 4.44Å; Q2525-I2597 PolarHBondContact N-O 3.36Å; Q2525-I2597 CarbonylContact O-C 3.45Å; Q2525-I2597 WeakPolarHBondContact O-CA 3.47Å; Q2525-I2597 PolarHBondContact O-N 2.86Å; Q2525-I2597 VanDerWaalsContact O-O 3.07Å; Q2525-A2622 PolarHBondContact NE2-O 2.88Å; Q2525-T2638 HydrophobicContact CG-CG2 3.93Å; Q2525-V2639 CarbonylContact C-O 3.58Å; Q2525-V2639 VanDerWaalsContact CA-O 3.3Å; Q2525-V2639 WeakPolarHBondContact CA-O 3.2Å; Q2525-V2639 PolarHBondContact N-O 2.75Å; Q2525-Y2640 HydrophobicContact CB-CD1 4.05Å; Q2525-Y2640 HydrophobicContact CB-CE1 4.32Å; Q2525-Y2640 HydrophobicContact CG-CD1 3.89Å; Q2525-Y2640 HydrophobicContact CG-CE1 3.81Å; Q2525-Y2640 HydrophobicContact CG-CE2 4.49Å; Q2525-Y2640 HydrophobicContact CG-CG 4.3Å; Q2525-Y2640 VanDerWaalsContact NE2-CE1 3.34Å; Q2525-Y2640 PolarHBondContact NE2-OH 2.71Å; Q2525-W2641 HydrophobicContact CB-CD2 4.5Å; Q2525-W2641 HydrophobicContact CB-CG 4.26Å; Q2525-W2641 HydrophobicContact CG-CD2 4.46Å; Q2525-W2641 HydrophobicContact CG-CZ2 4.06Å; Q2525-G2646 VanDerWaalsContact OE1-CA 3.27Å
2526	S	69.7	Low	63.4	Low	3.33333 Å²	3.33333	72.9 Å²	72.9	2%	0.023	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152	141.9	174.5	59.7	0	0	0	0	112.9	H2528 I2595 T2638 V2639 W2641	S2526-H2528 PolarHBondContact O-CD2 3.39Å; S2526-H2528 PolarHBondContact OG-CD2 2.87Å; S2526-H2528 VanDerWaalsContact OG-CD2 3.26Å; S2526-H2528 PolarHBondContact OG-NE2 2.79Å; S2526-I2595 CarbonylContact C-O 3.57Å; S2526-I2595 VanDerWaalsContact CA-O 3.3Å; S2526-I2595 WeakPolarHBondContact CA-O 3.46Å; S2526-I2595 WeakPolarHBondContact CB-O 3.24Å; S2526-T2638 CarbonylContact O-C 3.57Å; S2526-T2638 WeakPolarHBondContact O-CA 3.12Å; S2526-V2639 PolarHBondContact N-O 2.76Å; S2526-V2639 PolarHBondContact O-N 3.03Å; S2526-V2639 WeakPolarHBondContact OG-CB 3.03Å; S2526-W2641 PolarHBondContact OG-NE1 3.09Å
2527	I	76.3	Confident	66.1	Low	1.33333 Å²	1.33333	69.7 Å²	69.7	1%	0.007	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	123.6	173.8	-59.2	154.3	0	0	0	107.3	M2524 I2544 I2594 I2595 I2597 A2622 V2625 I2636 R2637 T2638	M2524-I2527 HydrophobicContact CE-CD1 3.92Å; M2524-I2527 HydrophobicContact CE-CG1 3.71Å; M2524-I2527 HydrophobicContact SD-CG1 4.27Å; I2527-I2544 HydrophobicContact CD1-CD1 3.59Å; I2527-I2544 VanDerWaalsContact CD1-CD1 3.44Å; I2527-I2544 HydrophobicContact CD1-CG1 4.04Å; I2527-I2594 CarbonylContact O-C 3.54Å; I2527-I2594 VanDerWaalsContact O-CA 3.28Å; I2527-I2594 WeakPolarHBondContact O-CA 3.41Å; I2527-I2594 WeakPolarHBondContact O-CG2 3.33Å; I2527-I2595 HydrophobicContact CB-CB 4.31Å; I2527-I2595 HydrophobicContact CD1-CB 4.34Å; I2527-I2595 HydrophobicContact CD1-CD1 4.48Å; I2527-I2595 PolarHBondContact N-O 3.03Å; I2527-I2595 PolarHBondContact O-N 2.99Å; I2527-I2597 HydrophobicContact CD1-CD1 3.85Å; I2527-I2597 HydrophobicContact CG1-CD1 4.28Å; I2527-A2622 HydrophobicContact CD1-CB 4.5Å; I2527-V2625 HydrophobicContact CD1-CB 3.83Å; I2527-V2625 HydrophobicContact CD1-CG1 4.22Å; I2527-V2625 HydrophobicContact CD1-CG2 3.7Å; I2527-V2625 VanDerWaalsContact CD1-CG2 3.45Å; I2527-V2625 HydrophobicContact CG1-CB 4.26Å; I2527-V2625 HydrophobicContact CG1-CG1 4.01Å; I2527-V2625 HydrophobicContact CG1-CG2 3.86Å; I2527-V2625 HydrophobicContact CG2-CB 4.41Å; I2527-V2625 HydrophobicContact CG2-CG1 4.01Å; I2527-V2625 HydrophobicContact CG2-CG2 4.19Å; I2527-I2636 HydrophobicContact CG2-CG2 4.07Å; I2527-R2637 CarbonylContact C-O 3.55Å; I2527-R2637 WeakPolarHBondContact CA-O 3.26Å; I2527-T2638 HydrophobicContact CG1-CG2 4.39Å
2528	H	78.2	Confident	69	Low	59.3333 Å²	59.3333	69.5 Å²	69.5	28%	0.275	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	110.1	173.9	-66.1	-106.3	0	0	0	108.9	S2526 I2594 R2637	S2526-H2528 PolarHBondContact O-CD2 3.39Å; S2526-H2528 PolarHBondContact OG-CD2 2.87Å; S2526-H2528 VanDerWaalsContact OG-CD2 3.26Å; S2526-H2528 PolarHBondContact OG-NE2 2.79Å; H2528-I2594 VanDerWaalsContact CE1-CG2 3.49Å; H2528-I2594 WeakPolarHBondContact CE1-CG2 3.32Å; H2528-R2637 HydrophobicContact CB-CB 4.41Å; H2528-R2637 PolarHBondContact N-O 2.89Å; H2528-R2637 PolarHBondContact O-N 2.85Å
2529	A	78.1	Confident	71.9	Confident	2.66667 Å²	2.66667	63.3 Å²	63.3	2%	0.022	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	144.3	176.7	0	0	0	0	0	111.9	V2531 K2592 L2593 I2627 A2635 I2636	A2529-V2531 HydrophobicContact CB-CG2 3.88Å; A2529-K2592 CarbonylContact O-C 3.59Å; A2529-K2592 WeakPolarHBondContact O-CA 3.38Å; A2529-L2593 HydrophobicContact CB-CB 4.31Å; A2529-L2593 HydrophobicContact CB-CD2 4.4Å; A2529-L2593 PolarHBondContact N-O 3.27Å; A2529-L2593 PolarHBondContact O-N 3.21Å; A2529-L2593 VanDerWaalsContact O-O 3.06Å; A2529-I2627 HydrophobicContact CB-CD1 3.57Å; A2529-I2627 VanDerWaalsContact CB-CD1 3.45Å; A2529-A2635 CarbonylContact C-O 3.52Å; A2529-A2635 VanDerWaalsContact CA-O 3.22Å; A2529-A2635 WeakPolarHBondContact CA-O 3.32Å; A2529-I2636 HydrophobicContact CB-CG1 4.27Å
2530	T	81.5	Confident	74.7	Confident	36 Å²	36	56.4 Å²	56.4	22%	0.221	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	111.3	168.3	-60.5	0	0	0	0	107.1	T2590 R2634 A2635	T2530-T2590 HydrophobicContact CG2-CG2 3.68Å; T2530-R2634 HydrophobicContact CG2-CB 4.4Å; T2530-R2634 PolarHBondContact O-N 2.89Å; T2530-A2635 PolarHBondContact N-O 2.93Å; T2530-A2635 PolarHBondContact O-N 2.84Å
2531	V	85.9	Confident	77.5	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	132.7	-167.8	-177.3	0	0	0	0	108.4	A2529 T2590 F2591 L2593 I2627 V2631 V2633	A2529-V2531 HydrophobicContact CB-CG2 3.88Å; V2531-T2590 CarbonylContact O-C 3.49Å; V2531-T2590 WeakPolarHBondContact O-CA 3.18Å; V2531-T2590 WeakPolarHBondContact O-CG2 3.35Å; V2531-F2591 HydrophobicContact CB-CD1 4.37Å; V2531-F2591 HydrophobicContact CB-CE1 3.81Å; V2531-F2591 HydrophobicContact CB-CE2 4.22Å; V2531-F2591 HydrophobicContact CB-CZ 3.69Å; V2531-F2591 HydrophobicContact CG1-CE1 3.75Å; V2531-F2591 HydrophobicContact CG1-CZ 3.73Å; V2531-F2591 HydrophobicContact CG2-CZ 4.4Å; V2531-F2591 PolarHBondContact N-O 3.31Å; V2531-F2591 VanDerWaalsContact O-CD1 3.24Å; V2531-F2591 WeakPolarHBondContact O-CD1 3.27Å; V2531-F2591 PolarHBondContact O-N 3.13Å; V2531-F2591 VanDerWaalsContact O-O 3.13Å; V2531-L2593 HydrophobicContact CG2-CB 4.22Å; V2531-L2593 HydrophobicContact CG2-CD2 4.44Å; V2531-I2627 HydrophobicContact CG2-CD1 4.19Å; V2531-V2631 HydrophobicContact CG1-CB 3.83Å; V2531-V2631 HydrophobicContact CG1-CG1 3.46Å; V2531-V2631 VanDerWaalsContact CG1-CG1 3.46Å; V2531-V2633 HydrophobicContact CG2-CG1 4.47Å; V2531-V2633 HydrophobicContact CG2-CG2 4.48Å
2532	R	89.5	Confident	80.2	Confident	94.3333 Å²	94.3333	43.9 Å²	43.9	36%	0.356	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	130.5	170	179.6	-169.3	-174.4	-164.3	0.3	108.6	G2588 A2589 T2590 V2631 D2632	R2532-G2588 WeakPolarHBondContact CG-O 3.37Å; R2532-G2588 PolarHBondContact NE-O 3.12Å; R2532-A2589 VanDerWaalsContact CA-O 3.3Å; R2532-A2589 WeakPolarHBondContact CA-O 3.38Å; R2532-T2590 HydrophobicContact CB-CG2 4.29Å; R2532-V2631 CarbonylContact O-C 3.57Å; R2532-V2631 VanDerWaalsContact O-CA 3.25Å; R2532-V2631 WeakPolarHBondContact O-CA 3.4Å; R2532-D2632 HydrophobicContact CB-CB 3.95Å; R2532-D2632 WeakPolarHBondContact CB-O 3.29Å; R2532-D2632 VanDerWaalsContact CD-OD2 3.31Å; R2532-D2632 WeakPolarHBondContact CD-OD2 3.39Å; R2532-D2632 HydrophobicContact CG-CB 4.45Å; R2532-D2632 PolarHBondContact N-O 3.16Å; R2532-D2632 IonicContact NH1-OD2 2.7Å; R2532-D2632 PolarHBondContact O-N 3.01Å
2533	L	90.5	Very high	82.2	Confident	0.666667 Å²	0.666667	39.9 Å²	39.9	0%	0.003	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	143.6	170.4	-69.3	166.2	0	0	0	109.8	A2537 F2540 V2558 L2585 I2586 G2588 A2589 F2591 V2631	L2533-A2537 HydrophobicContact CB-CB 4.01Å; L2533-A2537 HydrophobicContact CD2-CB 3.99Å; L2533-A2537 HydrophobicContact CG-CB 4.43Å; L2533-F2540 HydrophobicContact CD2-CD1 3.64Å; L2533-F2540 HydrophobicContact CD2-CE1 3.94Å; L2533-V2558 HydrophobicContact CD1-CG1 4.08Å; L2533-V2558 HydrophobicContact CD1-CG2 4.33Å; L2533-V2558 HydrophobicContact CD2-CG2 3.85Å; L2533-L2585 HydrophobicContact CD1-CB 3.88Å; L2533-L2585 HydrophobicContact CD1-CD2 4.23Å; L2533-I2586 VanDerWaalsContact CD1-O 3.32Å; L2533-I2586 WeakPolarHBondContact CD1-O 3.35Å; L2533-G2588 CarbonylContact O-C 3.52Å; L2533-G2588 VanDerWaalsContact O-C 3.29Å; L2533-G2588 WeakPolarHBondContact O-CA 3.37Å; L2533-G2588 PolarHBondContact O-N 3.31Å; L2533-G2588 VanDerWaalsContact O-N 3.14Å; L2533-A2589 PolarHBondContact N-O 3.26Å; L2533-F2591 HydrophobicContact CD1-CE1 4.39Å; L2533-F2591 HydrophobicContact CD2-CE1 4.41Å; L2533-F2591 HydrophobicContact CG-CE1 4.04Å; L2533-V2631 HydrophobicContact CD2-CG1 3.84Å
2534	E	90.5	Very high	83.9	Confident	98.6667 Å²	98.6667	37.1 Å²	37.1	46%	0.461	19%	0.191	S	C	.	.			trans	-64.9	158.5	167.2	-70.9	-168.1	-178.5	0	0	111.5	N2536 A2537 G2588 D2630	E2534-N2536 PolarHBondContact O-N 3.37Å; E2534-N2536 VanDerWaalsContact O-N 3.15Å; E2534-A2537 HydrophobicContact CB-CB 4.37Å; E2534-A2537 WeakPolarHBondContact O-CB 3.42Å; E2534-A2537 PolarHBondContact O-N 3.28Å; E2534-A2537 VanDerWaalsContact O-N 3.16Å; E2534-G2588 PolarHBondContact O-N 2.79Å; E2534-D2630 HydrophobicContact CB-CB 4.46Å; E2534-D2630 PolarHBondContact N-O 3.12Å
2535	P	88	Confident	85.2	Confident	87 Å²	87	39.9 Å²	39.9	57%	0.565	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-26.7	-175.7	-26.1	36.2	0	0	0	114.7	Q2587	P2535-Q2587 VanDerWaalsContact O-CB 3.28Å; P2535-Q2587 WeakPolarHBondContact O-CB 3.35Å
2536	N	88.9	Confident	85.9	Confident	138.333 Å²	138.333	38.9 Å²	38.9	74%	0.74	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	-115.8	16.8	-179.1	-61.7	-6.8	0	0	0	112.4	E2534 E2538 Q2587	E2534-N2536 PolarHBondContact O-N 3.37Å; E2534-N2536 VanDerWaalsContact O-N 3.15Å; N2536-E2538 PolarHBondContact O-N 2.9Å; N2536-Q2587 VanDerWaalsContact C-NE2 3.3Å; N2536-Q2587 PolarHBondContact O-NE2 2.82Å
2537	A	88.5	Confident	85.8	Confident	1 Å²	1	40.8 Å²	40.8	1%	0.008	21%	0.209	C	C	.	.			trans	-54	121.6	-169.9	0	0	0	0	0	113.7	L2533 E2534 V2558 Q2587 D2630	L2533-A2537 HydrophobicContact CB-CB 4.01Å; L2533-A2537 HydrophobicContact CD2-CB 3.99Å; L2533-A2537 HydrophobicContact CG-CB 4.43Å; E2534-A2537 HydrophobicContact CB-CB 4.37Å; E2534-A2537 WeakPolarHBondContact O-CB 3.42Å; E2534-A2537 PolarHBondContact O-N 3.28Å; E2534-A2537 VanDerWaalsContact O-N 3.16Å; A2537-V2558 HydrophobicContact CB-CG2 4.34Å; A2537-V2558 WeakPolarHBondContact O-CB 3.31Å; A2537-Q2587 HydrophobicContact CB-CG 4.41Å; A2537-Q2587 PolarHBondContact O-NE2 3.19Å; A2537-D2630 HydrophobicContact CB-CB 3.54Å; A2537-D2630 WeakPolarHBondContact CB-O 3.43Å
2538	E	91.3	Very high	85.4	Confident	126.667 Å²	126.667	44.3 Å²	44.3	59%	0.592	23%	0.228	S	C	*	.			trans	-94	-39.2	175	-64.4	-168.6	-178.7	0	0	111.4	N2536 N2557 V2558 D2630	N2536-E2538 PolarHBondContact O-N 2.9Å; E2538-N2557 CarbonylContact O-C 3.41Å; E2538-N2557 WeakPolarHBondContact O-CA 3.33Å; E2538-N2557 PolarHBondContact O-ND2 3.25Å; E2538-V2558 PolarHBondContact O-N 3.15Å; E2538-D2630 PolarHBondContact N-OD2 2.81Å
2539	S	92.7	Very high	84.9	Confident	46.6667 Å²	46.6667	47.6 Å²	47.6	33%	0.326	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	155.2	-177.3	74.3	0	0	0	0	114.5	V2556 D2630	S2539-V2556 WeakPolarHBondContact CA-O 3.35Å; S2539-V2556 VanDerWaalsContact CB-O 3.31Å; S2539-V2556 WeakPolarHBondContact CB-O 3.35Å; S2539-D2630 PolarHBondContact N-OD2 2.7Å; S2539-D2630 WeakPolarHBondContact O-CB 3.33Å; S2539-D2630 PolarHBondContact O-N 2.82Å; S2539-D2630 VanDerWaalsContact O-OD2 3.1Å
2540	F	93.4	Very high	84.7	Confident	1.33333 Å²	1.33333	48.4 Å²	48.4	1%	0.006	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	161.6	163.2	76.9	-96	0	0	0	111	L2533 V2542 V2555 V2556 V2558 W2563 L2585 F2591 L2593 I2627 S2628 V2631	L2533-F2540 HydrophobicContact CD2-CD1 3.64Å; L2533-F2540 HydrophobicContact CD2-CE1 3.94Å; F2540-V2542 HydrophobicContact CD2-CG2 4.33Å; F2540-V2542 HydrophobicContact CE2-CG2 4.06Å; F2540-V2555 CarbonylContact O-C 3.54Å; F2540-V2555 WeakPolarHBondContact O-CA 3.38Å; F2540-V2556 HydrophobicContact CD1-CG1 3.46Å; F2540-V2556 VanDerWaalsContact CD1-CG1 3.46Å; F2540-V2556 HydrophobicContact CD2-CG1 4.09Å; F2540-V2556 HydrophobicContact CE1-CG1 3.25Å; F2540-V2556 HydrophobicContact CE2-CG1 3.9Å; F2540-V2556 HydrophobicContact CG-CG1 3.88Å; F2540-V2556 HydrophobicContact CZ-CG1 3.47Å; F2540-V2556 VanDerWaalsContact CZ-CG1 3.44Å; F2540-V2556 PolarHBondContact N-O 3.14Å; F2540-V2556 VanDerWaalsContact N-O 3.1Å; F2540-V2556 WeakPolarHBondContact O-CG1 3.32Å; F2540-V2556 PolarHBondContact O-N 2.91Å; F2540-V2558 HydrophobicContact CD1-CG2 4.41Å; F2540-W2563 HydrophobicContact CE2-CH2 4.16Å; F2540-W2563 AromaticContact CZ-CH2 3.84Å; F2540-W2563 HydrophobicContact CZ-CH2 3.84Å; F2540-W2563 HydrophobicContact CZ-CZ2 4.11Å; F2540-L2585 HydrophobicContact CE1-CD1 4.12Å; F2540-L2585 HydrophobicContact CE1-CD2 4.34Å; F2540-F2591 HydrophobicContact CE1-CE1 4.3Å; F2540-F2591 AromaticContact CE1-CZ 3.79Å; F2540-F2591 HydrophobicContact CE1-CZ 3.79Å; F2540-F2591 HydrophobicContact CE2-CZ 4.36Å; F2540-F2591 HydrophobicContact CZ-CE1 4.39Å; F2540-F2591 HydrophobicContact CZ-CE2 4.22Å; F2540-F2591 AromaticContact CZ-CZ 3.56Å; F2540-F2591 HydrophobicContact CZ-CZ 3.56Å; F2540-F2591 VanDerWaalsContact CZ-CZ 3.42Å; F2540-L2593 HydrophobicContact CE2-CD2 4.14Å; F2540-I2627 HydrophobicContact CD2-CG2 4.26Å; F2540-S2628 CarbonylContact C-O 3.57Å; F2540-S2628 VanDerWaalsContact CA-O 3.31Å; F2540-S2628 WeakPolarHBondContact CA-O 3.35Å; F2540-S2628 VanDerWaalsContact CB-O 3.32Å; F2540-S2628 WeakPolarHBondContact CB-O 3.3Å; F2540-V2631 HydrophobicContact CB-CG1 3.77Å; F2540-V2631 HydrophobicContact CB-CG2 4.16Å; F2540-V2631 HydrophobicContact CD1-CG1 3.97Å; F2540-V2631 HydrophobicContact CD2-CG1 4.4Å; F2540-V2631 HydrophobicContact CG-CG1 3.85Å
2541	A	92.4	Very high	84.8	Confident	8.66667 Å²	8.66667	48.9 Å²	48.9	7%	0.072	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	144.1	179.1	0	0	0	0	0	111.9	K2553 A2554 V2555 I2627 S2628	A2541-K2553 HydrophobicContact CB-CD 4.2Å; A2541-K2553 HydrophobicContact CB-CG 4.29Å; A2541-A2554 CarbonylContact C-O 3.55Å; A2541-A2554 VanDerWaalsContact CA-O 3.28Å; A2541-A2554 WeakPolarHBondContact CA-O 3.29Å; A2541-V2555 HydrophobicContact CB-CB 4.46Å; A2541-V2555 HydrophobicContact CB-CG1 4.42Å; A2541-V2555 HydrophobicContact CB-CG2 4.08Å; A2541-I2627 CarbonylContact O-C 3.54Å; A2541-I2627 VanDerWaalsContact O-CA 3.31Å; A2541-I2627 WeakPolarHBondContact O-CA 3.43Å; A2541-I2627 WeakPolarHBondContact O-CG2 3.23Å; A2541-S2628 PolarHBondContact N-O 3.1Å; A2541-S2628 PolarHBondContact O-N 2.83Å; A2541-S2628 PolarHBondContact O-OG 2.65Å
2542	V	91.2	Very high	84.9	Confident	0.666667 Å²	0.666667	48.9 Å²	48.9	0%	0.004	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	118.4	168.7	-173.8	0	0	0	0	108.2	F2540 I2544 K2553 A2554 L2593 I2595 V2625 I2627	F2540-V2542 HydrophobicContact CD2-CG2 4.33Å; F2540-V2542 HydrophobicContact CE2-CG2 4.06Å; V2542-I2544 HydrophobicContact CG1-CG1 4.24Å; V2542-K2553 CarbonylContact O-C 3.52Å; V2542-K2553 VanDerWaalsContact O-CA 3.3Å; V2542-K2553 WeakPolarHBondContact O-CA 3.42Å; V2542-A2554 HydrophobicContact CB-CB 4.42Å; V2542-A2554 PolarHBondContact N-O 3Å; V2542-A2554 PolarHBondContact O-N 3Å; V2542-L2593 HydrophobicContact CG1-CD2 4.28Å; V2542-L2593 HydrophobicContact CG2-CD2 3.64Å; V2542-I2595 HydrophobicContact CB-CD1 4.21Å; V2542-I2595 HydrophobicContact CG1-CD1 3.65Å; V2542-I2595 HydrophobicContact CG2-CD1 4.34Å; V2542-V2625 HydrophobicContact CG1-CG1 4.09Å; V2542-V2625 HydrophobicContact CG1-CG2 3.84Å; V2542-I2627 HydrophobicContact CG1-CG1 4.18Å; V2542-I2627 HydrophobicContact CG2-CD1 4.39Å; V2542-I2627 HydrophobicContact CG2-CG1 4.25Å; V2542-I2627 HydrophobicContact CG2-CG2 4.41Å
2543	H	89.5	Confident	84.9	Confident	38.6667 Å²	38.6667	46.9 Å²	46.9	18%	0.179	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	135.1	177.7	-66.6	-127.4	0	0	0	109.3	E2551 W2552 K2553 V2625 T2626 S2628	H2543-E2551 IonicContact CE1-OE1 2.71Å; H2543-E2551 IonicContact CG-OE1 3.59Å; H2543-E2551 IonicContact ND1-OE1 2.85Å; H2543-E2551 PolarHBondContact ND1-OE1 2.88Å; H2543-W2552 CarbonylContact C-O 3.51Å; H2543-W2552 VanDerWaalsContact CA-O 3.32Å; H2543-W2552 WeakPolarHBondContact CA-O 3.43Å; H2543-K2553 VanDerWaalsContact CE1-CE 3.45Å; H2543-K2553 WeakPolarHBondContact CE1-CE 3.4Å; H2543-K2553 VanDerWaalsContact NE2-CD 3.31Å; H2543-K2553 WeakPolarHBondContact NE2-CD 3.33Å; H2543-K2553 VanDerWaalsContact NE2-CE 3.29Å; H2543-K2553 WeakPolarHBondContact NE2-CE 3.41Å; H2543-V2625 CarbonylContact O-C 3.58Å; H2543-V2625 VanDerWaalsContact O-CA 3.3Å; H2543-V2625 WeakPolarHBondContact O-CA 3.4Å; H2543-V2625 WeakPolarHBondContact O-CG2 3.47Å; H2543-T2626 PolarHBondContact N-O 2.95Å; H2543-T2626 PolarHBondContact O-N 3.11Å; H2543-S2628 PolarHBondContact NE2-OG 2.88Å
2544	I	86.5	Confident	85	Confident	0.333333 Å²	0.333333	46.9 Å²	46.9	0%	0.002	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	112.6	178.7	-54.7	-179.7	0	0	0	107.5	M2524 I2527 V2542 L2546 E2551 W2552 I2595 I2597 A2622 Q2624 V2625	M2524-I2544 HydrophobicContact CE-CG2 4.3Å; I2527-I2544 HydrophobicContact CD1-CD1 3.59Å; I2527-I2544 VanDerWaalsContact CD1-CD1 3.44Å; I2527-I2544 HydrophobicContact CD1-CG1 4.04Å; V2542-I2544 HydrophobicContact CG1-CG1 4.24Å; I2544-L2546 HydrophobicContact CB-CD2 4.47Å; I2544-L2546 HydrophobicContact CG2-CD2 3.82Å; I2544-E2551 CarbonylContact O-C 3.57Å; I2544-E2551 WeakPolarHBondContact O-CA 3.39Å; I2544-W2552 HydrophobicContact CB-CB 4.45Å; I2544-W2552 HydrophobicContact CB-CE3 4.2Å; I2544-W2552 HydrophobicContact CD1-CD2 4.3Å; I2544-W2552 HydrophobicContact CD1-CE3 3.56Å; I2544-W2552 VanDerWaalsContact CD1-CE3 3.48Å; I2544-W2552 HydrophobicContact CD1-CZ3 3.6Å; I2544-W2552 HydrophobicContact CG1-CE3 3.83Å; I2544-W2552 HydrophobicContact CG1-CZ3 4.17Å; I2544-W2552 PolarHBondContact N-O 2.83Å; I2544-W2552 PolarHBondContact O-N 3.36Å; I2544-I2595 HydrophobicContact CD1-CD1 4.21Å; I2544-I2595 HydrophobicContact CD1-CG2 4.24Å; I2544-I2597 HydrophobicContact CD1-CD1 4.39Å; I2544-I2597 HydrophobicContact CG2-CD1 4.43Å; I2544-A2622 HydrophobicContact CG2-CB 3.34Å; I2544-Q2624 CarbonylContact C-O 3.4Å; I2544-Q2624 WeakPolarHBondContact CA-O 3.36Å; I2544-V2625 HydrophobicContact CG1-CG2 4.24Å
2545	K	81.8	Confident	85.1	Confident	69.3333 Å²	69.3333	44.1 Å²	44.1	30%	0.301	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	130.7	172.7	-139.9	178.4	-177.3	162.3	0	109.4	E2549 E2551 K2623 Q2624	K2545-E2549 WeakPolarHBondContact CE-OE2 3.44Å; K2545-E2549 IonicContact NZ-OE1 2.73Å; K2545-E2549 IonicContact NZ-OE2 3.05Å; K2545-E2549 PolarHBondContact NZ-OE2 2.84Å; K2545-E2551 HydrophobicContact CB-CG 4.29Å; K2545-E2551 HydrophobicContact CD-CG 4.14Å; K2545-E2551 WeakPolarHBondContact CD-OE1 3.4Å; K2545-E2551 WeakPolarHBondContact CE-OE1 3.17Å; K2545-E2551 WeakPolarHBondContact CE-OE2 3.23Å; K2545-E2551 HydrophobicContact CG-CG 4.03Å; K2545-E2551 WeakPolarHBondContact CG-OE2 3.49Å; K2545-E2551 IonicContact NZ-OE1 3.97Å; K2545-E2551 PolarHBondContact NZ-OE1 2.89Å; K2545-K2623 WeakPolarHBondContact O-CB 3.17Å; K2545-K2623 PolarHBondContact O-N 3.04Å; K2545-Q2624 HydrophobicContact CB-CB 4.15Å; K2545-Q2624 PolarHBondContact N-O 3.08Å; K2545-Q2624 PolarHBondContact O-N 3.09Å
2546	L	79.4	Confident	85.4	Confident	2.66667 Å²	2.66667	40 Å²	40	1%	0.014	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	179.4	-174.9	-54.9	179.7	0	0	0	111.6	I2544 D2548 E2549 T2550 W2552 L2617 S2621 A2622	I2544-L2546 HydrophobicContact CB-CD2 4.47Å; I2544-L2546 HydrophobicContact CG2-CD2 3.82Å; L2546-D2548 VanDerWaalsContact C-N 3.29Å; L2546-D2548 PolarHBondContact O-N 2.85Å; L2546-E2549 PolarHBondContact O-N 2.85Å; L2546-E2549 VanDerWaalsContact O-N 3.08Å; L2546-T2550 WeakPolarHBondContact CB-O 3.49Å; L2546-T2550 WeakPolarHBondContact CB-OG1 3.31Å; L2546-T2550 PolarHBondContact N-O 2.94Å; L2546-W2552 HydrophobicContact CD1-CB 4.4Å; L2546-L2617 HydrophobicContact CD1-CB 4.05Å; L2546-L2617 HydrophobicContact CD1-CD2 4.16Å; L2546-L2617 HydrophobicContact CD2-CD1 4.29Å; L2546-L2617 HydrophobicContact CD2-CD2 4.31Å; L2546-S2621 CarbonylContact C-O 3.54Å; L2546-S2621 VanDerWaalsContact CA-O 3.26Å; L2546-S2621 WeakPolarHBondContact CA-O 3.42Å; L2546-S2621 WeakPolarHBondContact CD2-O 3.33Å; L2546-A2622 HydrophobicContact CD2-CB 4.27Å
2547	D	68.3	Low	85.6	Confident	42.3333 Å²	42.3333	36 Å²	36	23%	0.226	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-43.9	176.7	59.9	-33	0	0	0	113.8	E2549 T2550 G2619 E2620 S2621 K2623	D2547-E2549 PolarHBondContact O-N 3.01Å; D2547-E2549 VanDerWaalsContact O-N 3.12Å; D2547-T2550 PolarHBondContact O-N 2.98Å; D2547-T2550 PolarHBondContact O-OG1 2.88Å; D2547-G2619 VanDerWaalsContact OD1-C 3.27Å; D2547-G2619 VanDerWaalsContact OD1-CA 3.22Å; D2547-G2619 WeakPolarHBondContact OD1-CA 3.43Å; D2547-E2620 PolarHBondContact OD1-N 2.83Å; D2547-S2621 PolarHBondContact N-O 2.86Å; D2547-S2621 PolarHBondContact OD1-N 3.01Å; D2547-K2623 WeakPolarHBondContact O-CE 3.31Å; D2547-K2623 PolarHBondContact O-NZ 3.41Å
2548	D	66.5	Low	85.6	Confident	75.6667 Å²	75.6667	36.2 Å²	36.2	41%	0.405	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53	23	173.1	47.7	-15.4	0	0	0	113.8	L2546 T2550 G2619 K2718	L2546-D2548 VanDerWaalsContact C-N 3.29Å; L2546-D2548 PolarHBondContact O-N 2.85Å; D2548-T2550 PolarHBondContact O-N 3.11Å; D2548-T2550 VanDerWaalsContact O-N 3.11Å; D2548-T2550 VanDerWaalsContact OD1-CB 3.29Å; D2548-T2550 WeakPolarHBondContact OD1-CB 3.2Å; D2548-T2550 WeakPolarHBondContact OD1-CG2 3.24Å; D2548-T2550 PolarHBondContact OD1-N 2.85Å; D2548-T2550 PolarHBondContact OD1-OG1 3Å; D2548-T2550 VanDerWaalsContact OD2-CG2 3.32Å; D2548-T2550 WeakPolarHBondContact OD2-CG2 3.22Å; D2548-T2550 PolarHBondContact OD2-OG1 2.78Å; D2548-G2619 PolarHBondContact OD2-N 3.01Å; D2548-K2718 IonicContact OD2-NZ 3.62Å; D2548-K2718 PolarHBondContact OD2-NZ 3.02Å
2549	E	68.9	Low	85.5	Confident	128 Å²	128	35.7 Å²	35.7	60%	0.598	18%	0.184	S	C	*	.	S	Bend	trans	62.3	7	-176.1	-59.4	-99.7	153.1	0	0	115.4	K2545 L2546 D2547 F2568 K2623	K2545-E2549 WeakPolarHBondContact CE-OE2 3.44Å; K2545-E2549 IonicContact NZ-OE1 2.73Å; K2545-E2549 IonicContact NZ-OE2 3.05Å; K2545-E2549 PolarHBondContact NZ-OE2 2.84Å; L2546-E2549 PolarHBondContact O-N 2.85Å; L2546-E2549 VanDerWaalsContact O-N 3.08Å; D2547-E2549 PolarHBondContact O-N 3.01Å; D2547-E2549 VanDerWaalsContact O-N 3.12Å; E2549-F2568 WeakPolarHBondContact O-CD1 3.42Å; E2549-K2623 IonicContact OE1-NZ 3.52Å; E2549-K2623 PolarHBondContact OE1-NZ 3Å
2550	T	74.4	Confident	85.3	Confident	19 Å²	19	36.7 Å²	36.7	12%	0.117	19%	0.189	C	C	.	.			trans	-75	155.7	171.2	64.7	0	0	0	0	111.7	L2546 D2547 D2548 F2568 V2569 L2618	L2546-T2550 WeakPolarHBondContact CB-O 3.49Å; L2546-T2550 WeakPolarHBondContact CB-OG1 3.31Å; L2546-T2550 PolarHBondContact N-O 2.94Å; D2547-T2550 PolarHBondContact O-N 2.98Å; D2547-T2550 PolarHBondContact O-OG1 2.88Å; D2548-T2550 PolarHBondContact O-N 3.11Å; D2548-T2550 VanDerWaalsContact O-N 3.11Å; D2548-T2550 VanDerWaalsContact OD1-CB 3.29Å; D2548-T2550 WeakPolarHBondContact OD1-CB 3.2Å; D2548-T2550 WeakPolarHBondContact OD1-CG2 3.24Å; D2548-T2550 PolarHBondContact OD1-N 2.85Å; D2548-T2550 PolarHBondContact OD1-OG1 3Å; D2548-T2550 VanDerWaalsContact OD2-CG2 3.32Å; D2548-T2550 WeakPolarHBondContact OD2-CG2 3.22Å; D2548-T2550 PolarHBondContact OD2-OG1 2.78Å; T2550-F2568 VanDerWaalsContact CA-O 3.31Å; T2550-F2568 WeakPolarHBondContact CA-O 3.45Å; T2550-F2568 WeakPolarHBondContact CB-O 3.31Å; T2550-V2569 HydrophobicContact CG2-CG1 4.39Å; T2550-L2618 HydrophobicContact CG2-CB 4.32Å; T2550-L2618 HydrophobicContact CG2-CD1 4.34Å
2551	E	82.4	Confident	85.2	Confident	47 Å²	47	38.1 Å²	38.1	22%	0.22	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	143.8	179.2	-132	-178	148.8	0	0	109.9	H2543 I2544 K2545 S2567 F2568 W2573	H2543-E2551 IonicContact CE1-OE1 2.71Å; H2543-E2551 IonicContact CG-OE1 3.59Å; H2543-E2551 IonicContact ND1-OE1 2.85Å; H2543-E2551 PolarHBondContact ND1-OE1 2.88Å; I2544-E2551 CarbonylContact O-C 3.57Å; I2544-E2551 WeakPolarHBondContact O-CA 3.39Å; K2545-E2551 HydrophobicContact CB-CG 4.29Å; K2545-E2551 HydrophobicContact CD-CG 4.14Å; K2545-E2551 WeakPolarHBondContact CD-OE1 3.4Å; K2545-E2551 WeakPolarHBondContact CE-OE1 3.17Å; K2545-E2551 WeakPolarHBondContact CE-OE2 3.23Å; K2545-E2551 HydrophobicContact CG-CG 4.03Å; K2545-E2551 WeakPolarHBondContact CG-OE2 3.49Å; K2545-E2551 IonicContact NZ-OE1 3.97Å; K2545-E2551 PolarHBondContact NZ-OE1 2.89Å; E2551-S2567 CarbonylContact O-C 3.45Å; E2551-S2567 VanDerWaalsContact O-CA 3.3Å; E2551-S2567 WeakPolarHBondContact O-CA 3.4Å; E2551-F2568 HydrophobicContact CB-CB 3.84Å; E2551-F2568 PolarHBondContact N-O 2.84Å; E2551-F2568 PolarHBondContact O-N 3.15Å; E2551-W2573 HydrophobicContact CB-CH2 3.88Å; E2551-W2573 HydrophobicContact CB-CZ2 4.41Å; E2551-W2573 HydrophobicContact CG-CH2 3.77Å; E2551-W2573 HydrophobicContact CG-CZ2 4.38Å; E2551-W2573 VanDerWaalsContact OE1-CH2 3.27Å; E2551-W2573 WeakPolarHBondContact OE1-CH2 3.22Å; E2551-W2573 WeakPolarHBondContact OE1-CZ2 3.27Å
2552	W	88.1	Confident	85.1	Confident	0.333333 Å²	0.333333	43.8 Å²	43.8	0%	0.001	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	136.3	177.9	179.9	96.9	0	0	0	108.9	H2543 I2544 L2546 A2554 I2565 S2566 I2595 A2602 I2604 C2615 P2616 L2617	H2543-W2552 CarbonylContact C-O 3.51Å; H2543-W2552 VanDerWaalsContact CA-O 3.32Å; H2543-W2552 WeakPolarHBondContact CA-O 3.43Å; I2544-W2552 HydrophobicContact CB-CB 4.45Å; I2544-W2552 HydrophobicContact CB-CE3 4.2Å; I2544-W2552 HydrophobicContact CD1-CD2 4.3Å; I2544-W2552 HydrophobicContact CD1-CE3 3.56Å; I2544-W2552 VanDerWaalsContact CD1-CE3 3.48Å; I2544-W2552 HydrophobicContact CD1-CZ3 3.6Å; I2544-W2552 HydrophobicContact CG1-CE3 3.83Å; I2544-W2552 HydrophobicContact CG1-CZ3 4.17Å; I2544-W2552 PolarHBondContact N-O 2.83Å; I2544-W2552 PolarHBondContact O-N 3.36Å; L2546-W2552 HydrophobicContact CD1-CB 4.4Å; W2552-A2554 HydrophobicContact CH2-CB 3.67Å; W2552-A2554 HydrophobicContact CZ2-CB 4.45Å; W2552-A2554 HydrophobicContact CZ3-CB 3.69Å; W2552-I2565 HydrophobicContact CD2-CG2 4.41Å; W2552-I2565 VanDerWaalsContact CE2-CG2 3.45Å; W2552-I2565 HydrophobicContact CH2-CD1 4.31Å; W2552-I2565 HydrophobicContact CZ2-CD1 4.11Å; W2552-I2565 HydrophobicContact CZ2-CG2 3.59Å; W2552-I2565 VanDerWaalsContact NE1-CG2 3.26Å; W2552-S2566 CarbonylContact C-O 3.53Å; W2552-S2566 WeakPolarHBondContact CA-O 3.28Å; W2552-I2595 HydrophobicContact CH2-CD1 4.23Å; W2552-I2595 HydrophobicContact CZ3-CD1 4.24Å; W2552-A2602 HydrophobicContact CH2-CB 4.02Å; W2552-A2602 HydrophobicContact CZ2-CB 3.81Å; W2552-I2604 HydrophobicContact CH2-CD1 4.15Å; W2552-I2604 HydrophobicContact CH2-CG1 4.46Å; W2552-C2615 HydrophobicContact CZ2-CB 3.87Å; W2552-P2616 VanDerWaalsContact CD1-O 3.25Å; W2552-P2616 PolarHBondContact NE1-O 3.11Å; W2552-P2616 VanDerWaalsContact NE1-O 3.11Å; W2552-L2617 HydrophobicContact CB-CD2 3.96Å; W2552-L2617 VanDerWaalsContact CD1-CD2 3.46Å; W2552-L2617 HydrophobicContact CD2-CD2 3.82Å; W2552-L2617 HydrophobicContact CG-CD2 3.51Å; W2552-L2617 VanDerWaalsContact CG-CD2 3.43Å
2553	K	90.6	Very high	85.1	Confident	51.6667 Å²	51.6667	43.8 Å²	43.8	23%	0.225	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	127.3	-173.7	-176.9	177.5	150.7	171.3	0	110.7	A2541 V2542 H2543 V2555 I2565 S2566 W2573	A2541-K2553 HydrophobicContact CB-CD 4.2Å; A2541-K2553 HydrophobicContact CB-CG 4.29Å; V2542-K2553 CarbonylContact O-C 3.52Å; V2542-K2553 VanDerWaalsContact O-CA 3.3Å; V2542-K2553 WeakPolarHBondContact O-CA 3.42Å; H2543-K2553 VanDerWaalsContact CE1-CE 3.45Å; H2543-K2553 WeakPolarHBondContact CE1-CE 3.4Å; H2543-K2553 VanDerWaalsContact NE2-CD 3.31Å; H2543-K2553 WeakPolarHBondContact NE2-CD 3.33Å; H2543-K2553 VanDerWaalsContact NE2-CE 3.29Å; H2543-K2553 WeakPolarHBondContact NE2-CE 3.41Å; K2553-V2555 HydrophobicContact CD-CG2 3.94Å; K2553-V2555 VanDerWaalsContact CE-CG2 3.44Å; K2553-V2555 HydrophobicContact CG-CG2 3.89Å; K2553-I2565 CarbonylContact O-C 3.55Å; K2553-I2565 WeakPolarHBondContact O-CA 3.29Å; K2553-S2566 PolarHBondContact N-O 2.91Å; K2553-S2566 PolarHBondContact O-N 3.14Å; K2553-W2573 HydrophobicContact CB-CE3 4.16Å; K2553-W2573 HydrophobicContact CB-CH2 3.55Å; K2553-W2573 VanDerWaalsContact CB-CH2 3.47Å; K2553-W2573 HydrophobicContact CB-CZ2 4.48Å; K2553-W2573 HydrophobicContact CB-CZ3 3.36Å; K2553-W2573 VanDerWaalsContact CB-CZ3 3.41Å; K2553-W2573 HydrophobicContact CD-CE3 4.42Å; K2553-W2573 HydrophobicContact CD-CH2 3.93Å; K2553-W2573 HydrophobicContact CD-CZ2 4.13Å; K2553-W2573 HydrophobicContact CD-CZ3 4.13Å; K2553-W2573 HydrophobicContact CG-CH2 4.33Å; K2553-W2573 HydrophobicContact CG-CZ3 4.39Å
2554	A	91.7	Very high	85.1	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	107.6	168.3	0	0	0	0	0	109.1	A2541 V2542 W2552 W2563 I2565 I2604	A2541-A2554 CarbonylContact C-O 3.55Å; A2541-A2554 VanDerWaalsContact CA-O 3.28Å; A2541-A2554 WeakPolarHBondContact CA-O 3.29Å; V2542-A2554 HydrophobicContact CB-CB 4.42Å; V2542-A2554 PolarHBondContact N-O 3Å; V2542-A2554 PolarHBondContact O-N 3Å; W2552-A2554 HydrophobicContact CH2-CB 3.67Å; W2552-A2554 HydrophobicContact CZ2-CB 4.45Å; W2552-A2554 HydrophobicContact CZ3-CB 3.69Å; A2554-W2563 HydrophobicContact CB-CE3 4.21Å; A2554-W2563 HydrophobicContact CB-CZ3 4.2Å; A2554-I2565 HydrophobicContact CB-CD1 3.48Å; A2554-I2565 VanDerWaalsContact CB-CD1 3.47Å; A2554-I2604 HydrophobicContact CB-CD1 3.89Å
2555	V	92.8	Very high	85.3	Confident	40.6667 Å²	40.6667	43.2 Å²	43.2	25%	0.246	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	142.9	172.4	-170.4	0	0	0	0	108.8	F2540 A2541 K2553 W2563 T2564	F2540-V2555 CarbonylContact O-C 3.54Å; F2540-V2555 WeakPolarHBondContact O-CA 3.38Å; A2541-V2555 HydrophobicContact CB-CB 4.46Å; A2541-V2555 HydrophobicContact CB-CG1 4.42Å; A2541-V2555 HydrophobicContact CB-CG2 4.08Å; K2553-V2555 HydrophobicContact CD-CG2 3.94Å; K2553-V2555 VanDerWaalsContact CE-CG2 3.44Å; K2553-V2555 HydrophobicContact CG-CG2 3.89Å; V2555-W2563 CarbonylContact O-C 3.56Å; V2555-W2563 VanDerWaalsContact O-CA 3.29Å; V2555-W2563 WeakPolarHBondContact O-CA 3.34Å; V2555-T2564 PolarHBondContact N-O 3.2Å; V2555-T2564 PolarHBondContact O-N 2.91Å
2556	V	93.4	Very high	85.5	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	133.6	168.1	57.4	0	0	0	0	110.9	S2539 F2540 R2562 W2563 L2585	S2539-V2556 WeakPolarHBondContact CA-O 3.35Å; S2539-V2556 VanDerWaalsContact CB-O 3.31Å; S2539-V2556 WeakPolarHBondContact CB-O 3.35Å; F2540-V2556 HydrophobicContact CD1-CG1 3.46Å; F2540-V2556 VanDerWaalsContact CD1-CG1 3.46Å; F2540-V2556 HydrophobicContact CD2-CG1 4.09Å; F2540-V2556 HydrophobicContact CE1-CG1 3.25Å; F2540-V2556 HydrophobicContact CE2-CG1 3.9Å; F2540-V2556 HydrophobicContact CG-CG1 3.88Å; F2540-V2556 HydrophobicContact CZ-CG1 3.47Å; F2540-V2556 VanDerWaalsContact CZ-CG1 3.44Å; F2540-V2556 PolarHBondContact N-O 3.14Å; F2540-V2556 VanDerWaalsContact N-O 3.1Å; F2540-V2556 WeakPolarHBondContact O-CG1 3.32Å; F2540-V2556 PolarHBondContact O-N 2.91Å; V2556-R2562 WeakPolarHBondContact CA-O 3.38Å; V2556-W2563 HydrophobicContact CB-CD2 3.68Å; V2556-W2563 HydrophobicContact CB-CE3 4.01Å; V2556-W2563 HydrophobicContact CB-CG 4.09Å; V2556-W2563 HydrophobicContact CB-CH2 4.14Å; V2556-W2563 HydrophobicContact CB-CZ2 3.81Å; V2556-W2563 HydrophobicContact CB-CZ3 4.23Å; V2556-W2563 HydrophobicContact CG1-CD2 4.41Å; V2556-W2563 HydrophobicContact CG1-CE3 4.48Å; V2556-W2563 HydrophobicContact CG1-CH2 3.88Å; V2556-W2563 HydrophobicContact CG1-CZ2 3.79Å; V2556-W2563 HydrophobicContact CG1-CZ3 4.26Å; V2556-W2563 HydrophobicContact CG2-CD2 3.98Å; V2556-W2563 VanDerWaalsContact CG2-CE2 3.48Å; V2556-W2563 HydrophobicContact CG2-CG 4.07Å; V2556-W2563 HydrophobicContact CG2-CZ2 3.95Å; V2556-L2585 HydrophobicContact CB-CD1 4.49Å; V2556-L2585 HydrophobicContact CG1-CD1 4.24Å; V2556-L2585 HydrophobicContact CG2-CD1 3.71Å
2557	N	93.1	Very high	85.5	Confident	56.3333 Å²	56.3333	40.9 Å²	40.9	30%	0.301	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	120	161.7	176.4	-77.8	0	0	0	108.4	E2538 L2559 T2560 L2561 R2562	E2538-N2557 CarbonylContact O-C 3.41Å; E2538-N2557 WeakPolarHBondContact O-CA 3.33Å; E2538-N2557 PolarHBondContact O-ND2 3.25Å; N2557-L2559 PolarHBondContact OD1-N 3.01Å; N2557-L2559 VanDerWaalsContact OD1-N 3.1Å; N2557-T2560 WeakPolarHBondContact CB-OG1 3.19Å; N2557-T2560 WeakPolarHBondContact OD1-CB 3.34Å; N2557-T2560 WeakPolarHBondContact OD1-CG2 3.43Å; N2557-T2560 PolarHBondContact OD1-N 3.02Å; N2557-T2560 PolarHBondContact OD1-OG1 2.93Å; N2557-L2561 WeakPolarHBondContact O-CA 3.39Å; N2557-L2561 PolarHBondContact O-N 3.02Å; N2557-R2562 PolarHBondContact N-O 2.93Å; N2557-R2562 PolarHBondContact O-N 3.19Å
2558	V	90.3	Very high	85.9	Confident	4.66667 Å²	4.66667	41.9 Å²	41.9	3%	0.028	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-44.9	-171.2	175.4	0	0	0	0	111	L2533 A2537 E2538 F2540 L2561 L2585 Q2587	L2533-V2558 HydrophobicContact CD1-CG1 4.08Å; L2533-V2558 HydrophobicContact CD1-CG2 4.33Å; L2533-V2558 HydrophobicContact CD2-CG2 3.85Å; A2537-V2558 HydrophobicContact CB-CG2 4.34Å; A2537-V2558 WeakPolarHBondContact O-CB 3.31Å; E2538-V2558 PolarHBondContact O-N 3.15Å; F2540-V2558 HydrophobicContact CD1-CG2 4.41Å; V2558-L2561 VanDerWaalsContact O-CD2 3.28Å; V2558-L2561 WeakPolarHBondContact O-CD2 3.36Å; V2558-L2561 PolarHBondContact O-N 3.24Å; V2558-L2585 HydrophobicContact CG1-CB 4.09Å; V2558-Q2587 HydrophobicContact CG1-CG 3.96Å
2559	L	87.7	Confident	85.7	Confident	115 Å²	115	39.1 Å²	39.1	60%	0.602	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-43.7	-176.6	-60.4	175.7	0	0	0	112.5	N2557	N2557-L2559 PolarHBondContact OD1-N 3.01Å; N2557-L2559 VanDerWaalsContact OD1-N 3.1Å
2560	T	89.7	Confident	85	Confident	67.6667 Å²	67.6667	37.9 Å²	37.9	42%	0.415	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-12.2	-179	67.4	0	0	0	0	113.6	N2557 R2562 K2580	N2557-T2560 WeakPolarHBondContact CB-OG1 3.19Å; N2557-T2560 WeakPolarHBondContact OD1-CB 3.34Å; N2557-T2560 WeakPolarHBondContact OD1-CG2 3.43Å; N2557-T2560 PolarHBondContact OD1-N 3.02Å; N2557-T2560 PolarHBondContact OD1-OG1 2.93Å; T2560-R2562 PolarHBondContact O-N 2.87Å; T2560-R2562 VanDerWaalsContact OG1-CB 3.29Å; T2560-R2562 WeakPolarHBondContact OG1-CB 3.24Å; T2560-R2562 PolarHBondContact OG1-N 2.91Å; T2560-K2580 WeakPolarHBondContact O-CD 3.47Å; T2560-K2580 WeakPolarHBondContact O-CE 3.42Å; T2560-K2580 PolarHBondContact O-NZ 2.97Å; T2560-K2580 VanDerWaalsContact O-NZ 3.14Å
2561	L	89.9	Confident	84.3	Confident	31.6667 Å²	31.6667	39.6 Å²	39.6	17%	0.166	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.3	20.2	-168.3	-56.1	174.4	0	0	0	113.9	N2557 V2558 K2580 S2581 L2585	N2557-L2561 WeakPolarHBondContact O-CA 3.39Å; N2557-L2561 PolarHBondContact O-N 3.02Å; V2558-L2561 VanDerWaalsContact O-CD2 3.28Å; V2558-L2561 WeakPolarHBondContact O-CD2 3.36Å; V2558-L2561 PolarHBondContact O-N 3.24Å; L2561-K2580 HydrophobicContact CB-CG 4.25Å; L2561-K2580 WeakPolarHBondContact O-CA 3.45Å; L2561-S2581 PolarHBondContact O-N 3.3Å; L2561-S2581 PolarHBondContact O-OG 3.06Å; L2561-L2585 HydrophobicContact CD2-CB 3.79Å; L2561-L2585 HydrophobicContact CD2-CD1 4.26Å; L2561-L2585 HydrophobicContact CD2-CG 4.13Å
2562	R	91.4	Very high	83.5	Confident	127.667 Å²	127.667	43.9 Å²	43.9	48%	0.482	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	123.8	176.7	-179.5	178	172.5	171	-1.7	109.8	V2556 N2557 T2560 T2564 E2575 F2579	V2556-R2562 WeakPolarHBondContact CA-O 3.38Å; N2557-R2562 PolarHBondContact N-O 2.93Å; N2557-R2562 PolarHBondContact O-N 3.19Å; T2560-R2562 PolarHBondContact O-N 2.87Å; T2560-R2562 VanDerWaalsContact OG1-CB 3.29Å; T2560-R2562 WeakPolarHBondContact OG1-CB 3.24Å; T2560-R2562 PolarHBondContact OG1-N 2.91Å; R2562-T2564 PolarHBondContact NE-OG1 3.31Å; R2562-E2575 IonicContact NH2-OE1 3.34Å; R2562-E2575 PolarHBondContact NH2-OE1 2.93Å; R2562-F2579 WeakPolarHBondContact CA-O 3.38Å
2563	W	91.7	Very high	83	Confident	0.333333 Å²	0.333333	48.6 Å²	48.6	0%	0.001	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	134.8	169.2	-70.5	71.8	0	0	0	109.6	F2540 A2554 V2555 V2556 A2578 F2579 S2581 L2585 L2593 I2604 I2606 I2611	F2540-W2563 HydrophobicContact CE2-CH2 4.16Å; F2540-W2563 AromaticContact CZ-CH2 3.84Å; F2540-W2563 HydrophobicContact CZ-CH2 3.84Å; F2540-W2563 HydrophobicContact CZ-CZ2 4.11Å; A2554-W2563 HydrophobicContact CB-CE3 4.21Å; A2554-W2563 HydrophobicContact CB-CZ3 4.2Å; V2555-W2563 CarbonylContact O-C 3.56Å; V2555-W2563 VanDerWaalsContact O-CA 3.29Å; V2555-W2563 WeakPolarHBondContact O-CA 3.34Å; V2556-W2563 HydrophobicContact CB-CD2 3.68Å; V2556-W2563 HydrophobicContact CB-CE3 4.01Å; V2556-W2563 HydrophobicContact CB-CG 4.09Å; V2556-W2563 HydrophobicContact CB-CH2 4.14Å; V2556-W2563 HydrophobicContact CB-CZ2 3.81Å; V2556-W2563 HydrophobicContact CB-CZ3 4.23Å; V2556-W2563 HydrophobicContact CG1-CD2 4.41Å; V2556-W2563 HydrophobicContact CG1-CE3 4.48Å; V2556-W2563 HydrophobicContact CG1-CH2 3.88Å; V2556-W2563 HydrophobicContact CG1-CZ2 3.79Å; V2556-W2563 HydrophobicContact CG1-CZ3 4.26Å; V2556-W2563 HydrophobicContact CG2-CD2 3.98Å; V2556-W2563 VanDerWaalsContact CG2-CE2 3.48Å; V2556-W2563 HydrophobicContact CG2-CG 4.07Å; V2556-W2563 HydrophobicContact CG2-CZ2 3.95Å; W2563-A2578 CarbonylContact O-C 3.56Å; W2563-A2578 VanDerWaalsContact O-CA 3.27Å; W2563-A2578 WeakPolarHBondContact O-CA 3.36Å; W2563-F2579 HydrophobicContact CB-CD1 4.01Å; W2563-F2579 HydrophobicContact CB-CD2 4.05Å; W2563-F2579 HydrophobicContact CB-CE1 3.55Å; W2563-F2579 VanDerWaalsContact CB-CE1 3.47Å; W2563-F2579 HydrophobicContact CB-CE2 3.57Å; W2563-F2579 HydrophobicContact CB-CG 4.23Å; W2563-F2579 HydrophobicContact CB-CZ 3.29Å; W2563-F2579 AromaticContact CD1-CE2 3.74Å; W2563-F2579 HydrophobicContact CD2-CE2 4.29Å; W2563-F2579 AromaticContact CD2-CZ 3.94Å; W2563-F2579 HydrophobicContact CD2-CZ 3.97Å; W2563-F2579 HydrophobicContact CE3-CZ 4.38Å; W2563-F2579 HydrophobicContact CG-CD2 4.35Å; W2563-F2579 HydrophobicContact CG-CE1 4.26Å; W2563-F2579 AromaticContact CG-CE2 3.56Å; W2563-F2579 HydrophobicContact CG-CE2 3.56Å; W2563-F2579 AromaticContact CG-CZ 3.49Å; W2563-F2579 HydrophobicContact CG-CZ 3.49Å; W2563-F2579 VanDerWaalsContact CG-CZ 3.45Å; W2563-F2579 PolarHBondContact N-O 3.15Å; W2563-F2579 PolarHBondContact O-N 2.99Å; W2563-F2579 VanDerWaalsContact O-N 3.09Å; W2563-S2581 PolarHBondContact NE1-OG 3.2Å; W2563-S2581 VanDerWaalsContact NE1-OG 3.08Å; W2563-L2585 HydrophobicContact CZ2-CD1 4.31Å; W2563-L2593 HydrophobicContact CH2-CD1 4.39Å; W2563-I2604 HydrophobicContact CE3-CD1 3.79Å; W2563-I2604 HydrophobicContact CH2-CG2 4.29Å; W2563-I2604 HydrophobicContact CZ3-CD1 3.81Å; W2563-I2604 HydrophobicContact CZ3-CG2 4.26Å; W2563-I2606 HydrophobicContact CZ2-CD1 4.07Å; W2563-I2611 HydrophobicContact CD2-CD1 4.01Å; W2563-I2611 HydrophobicContact CE3-CD1 4.47Å; W2563-I2611 HydrophobicContact CG-CD1 4.43Å; W2563-I2611 HydrophobicContact CH2-CD1 4.12Å; W2563-I2611 HydrophobicContact CZ2-CD1 3.47Å
2564	T	89.4	Confident	82	Confident	27 Å²	27	48 Å²	48	17%	0.166	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	123.3	172	-44.8	0	0	0	0	108.6	V2555 R2562 E2575 A2578	V2555-T2564 PolarHBondContact N-O 3.2Å; V2555-T2564 PolarHBondContact O-N 2.91Å; R2562-T2564 PolarHBondContact NE-OG1 3.31Å; T2564-E2575 VanDerWaalsContact CG2-CD 3.49Å; T2564-E2575 HydrophobicContact CG2-CG 3.86Å; T2564-E2575 VanDerWaalsContact CG2-OE2 3.3Å; T2564-E2575 WeakPolarHBondContact CG2-OE2 3.32Å; T2564-A2578 HydrophobicContact CG2-CB 4.15Å
2565	I	89.6	Confident	81.4	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	133	177.5	-48.2	-59	0	0	0	108.3	W2552 K2553 A2554 E2575 S2576 L2577 F2579 I2604 C2615	W2552-I2565 HydrophobicContact CD2-CG2 4.41Å; W2552-I2565 VanDerWaalsContact CE2-CG2 3.45Å; W2552-I2565 HydrophobicContact CH2-CD1 4.31Å; W2552-I2565 HydrophobicContact CZ2-CD1 4.11Å; W2552-I2565 HydrophobicContact CZ2-CG2 3.59Å; W2552-I2565 VanDerWaalsContact NE1-CG2 3.26Å; K2553-I2565 CarbonylContact O-C 3.55Å; K2553-I2565 WeakPolarHBondContact O-CA 3.29Å; A2554-I2565 HydrophobicContact CB-CD1 3.48Å; A2554-I2565 VanDerWaalsContact CB-CD1 3.47Å; I2565-E2575 CarbonylContact O-C 3.53Å; I2565-E2575 WeakPolarHBondContact O-CA 3.46Å; I2565-E2575 WeakPolarHBondContact O-CG 3.31Å; I2565-S2576 PolarHBondContact O-N 3.07Å; I2565-S2576 PolarHBondContact O-OG 3.14Å; I2565-L2577 HydrophobicContact CB-CB 4.2Å; I2565-L2577 WeakPolarHBondContact CB-O 3.35Å; I2565-L2577 HydrophobicContact CG1-CB 4.3Å; I2565-L2577 HydrophobicContact CG1-CD2 4.24Å; I2565-L2577 WeakPolarHBondContact CG1-O 3.15Å; I2565-L2577 PolarHBondContact N-O 2.76Å; I2565-L2577 PolarHBondContact O-N 2.89Å; I2565-F2579 HydrophobicContact CD1-CE1 4.04Å; I2565-F2579 HydrophobicContact CG1-CE1 4.03Å; I2565-I2604 HydrophobicContact CD1-CD1 4.04Å; I2565-C2615 HydrophobicContact CG1-CB 4.35Å; I2565-C2615 HydrophobicContact CG2-CB 4.25Å
2566	S	85.9	Confident	80.3	Confident	15.3333 Å²	15.3333	52.3 Å²	52.3	11%	0.107	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	153.6	178	-54.5	0	0	0	0	111.5	W2552 K2553 I2574	W2552-S2566 CarbonylContact C-O 3.53Å; W2552-S2566 WeakPolarHBondContact CA-O 3.28Å; K2553-S2566 PolarHBondContact N-O 2.91Å; K2553-S2566 PolarHBondContact O-N 3.14Å; S2566-I2574 CarbonylContact C-O 3.54Å; S2566-I2574 WeakPolarHBondContact CA-O 3.38Å; S2566-I2574 WeakPolarHBondContact CB-O 3.33Å
2567	S	80.7	Confident	79.4	Confident	8 Å²	8	54.1 Å²	54.1	6%	0.056	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	137.1	170.8	-58.6	0	0	0	0	110.1	E2551 V2569 I2574	E2551-S2567 CarbonylContact O-C 3.45Å; E2551-S2567 VanDerWaalsContact O-CA 3.3Å; E2551-S2567 WeakPolarHBondContact O-CA 3.4Å; S2567-V2569 PolarHBondContact O-N 2.94Å; S2567-I2574 PolarHBondContact N-O 2.97Å; S2567-I2574 PolarHBondContact O-N 2.93Å
2568	F	76.3	Confident	78.9	Confident	64.6667 Å²	64.6667	53 Å²	53	28%	0.284	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	116.7	174.9	-168.5	-111	0	0	0	109.5	E2549 T2550 E2551 G2571 R2572 W2573	E2549-F2568 WeakPolarHBondContact O-CD1 3.42Å; T2550-F2568 VanDerWaalsContact CA-O 3.31Å; T2550-F2568 WeakPolarHBondContact CA-O 3.45Å; T2550-F2568 WeakPolarHBondContact CB-O 3.31Å; E2551-F2568 HydrophobicContact CB-CB 3.84Å; E2551-F2568 PolarHBondContact N-O 2.84Å; E2551-F2568 PolarHBondContact O-N 3.15Å; F2568-G2571 VanDerWaalsContact CE2-C 3.42Å; F2568-G2571 VanDerWaalsContact CE2-O 3.27Å; F2568-G2571 WeakPolarHBondContact CE2-O 3.21Å; F2568-G2571 VanDerWaalsContact CZ-C 3.5Å; F2568-G2571 VanDerWaalsContact CZ-CA 3.46Å; F2568-R2572 CarbonylContact C-O 3.59Å; F2568-R2572 VanDerWaalsContact CA-O 3.25Å; F2568-R2572 WeakPolarHBondContact CA-O 3.38Å; F2568-W2573 HydrophobicContact CB-CD2 4.06Å; F2568-W2573 HydrophobicContact CB-CE3 3.92Å; F2568-W2573 HydrophobicContact CB-CH2 3.91Å; F2568-W2573 HydrophobicContact CB-CZ2 4.04Å; F2568-W2573 HydrophobicContact CB-CZ3 3.84Å; F2568-W2573 AromaticContact CD2-CD1 3.79Å; F2568-W2573 AromaticContact CD2-CD2 3.9Å; F2568-W2573 HydrophobicContact CD2-CD2 3.9Å; F2568-W2573 AromaticContact CD2-CE2 3.7Å; F2568-W2573 AromaticContact CD2-CG 3.95Å; F2568-W2573 HydrophobicContact CD2-CG 3.97Å; F2568-W2573 HydrophobicContact CD2-CZ2 4.25Å; F2568-W2573 AromaticContact CD2-NE1 3.61Å; F2568-W2573 AromaticContact CE2-NE1 3.96Å; F2568-W2573 HydrophobicContact CG-CD2 4.41Å; F2568-W2573 HydrophobicContact CG-CZ2 4.33Å
2569	V	61.3	Low	78.7	Confident	16.3333 Å²	16.3333	54.3 Å²	54.3	10%	0.099	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	118.3	-173.7	-173.5	0	0	0	0	108.1	N2194 N2215 T2550 S2567 G2571 R2572 I2574 L2618 G2744	N2194-V2569 HydrophobicContact CB-CG1 3.77Å; N2215-V2569 VanDerWaalsContact CA-CG1 3.49Å; N2215-V2569 HydrophobicContact CB-CG1 4.06Å; N2215-V2569 WeakPolarHBondContact O-CB 3.29Å; T2550-V2569 HydrophobicContact CG2-CG1 4.39Å; S2567-V2569 PolarHBondContact O-N 2.94Å; V2569-G2571 VanDerWaalsContact C-N 3.28Å; V2569-G2571 PolarHBondContact O-N 3.04Å; V2569-G2571 VanDerWaalsContact O-N 3.16Å; V2569-R2572 PolarHBondContact N-O 2.85Å; V2569-R2572 PolarHBondContact O-N 2.99Å; V2569-R2572 VanDerWaalsContact O-O 3.08Å; V2569-I2574 HydrophobicContact CB-CD1 4.05Å; V2569-I2574 HydrophobicContact CB-CG1 4.49Å; V2569-I2574 HydrophobicContact CG1-CD1 4.25Å; V2569-I2574 HydrophobicContact CG2-CD1 4.14Å; V2569-L2618 HydrophobicContact CG2-CD1 3.55Å; V2569-L2618 VanDerWaalsContact CG2-CD1 3.49Å; V2569-G2744 WeakPolarHBondContact O-CA 3.26Å
2570	N	53.7	Low	78.6	Confident	102.667 Å²	102.667	55.8 Å²	55.8	55%	0.549	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.5	44	176	-50.2	-14.2	0	0	0	114.2	N2194 N2215 R2572 H2722 N2743	N2194-N2570 PolarHBondContact ND2-OD1 2.84Å; N2215-N2570 HydrophobicContact CB-CB 3.85Å; N2215-N2570 VanDerWaalsContact CG-CG 3.46Å; N2215-N2570 PolarHBondContact ND2-ND2 3.06Å; N2215-N2570 PolarHBondContact OD1-ND2 3.34Å; N2570-R2572 VanDerWaalsContact C-N 3.3Å; N2570-R2572 PolarHBondContact O-N 2.98Å; N2570-H2722 VanDerWaalsContact CG-ND1 3.33Å; N2570-H2722 WeakPolarHBondContact ND2-CA 3.36Å; N2570-H2722 VanDerWaalsContact ND2-CB 3.31Å; N2570-H2722 WeakPolarHBondContact ND2-CB 3.39Å; N2570-H2722 PolarHBondContact ND2-O 3.11Å; N2570-H2722 PolarHBondContact OD1-ND1 3.26Å; N2570-N2743 WeakPolarHBondContact ND2-CA 3.38Å
2571	G	60.1	Low	78.2	Confident	54.3333 Å²	54.3333	52.8 Å²	52.8	56%	0.56	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.6	-1.5	178.6	0	0	0	0	0	115.4	F2568 V2569	F2568-G2571 VanDerWaalsContact CE2-C 3.42Å; F2568-G2571 VanDerWaalsContact CE2-O 3.27Å; F2568-G2571 WeakPolarHBondContact CE2-O 3.21Å; F2568-G2571 VanDerWaalsContact CZ-C 3.5Å; F2568-G2571 VanDerWaalsContact CZ-CA 3.46Å; V2569-G2571 VanDerWaalsContact C-N 3.28Å; V2569-G2571 PolarHBondContact O-N 3.04Å; V2569-G2571 VanDerWaalsContact O-N 3.16Å
2572	R	66.3	Low	77.7	Confident	137.667 Å²	137.667	63 Å²	63	52%	0.519	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	147.3	-178.6	-66.7	-176.9	171.2	-175.3	-6	111.9	E2217 F2568 V2569 N2570 I2574 T2745	E2217-R2572 WeakPolarHBondContact OE1-CD 3.36Å; E2217-R2572 IonicContact OE1-CZ 2.98Å; E2217-R2572 IonicContact OE1-NE 3.94Å; E2217-R2572 IonicContact OE1-NH1 2.68Å; E2217-R2572 PolarHBondContact OE1-NH1 3.27Å; E2217-R2572 IonicContact OE2-NH1 2.68Å; E2217-R2572 PolarHBondContact OE2-NH1 3.32Å; F2568-R2572 CarbonylContact C-O 3.59Å; F2568-R2572 VanDerWaalsContact CA-O 3.25Å; F2568-R2572 WeakPolarHBondContact CA-O 3.38Å; V2569-R2572 PolarHBondContact N-O 2.85Å; V2569-R2572 PolarHBondContact O-N 2.99Å; V2569-R2572 VanDerWaalsContact O-O 3.08Å; N2570-R2572 VanDerWaalsContact C-N 3.3Å; N2570-R2572 PolarHBondContact O-N 2.98Å; R2572-I2574 HydrophobicContact CB-CD1 4.13Å; R2572-I2574 WeakPolarHBondContact O-CD1 3.49Å; R2572-T2745 PolarHBondContact NH1-OG1 2.85Å
2573	W	77.3	Confident	77	Confident	98.6667 Å²	98.6667	58.9 Å²	58.9	37%	0.374	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	126.6	169.8	-74.3	100.7	0	0	0	110.1	E2551 K2553 F2568	E2551-W2573 HydrophobicContact CB-CH2 3.88Å; E2551-W2573 HydrophobicContact CB-CZ2 4.41Å; E2551-W2573 HydrophobicContact CG-CH2 3.77Å; E2551-W2573 HydrophobicContact CG-CZ2 4.38Å; E2551-W2573 VanDerWaalsContact OE1-CH2 3.27Å; E2551-W2573 WeakPolarHBondContact OE1-CH2 3.22Å; E2551-W2573 WeakPolarHBondContact OE1-CZ2 3.27Å; K2553-W2573 HydrophobicContact CB-CE3 4.16Å; K2553-W2573 HydrophobicContact CB-CH2 3.55Å; K2553-W2573 VanDerWaalsContact CB-CH2 3.47Å; K2553-W2573 HydrophobicContact CB-CZ2 4.48Å; K2553-W2573 HydrophobicContact CB-CZ3 3.36Å; K2553-W2573 VanDerWaalsContact CB-CZ3 3.41Å; K2553-W2573 HydrophobicContact CD-CE3 4.42Å; K2553-W2573 HydrophobicContact CD-CH2 3.93Å; K2553-W2573 HydrophobicContact CD-CZ2 4.13Å; K2553-W2573 HydrophobicContact CD-CZ3 4.13Å; K2553-W2573 HydrophobicContact CG-CH2 4.33Å; K2553-W2573 HydrophobicContact CG-CZ3 4.39Å; F2568-W2573 HydrophobicContact CB-CD2 4.06Å; F2568-W2573 HydrophobicContact CB-CE3 3.92Å; F2568-W2573 HydrophobicContact CB-CH2 3.91Å; F2568-W2573 HydrophobicContact CB-CZ2 4.04Å; F2568-W2573 HydrophobicContact CB-CZ3 3.84Å; F2568-W2573 AromaticContact CD2-CD1 3.79Å; F2568-W2573 AromaticContact CD2-CD2 3.9Å; F2568-W2573 HydrophobicContact CD2-CD2 3.9Å; F2568-W2573 AromaticContact CD2-CE2 3.7Å; F2568-W2573 AromaticContact CD2-CG 3.95Å; F2568-W2573 HydrophobicContact CD2-CG 3.97Å; F2568-W2573 HydrophobicContact CD2-CZ2 4.25Å; F2568-W2573 AromaticContact CD2-NE1 3.61Å; F2568-W2573 AromaticContact CE2-NE1 3.96Å; F2568-W2573 HydrophobicContact CG-CD2 4.41Å; F2568-W2573 HydrophobicContact CG-CZ2 4.33Å
2574	I	69.7	Low	76.4	Confident	40 Å²	40	62.5 Å²	62.5	21%	0.205	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	122.7	173.7	-60.7	147.9	0	0	0	108.5	M2213 E2217 S2566 S2567 V2569 R2572 S2576 Y2741 G2744	M2213-I2574 HydrophobicContact CE-CG2 4.13Å; E2217-I2574 HydrophobicContact CG-CD1 4.41Å; S2566-I2574 CarbonylContact C-O 3.54Å; S2566-I2574 WeakPolarHBondContact CA-O 3.38Å; S2566-I2574 WeakPolarHBondContact CB-O 3.33Å; S2567-I2574 PolarHBondContact N-O 2.97Å; S2567-I2574 PolarHBondContact O-N 2.93Å; V2569-I2574 HydrophobicContact CB-CD1 4.05Å; V2569-I2574 HydrophobicContact CB-CG1 4.49Å; V2569-I2574 HydrophobicContact CG1-CD1 4.25Å; V2569-I2574 HydrophobicContact CG2-CD1 4.14Å; R2572-I2574 HydrophobicContact CB-CD1 4.13Å; R2572-I2574 WeakPolarHBondContact O-CD1 3.49Å; I2574-S2576 PolarHBondContact O-N 3.03Å; I2574-Y2741 HydrophobicContact CB-CD1 4.49Å; I2574-Y2741 HydrophobicContact CB-CE1 4.48Å; I2574-Y2741 HydrophobicContact CD1-CD1 3.54Å; I2574-Y2741 HydrophobicContact CD1-CE1 4.33Å; I2574-Y2741 HydrophobicContact CD1-CG 3.93Å; I2574-Y2741 HydrophobicContact CG1-CD1 3.82Å; I2574-Y2741 HydrophobicContact CG1-CE1 4.22Å; I2574-Y2741 HydrophobicContact CG2-CD1 3.82Å; I2574-Y2741 HydrophobicContact CG2-CE1 3.48Å; I2574-Y2741 VanDerWaalsContact CG2-CE1 3.48Å; I2574-G2744 WeakPolarHBondContact CG1-O 3.18Å
2575	E	80.1	Confident	76.3	Confident	98.6667 Å²	98.6667	61.9 Å²	61.9	46%	0.461	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	118	168.3	-177.1	169.6	141.4	0	0	109.1	R2562 T2564 I2565 A2578	R2562-E2575 IonicContact NH2-OE1 3.34Å; R2562-E2575 PolarHBondContact NH2-OE1 2.93Å; T2564-E2575 VanDerWaalsContact CG2-CD 3.49Å; T2564-E2575 HydrophobicContact CG2-CG 3.86Å; T2564-E2575 VanDerWaalsContact CG2-OE2 3.3Å; T2564-E2575 WeakPolarHBondContact CG2-OE2 3.32Å; I2565-E2575 CarbonylContact O-C 3.53Å; I2565-E2575 WeakPolarHBondContact O-CA 3.46Å; I2565-E2575 WeakPolarHBondContact O-CG 3.31Å; E2575-A2578 WeakPolarHBondContact OE1-CB 3.35Å
2576	S	68	Low	76.2	Confident	32.6667 Å²	32.6667	67.4 Å²	67.4	23%	0.228	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	-22.3	-176.6	63.2	0	0	0	0	113	R2188 I2565 I2574	R2188-S2576 PolarHBondContact NH1-O 3.43Å; I2565-S2576 PolarHBondContact O-N 3.07Å; I2565-S2576 PolarHBondContact O-OG 3.14Å; I2574-S2576 PolarHBondContact O-N 3.03Å
2577	L	75.5	Confident	76.4	Confident	37.6667 Å²	37.6667	70.3 Å²	70.3	20%	0.197	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	139.3	178.7	178.3	66.3	0	0	0	111.2	I2565 F2579 P2613	I2565-L2577 HydrophobicContact CB-CB 4.2Å; I2565-L2577 WeakPolarHBondContact CB-O 3.35Å; I2565-L2577 HydrophobicContact CG1-CB 4.3Å; I2565-L2577 HydrophobicContact CG1-CD2 4.24Å; I2565-L2577 WeakPolarHBondContact CG1-O 3.15Å; I2565-L2577 PolarHBondContact N-O 2.76Å; I2565-L2577 PolarHBondContact O-N 2.89Å; L2577-F2579 HydrophobicContact CD2-CD1 3.86Å; L2577-F2579 HydrophobicContact CD2-CE1 4.29Å; L2577-F2579 HydrophobicContact CG-CD1 4.2Å; L2577-P2613 HydrophobicContact CD1-CG 4.41Å; L2577-P2613 HydrophobicContact CD2-CB 4.43Å; L2577-P2613 HydrophobicContact CD2-CG 3.48Å; L2577-P2613 VanDerWaalsContact CD2-CG 3.44Å; L2577-P2613 HydrophobicContact CG-CG 4.41Å
2578	A	83.1	Confident	76.6	Confident	33.3333 Å²	33.3333	70.9 Å²	70.9	28%	0.275	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	147.2	161.2	0	0	0	0	0	112.2	W2563 T2564 E2575 K2712	W2563-A2578 CarbonylContact O-C 3.56Å; W2563-A2578 VanDerWaalsContact O-CA 3.27Å; W2563-A2578 WeakPolarHBondContact O-CA 3.36Å; T2564-A2578 HydrophobicContact CG2-CB 4.15Å; E2575-A2578 WeakPolarHBondContact OE1-CB 3.35Å; A2578-K2712 PolarHBondContact O-NZ 2.93Å
2579	F	85.2	Confident	77.2	Confident	32 Å²	32	69.7 Å²	69.7	14%	0.14	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	168.6	176.6	64.3	-86.7	0	0	0	111.2	R2562 W2563 I2565 L2577 I2604 I2611 P2613	R2562-F2579 WeakPolarHBondContact CA-O 3.38Å; W2563-F2579 HydrophobicContact CB-CD1 4.01Å; W2563-F2579 HydrophobicContact CB-CD2 4.05Å; W2563-F2579 HydrophobicContact CB-CE1 3.55Å; W2563-F2579 VanDerWaalsContact CB-CE1 3.47Å; W2563-F2579 HydrophobicContact CB-CE2 3.57Å; W2563-F2579 HydrophobicContact CB-CG 4.23Å; W2563-F2579 HydrophobicContact CB-CZ 3.29Å; W2563-F2579 AromaticContact CD1-CE2 3.74Å; W2563-F2579 HydrophobicContact CD2-CE2 4.29Å; W2563-F2579 AromaticContact CD2-CZ 3.94Å; W2563-F2579 HydrophobicContact CD2-CZ 3.97Å; W2563-F2579 HydrophobicContact CE3-CZ 4.38Å; W2563-F2579 HydrophobicContact CG-CD2 4.35Å; W2563-F2579 HydrophobicContact CG-CE1 4.26Å; W2563-F2579 AromaticContact CG-CE2 3.56Å; W2563-F2579 HydrophobicContact CG-CE2 3.56Å; W2563-F2579 AromaticContact CG-CZ 3.49Å; W2563-F2579 HydrophobicContact CG-CZ 3.49Å; W2563-F2579 VanDerWaalsContact CG-CZ 3.45Å; W2563-F2579 PolarHBondContact N-O 3.15Å; W2563-F2579 PolarHBondContact O-N 2.99Å; W2563-F2579 VanDerWaalsContact O-N 3.09Å; I2565-F2579 HydrophobicContact CD1-CE1 4.04Å; I2565-F2579 HydrophobicContact CG1-CE1 4.03Å; L2577-F2579 HydrophobicContact CD2-CD1 3.86Å; L2577-F2579 HydrophobicContact CD2-CE1 4.29Å; L2577-F2579 HydrophobicContact CG-CD1 4.2Å; F2579-I2604 HydrophobicContact CZ-CD1 4.44Å; F2579-I2611 WeakPolarHBondContact CD2-O 3.29Å; F2579-I2611 HydrophobicContact CE2-CD1 4.25Å; F2579-I2611 HydrophobicContact CE2-CG1 4.44Å; F2579-I2611 VanDerWaalsContact CE2-O 3.27Å; F2579-I2611 WeakPolarHBondContact CE2-O 3.28Å; F2579-P2613 HydrophobicContact CD1-CG 4.3Å
2580	K	85	Confident	78.4	Confident	145 Å²	145	71.8 Å²	71.8	63%	0.63	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.2	126.7	174.1	179.7	164.2	176.5	153.5	0	110.2	T2560 L2561	T2560-K2580 WeakPolarHBondContact O-CD 3.47Å; T2560-K2580 WeakPolarHBondContact O-CE 3.42Å; T2560-K2580 PolarHBondContact O-NZ 2.97Å; T2560-K2580 VanDerWaalsContact O-NZ 3.14Å; L2561-K2580 HydrophobicContact CB-CG 4.25Å; L2561-K2580 WeakPolarHBondContact O-CA 3.45Å
2581	S	83.2	Confident	80	Confident	4.33333 Å²	4.33333	67.5 Å²	67.5	3%	0.03	34%	0.344	C	S	.	.			trans	-72.3	140.4	178.8	143.9	0	0	0	0	111.4	L2561 W2563 Q2583	L2561-S2581 PolarHBondContact O-N 3.3Å; L2561-S2581 PolarHBondContact O-OG 3.06Å; W2563-S2581 PolarHBondContact NE1-OG 3.2Å; W2563-S2581 VanDerWaalsContact NE1-OG 3.08Å; S2581-Q2583 PolarHBondContact OG-N 3.16Å; S2581-Q2583 PolarHBondContact OG-O 3.24Å
2582	R	77.3	Confident	81	Confident	246.667 Å²	246.667	69.4 Å²	69.4	93%	0.931	34%	0.337	S	S	*	.	S	Bend	trans	-85.1	-18.4	168.1	-64.8	-175.1	-177.7	179.7	1.1	113
2583	Q	78.3	Confident	82	Confident	42.3333 Å²	42.3333	63 Å²	63	20%	0.198	31%	0.313	C	S	.	.	S	Bend	trans	-79.4	126.9	173.4	-110.6	-39.7	-19	0	0	109.6	S2581 I2606 Q2609 I2611	S2581-Q2583 PolarHBondContact OG-N 3.16Å; S2581-Q2583 PolarHBondContact OG-O 3.24Å; Q2583-I2606 HydrophobicContact CB-CB 4.09Å; Q2583-I2606 HydrophobicContact CB-CD1 4.34Å; Q2583-I2606 HydrophobicContact CB-CG2 4.04Å; Q2583-I2606 HydrophobicContact CG-CB 4.16Å; Q2583-I2606 HydrophobicContact CG-CG2 4.06Å; Q2583-Q2609 HydrophobicContact CG-CB 4.36Å; Q2583-Q2609 VanDerWaalsContact NE2-CD 3.26Å; Q2583-I2611 HydrophobicContact CB-CG2 3.75Å; Q2583-I2611 HydrophobicContact CG-CG2 4.14Å
2584	P	79.2	Confident	82.2	Confident	75 Å²	75	59.6 Å²	59.6	49%	0.487	30%	0.302	S	S	.	.			trans	-72.2	140.8	177.5	29.5	-34.6	0	0	0	111.6
2585	L	86.2	Confident	82.9	Confident	14.3333 Å²	14.3333	57.8 Å²	57.8	8%	0.075	29%	0.293	C	S	.	.			trans	-106.2	107.1	169.4	-75.9	172.7	0	0	0	107.6	L2533 F2540 V2556 V2558 L2561 W2563 F2591 I2606	L2533-L2585 HydrophobicContact CD1-CB 3.88Å; L2533-L2585 HydrophobicContact CD1-CD2 4.23Å; F2540-L2585 HydrophobicContact CE1-CD1 4.12Å; F2540-L2585 HydrophobicContact CE1-CD2 4.34Å; V2556-L2585 HydrophobicContact CB-CD1 4.49Å; V2556-L2585 HydrophobicContact CG1-CD1 4.24Å; V2556-L2585 HydrophobicContact CG2-CD1 3.71Å; V2558-L2585 HydrophobicContact CG1-CB 4.09Å; L2561-L2585 HydrophobicContact CD2-CB 3.79Å; L2561-L2585 HydrophobicContact CD2-CD1 4.26Å; L2561-L2585 HydrophobicContact CD2-CG 4.13Å; W2563-L2585 HydrophobicContact CZ2-CD1 4.31Å; L2585-F2591 HydrophobicContact CD2-CD1 4.14Å; L2585-F2591 HydrophobicContact CD2-CD2 4.4Å; L2585-F2591 HydrophobicContact CD2-CE1 3.9Å; L2585-F2591 HydrophobicContact CD2-CE2 4.14Å; L2585-F2591 HydrophobicContact CD2-CG 4.41Å; L2585-F2591 HydrophobicContact CD2-CZ 3.9Å; L2585-I2606 HydrophobicContact CD1-CD1 4.46Å; L2585-I2606 HydrophobicContact CD2-CD1 3.83Å; L2585-I2606 HydrophobicContact CG-CD1 4.25Å
2586	I	87.2	Confident	82.7	Confident	115.667 Å²	115.667	54.3 Å²	54.3	59%	0.593	28%	0.277	S	S	*	.			trans	-95.2	120.8	-176.5	-56.6	174.3	0	0	0	108.4	L2533 A2589	L2533-I2586 VanDerWaalsContact CD1-O 3.32Å; L2533-I2586 WeakPolarHBondContact CD1-O 3.35Å; I2586-A2589 HydrophobicContact CB-CB 3.98Å; I2586-A2589 HydrophobicContact CG2-CB 4.24Å; I2586-A2589 VanDerWaalsContact O-CB 3.23Å; I2586-A2589 WeakPolarHBondContact O-CB 3.36Å; I2586-A2589 PolarHBondContact O-N 2.96Å; I2586-A2589 VanDerWaalsContact O-N 3.11Å
2587	Q	90.4	Very high	82.9	Confident	75.3333 Å²	75.3333	53 Å²	53	35%	0.352	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	145.4	177	-63.3	169.7	-53	0	0	111.1	P2535 N2536 A2537 V2558 A2589	P2535-Q2587 VanDerWaalsContact O-CB 3.28Å; P2535-Q2587 WeakPolarHBondContact O-CB 3.35Å; N2536-Q2587 VanDerWaalsContact C-NE2 3.3Å; N2536-Q2587 PolarHBondContact O-NE2 2.82Å; A2537-Q2587 HydrophobicContact CB-CG 4.41Å; A2537-Q2587 PolarHBondContact O-NE2 3.19Å; V2558-Q2587 HydrophobicContact CG1-CG 3.96Å; Q2587-A2589 PolarHBondContact O-N 3.29Å; Q2587-A2589 VanDerWaalsContact O-N 3.11Å
2588	G	85.6	Confident	82.1	Confident	21.3333 Å²	21.3333	52.9 Å²	52.9	22%	0.22	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.3	-19.4	-173	0	0	0	0	0	116.3	R2532 L2533 E2534	R2532-G2588 WeakPolarHBondContact CG-O 3.37Å; R2532-G2588 PolarHBondContact NE-O 3.12Å; L2533-G2588 CarbonylContact O-C 3.52Å; L2533-G2588 VanDerWaalsContact O-C 3.29Å; L2533-G2588 WeakPolarHBondContact O-CA 3.37Å; L2533-G2588 PolarHBondContact O-N 3.31Å; L2533-G2588 VanDerWaalsContact O-N 3.14Å; E2534-G2588 PolarHBondContact O-N 2.79Å
2589	A	88	Confident	80.8	Confident	39 Å²	39	54.1 Å²	54.1	32%	0.322	27%	0.268	S	S	.	.			trans	-87.8	156.9	-171.7	0	0	0	0	0	113.8	R2532 L2533 I2586 Q2587	R2532-A2589 VanDerWaalsContact CA-O 3.3Å; R2532-A2589 WeakPolarHBondContact CA-O 3.38Å; L2533-A2589 PolarHBondContact N-O 3.26Å; I2586-A2589 HydrophobicContact CB-CB 3.98Å; I2586-A2589 HydrophobicContact CG2-CB 4.24Å; I2586-A2589 VanDerWaalsContact O-CB 3.23Å; I2586-A2589 WeakPolarHBondContact O-CB 3.36Å; I2586-A2589 PolarHBondContact O-N 2.96Å; I2586-A2589 VanDerWaalsContact O-N 3.11Å; Q2587-A2589 PolarHBondContact O-N 3.29Å; Q2587-A2589 VanDerWaalsContact O-N 3.11Å
2590	T	86.7	Confident	79.7	Confident	60.3333 Å²	60.3333	53.9 Å²	53.9	37%	0.37	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	131.9	177.4	-47	0	0	0	0	111.8	T2530 V2531 R2532 R2634	T2530-T2590 HydrophobicContact CG2-CG2 3.68Å; V2531-T2590 CarbonylContact O-C 3.49Å; V2531-T2590 WeakPolarHBondContact O-CA 3.18Å; V2531-T2590 WeakPolarHBondContact O-CG2 3.35Å; R2532-T2590 HydrophobicContact CB-CG2 4.29Å; T2590-R2634 PolarHBondContact OG1-NH1 2.88Å
2591	F	86.6	Confident	79	Confident	13 Å²	13	47.5 Å²	47.5	6%	0.057	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	165.9	176.5	67.4	-80.4	0	0	0	111.4	V2531 L2533 F2540 L2585 L2593 I2606 N2607	V2531-F2591 HydrophobicContact CB-CD1 4.37Å; V2531-F2591 HydrophobicContact CB-CE1 3.81Å; V2531-F2591 HydrophobicContact CB-CE2 4.22Å; V2531-F2591 HydrophobicContact CB-CZ 3.69Å; V2531-F2591 HydrophobicContact CG1-CE1 3.75Å; V2531-F2591 HydrophobicContact CG1-CZ 3.73Å; V2531-F2591 HydrophobicContact CG2-CZ 4.4Å; V2531-F2591 PolarHBondContact N-O 3.31Å; V2531-F2591 VanDerWaalsContact O-CD1 3.24Å; V2531-F2591 WeakPolarHBondContact O-CD1 3.27Å; V2531-F2591 PolarHBondContact O-N 3.13Å; V2531-F2591 VanDerWaalsContact O-O 3.13Å; L2533-F2591 HydrophobicContact CD1-CE1 4.39Å; L2533-F2591 HydrophobicContact CD2-CE1 4.41Å; L2533-F2591 HydrophobicContact CG-CE1 4.04Å; F2540-F2591 HydrophobicContact CE1-CE1 4.3Å; F2540-F2591 AromaticContact CE1-CZ 3.79Å; F2540-F2591 HydrophobicContact CE1-CZ 3.79Å; F2540-F2591 HydrophobicContact CE2-CZ 4.36Å; F2540-F2591 HydrophobicContact CZ-CE1 4.39Å; F2540-F2591 HydrophobicContact CZ-CE2 4.22Å; F2540-F2591 AromaticContact CZ-CZ 3.56Å; F2540-F2591 HydrophobicContact CZ-CZ 3.56Å; F2540-F2591 VanDerWaalsContact CZ-CZ 3.42Å; L2585-F2591 HydrophobicContact CD2-CD1 4.14Å; L2585-F2591 HydrophobicContact CD2-CD2 4.4Å; L2585-F2591 HydrophobicContact CD2-CE1 3.9Å; L2585-F2591 HydrophobicContact CD2-CE2 4.14Å; L2585-F2591 HydrophobicContact CD2-CG 4.41Å; L2585-F2591 HydrophobicContact CD2-CZ 3.9Å; F2591-L2593 HydrophobicContact CD2-CB 4.44Å; F2591-L2593 HydrophobicContact CE2-CB 3.98Å; F2591-L2593 HydrophobicContact CE2-CD1 4.3Å; F2591-I2606 HydrophobicContact CB-CG2 4.42Å; F2591-I2606 HydrophobicContact CD2-CG1 4.33Å; F2591-I2606 HydrophobicContact CD2-CG2 3.98Å; F2591-I2606 HydrophobicContact CE2-CD1 4.34Å; F2591-I2606 HydrophobicContact CE2-CG1 4.37Å; F2591-I2606 HydrophobicContact CG-CG2 4.42Å; F2591-N2607 WeakPolarHBondContact CA-OD1 3.45Å
2592	K	81.8	Confident	78.9	Confident	95.3333 Å²	95.3333	47.3 Å²	47.3	41%	0.414	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	115.9	171.7	-67.3	-171.5	174.7	-170.2	0	109.9	A2529 I2606 N2607	A2529-K2592 CarbonylContact O-C 3.59Å; A2529-K2592 WeakPolarHBondContact O-CA 3.38Å; K2592-I2606 CarbonylContact O-C 3.51Å; K2592-I2606 WeakPolarHBondContact O-CA 3.35Å; K2592-N2607 PolarHBondContact N-OD1 3.16Å; K2592-N2607 PolarHBondContact O-N 3.01Å
2593	L	87.6	Confident	79.1	Confident	1.66667 Å²	1.66667	36.4 Å²	36.4	1%	0.009	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	132.1	168.5	-178.3	67.5	0	0	0	108.5	A2529 V2531 F2540 V2542 W2563 F2591 I2595 I2604 I2606 I2627	A2529-L2593 HydrophobicContact CB-CB 4.31Å; A2529-L2593 HydrophobicContact CB-CD2 4.4Å; A2529-L2593 PolarHBondContact N-O 3.27Å; A2529-L2593 PolarHBondContact O-N 3.21Å; A2529-L2593 VanDerWaalsContact O-O 3.06Å; V2531-L2593 HydrophobicContact CG2-CB 4.22Å; V2531-L2593 HydrophobicContact CG2-CD2 4.44Å; F2540-L2593 HydrophobicContact CE2-CD2 4.14Å; V2542-L2593 HydrophobicContact CG1-CD2 4.28Å; V2542-L2593 HydrophobicContact CG2-CD2 3.64Å; W2563-L2593 HydrophobicContact CH2-CD1 4.39Å; F2591-L2593 HydrophobicContact CD2-CB 4.44Å; F2591-L2593 HydrophobicContact CE2-CB 3.98Å; F2591-L2593 HydrophobicContact CE2-CD1 4.3Å; L2593-I2595 HydrophobicContact CD1-CG1 4.38Å; L2593-I2595 HydrophobicContact CD2-CD1 4.48Å; L2593-I2595 HydrophobicContact CG-CG1 4.34Å; L2593-I2604 HydrophobicContact CD1-CG2 3.6Å; L2593-I2606 HydrophobicContact CD1-CG1 4.16Å; L2593-I2627 HydrophobicContact CD2-CD1 3.94Å
2594	I	81.4	Confident	79.5	Confident	28.3333 Å²	28.3333	34.4 Å²	34.4	15%	0.145	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	128.6	168.7	-49.8	174	0	0	0	107.4	I2527 H2528 I2596 I2604 L2605	I2527-I2594 CarbonylContact O-C 3.54Å; I2527-I2594 VanDerWaalsContact O-CA 3.28Å; I2527-I2594 WeakPolarHBondContact O-CA 3.41Å; I2527-I2594 WeakPolarHBondContact O-CG2 3.33Å; H2528-I2594 VanDerWaalsContact CE1-CG2 3.49Å; H2528-I2594 WeakPolarHBondContact CE1-CG2 3.32Å; I2594-I2596 HydrophobicContact CG2-CD1 3.88Å; I2594-I2596 HydrophobicContact CG2-CG1 4.11Å; I2594-I2604 CarbonylContact O-C 3.58Å; I2594-I2604 WeakPolarHBondContact O-CA 3.49Å; I2594-L2605 HydrophobicContact CB-CB 4.23Å; I2594-L2605 HydrophobicContact CB-CD1 4.25Å; I2594-L2605 HydrophobicContact CG2-CD1 4.25Å; I2594-L2605 PolarHBondContact N-O 3.24Å; I2594-L2605 WeakPolarHBondContact O-CD1 3.41Å; I2594-L2605 PolarHBondContact O-N 3.32Å
2595	I	84.4	Confident	79.9	Confident	1.33333 Å²	1.33333	31.2 Å²	31.2	1%	0.007	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	118.2	169	-55.8	-177.9	0	0	0	107.3	S2526 I2527 V2542 I2544 W2552 L2593 I2597 A2602 Q2603 I2604	S2526-I2595 CarbonylContact C-O 3.57Å; S2526-I2595 VanDerWaalsContact CA-O 3.3Å; S2526-I2595 WeakPolarHBondContact CA-O 3.46Å; S2526-I2595 WeakPolarHBondContact CB-O 3.24Å; I2527-I2595 HydrophobicContact CB-CB 4.31Å; I2527-I2595 HydrophobicContact CD1-CB 4.34Å; I2527-I2595 HydrophobicContact CD1-CD1 4.48Å; I2527-I2595 PolarHBondContact N-O 3.03Å; I2527-I2595 PolarHBondContact O-N 2.99Å; V2542-I2595 HydrophobicContact CB-CD1 4.21Å; V2542-I2595 HydrophobicContact CG1-CD1 3.65Å; V2542-I2595 HydrophobicContact CG2-CD1 4.34Å; I2544-I2595 HydrophobicContact CD1-CD1 4.21Å; I2544-I2595 HydrophobicContact CD1-CG2 4.24Å; W2552-I2595 HydrophobicContact CH2-CD1 4.23Å; W2552-I2595 HydrophobicContact CZ3-CD1 4.24Å; L2593-I2595 HydrophobicContact CD1-CG1 4.38Å; L2593-I2595 HydrophobicContact CD2-CD1 4.48Å; L2593-I2595 HydrophobicContact CG-CG1 4.34Å; I2595-I2597 HydrophobicContact CG2-CG1 4.36Å; I2595-A2602 HydrophobicContact CG2-CB 3.96Å; I2595-Q2603 CarbonylContact C-O 3.46Å; I2595-Q2603 WeakPolarHBondContact CA-O 3.45Å; I2595-I2604 HydrophobicContact CD1-CG1 4.49Å; I2595-I2604 HydrophobicContact CG1-CG1 4.31Å; I2595-I2604 HydrophobicContact CG1-CG2 4.31Å
2596	I	75.9	Confident	79.8	Confident	26.3333 Å²	26.3333	30.5 Å²	30.5	14%	0.135	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	120.7	176.2	-57.2	-179.8	0	0	0	107.4	M2524 I2594 A2602 Q2603 L2605 P2647 E2648 Y2669 M2673	M2524-I2596 HydrophobicContact CE-CG2 3.45Å; M2524-I2596 VanDerWaalsContact CE-CG2 3.45Å; M2524-I2596 HydrophobicContact CG-CG2 4.28Å; M2524-I2596 HydrophobicContact SD-CG2 3.66Å; I2594-I2596 HydrophobicContact CG2-CD1 3.88Å; I2594-I2596 HydrophobicContact CG2-CG1 4.11Å; I2596-A2602 CarbonylContact O-C 3.55Å; I2596-A2602 VanDerWaalsContact O-CA 3.29Å; I2596-A2602 WeakPolarHBondContact O-CA 3.36Å; I2596-Q2603 PolarHBondContact N-O 3.25Å; I2596-Q2603 PolarHBondContact O-N 3.19Å; I2596-L2605 HydrophobicContact CD1-CD1 3.68Å; I2596-L2605 HydrophobicContact CG1-CD1 3.77Å; I2596-P2647 WeakPolarHBondContact CD1-O 3.05Å; I2596-E2648 HydrophobicContact CB-CG 4.05Å; I2596-E2648 HydrophobicContact CD1-CG 3.97Å; I2596-E2648 HydrophobicContact CG2-CG 3.64Å; I2596-Y2669 HydrophobicContact CD1-CD1 3.87Å; I2596-Y2669 HydrophobicContact CD1-CD2 4.27Å; I2596-Y2669 HydrophobicContact CD1-CE1 3.6Å; I2596-Y2669 HydrophobicContact CD1-CE2 4.02Å; I2596-Y2669 HydrophobicContact CD1-CG 4.2Å; I2596-M2673 HydrophobicContact CD1-CE 4.18Å; I2596-M2673 HydrophobicContact CG2-CE 4.21Å
2597	I	71.2	Confident	79.6	Confident	5.33333 Å²	5.33333	29.4 Å²	29.4	3%	0.027	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	110.9	179.1	-63.9	170.7	0	0	0	107.4	M2524 Q2525 I2527 I2544 I2595 T2601 L2617 A2622	M2524-I2597 CarbonylContact C-O 3.56Å; M2524-I2597 WeakPolarHBondContact CA-O 3.44Å; M2524-I2597 HydrophobicContact CB-CD1 4.41Å; M2524-I2597 HydrophobicContact CE-CD1 3.37Å; M2524-I2597 HydrophobicContact CG-CD1 4.28Å; M2524-I2597 WeakPolarHBondContact CG-O 3.49Å; M2524-I2597 WeakPolarHBondContact O-CB 3.4Å; M2524-I2597 WeakPolarHBondContact O-CG2 3.45Å; Q2525-I2597 HydrophobicContact CB-CB 4.11Å; Q2525-I2597 HydrophobicContact CB-CG2 4.44Å; Q2525-I2597 PolarHBondContact N-O 3.36Å; Q2525-I2597 CarbonylContact O-C 3.45Å; Q2525-I2597 WeakPolarHBondContact O-CA 3.47Å; Q2525-I2597 PolarHBondContact O-N 2.86Å; Q2525-I2597 VanDerWaalsContact O-O 3.07Å; I2527-I2597 HydrophobicContact CD1-CD1 3.85Å; I2527-I2597 HydrophobicContact CG1-CD1 4.28Å; I2544-I2597 HydrophobicContact CD1-CD1 4.39Å; I2544-I2597 HydrophobicContact CG2-CD1 4.43Å; I2595-I2597 HydrophobicContact CG2-CG1 4.36Å; I2597-T2601 CarbonylContact C-O 3.53Å; I2597-T2601 WeakPolarHBondContact CA-O 3.4Å; I2597-L2617 HydrophobicContact CB-CD1 4.35Å; I2597-L2617 HydrophobicContact CG1-CD1 4.12Å; I2597-L2617 HydrophobicContact CG2-CD1 3.78Å; I2597-A2622 HydrophobicContact CD1-CB 3.52Å; I2597-A2622 VanDerWaalsContact CD1-CB 3.49Å
2598	D	59.5	Low	78.4	Confident	35.6667 Å²	35.6667	27.3 Å²	27.3	19%	0.191	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	172.7	170.8	-162	-16.1	0	0	0	108.7	T2303 H2305 M2524 Y2600 T2601 K2614	T2303-D2598 WeakPolarHBondContact CG2-OD1 3.4Å; H2305-D2598 IonicContact CD2-OD1 2.77Å; H2305-D2598 IonicContact CE1-OD1 3.52Å; H2305-D2598 IonicContact CE1-OD2 3.6Å; H2305-D2598 PolarHBondContact CE1-OD2 2.71Å; H2305-D2598 IonicContact NE2-OD1 3.76Å; H2305-D2598 PolarHBondContact NE2-OD1 2.69Å; H2305-D2598 IonicContact NE2-OD2 2.73Å; H2305-D2598 PolarHBondContact NE2-OD2 3.03Å; M2524-D2598 HydrophobicContact CE-CB 3.49Å; M2524-D2598 VanDerWaalsContact CE-CB 3.49Å; D2598-Y2600 PolarHBondContact O-N 2.91Å; D2598-T2601 PolarHBondContact N-O 3.22Å; D2598-T2601 PolarHBondContact O-N 2.9Å; D2598-T2601 VanDerWaalsContact O-O 3.11Å; D2598-K2614 IonicContact OD2-NZ 3.22Å; D2598-K2614 PolarHBondContact OD2-NZ 3.17Å
2599	I	56.4	Low	77.7	Confident	57 Å²	57	31.2 Å²	31.2	29%	0.292	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.8	111.9	-175.1	-51.9	177.7	0	0	0	109.5	T2303 D2523 T2601 F2680	T2303-I2599 HydrophobicContact CG2-CB 4.11Å; T2303-I2599 HydrophobicContact CG2-CD1 4.18Å; T2303-I2599 HydrophobicContact CG2-CG1 4.25Å; T2303-I2599 WeakPolarHBondContact OG1-CB 3.21Å; D2523-I2599 WeakPolarHBondContact O-CG1 3.12Å; I2599-T2601 VanDerWaalsContact C-N 3.25Å; I2599-T2601 PolarHBondContact O-N 3.37Å; I2599-F2680 WeakPolarHBondContact O-CE1 3.43Å; I2599-F2680 WeakPolarHBondContact O-CZ 3.29Å
2600	Y	61.6	Low	77.3	Confident	29 Å²	29	31.4 Å²	31.4	11%	0.114	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	18.1	-174.2	-46.3	-63.8	0	0	0	116.5	P2190 K2269 M2272 D2598 L2617 G2619 E2620 F2680 R2797	P2190-Y2600 HydrophobicContact CG-CE2 4.2Å; K2269-Y2600 HydrophobicContact CB-CE2 4.18Å; K2269-Y2600 HydrophobicContact CD-CE1 4.33Å; K2269-Y2600 WeakPolarHBondContact O-CE2 3.13Å; M2272-Y2600 HydrophobicContact CE-CD2 4.13Å; M2272-Y2600 HydrophobicContact SD-CD2 4.35Å; D2598-Y2600 PolarHBondContact O-N 2.91Å; Y2600-L2617 PolarHBondContact O-N 3.02Å; Y2600-G2619 WeakPolarHBondContact CD1-O 3.28Å; Y2600-E2620 HydrophobicContact CD1-CG 4.33Å; Y2600-E2620 HydrophobicContact CE1-CB 4.38Å; Y2600-E2620 HydrophobicContact CE1-CG 3.36Å; Y2600-E2620 VanDerWaalsContact CE1-CG 3.42Å; Y2600-E2620 WeakPolarHBondContact OH-CG 3.41Å; Y2600-E2620 PolarHBondContact OH-OE1 2.94Å; Y2600-E2620 VanDerWaalsContact OH-OE1 3.13Å; Y2600-F2680 HydrophobicContact CD2-CD1 4.14Å; Y2600-R2797 VanDerWaalsContact CD1-CZ 3.47Å; Y2600-R2797 VanDerWaalsContact CD1-NH1 3.3Å; Y2600-R2797 VanDerWaalsContact CE1-NH1 3.28Å; Y2600-R2797 VanDerWaalsContact CZ-NE 3.25Å; Y2600-R2797 PolarHBondContact OH-NH2 3.4Å
2601	T	70.6	Confident	77.1	Confident	10 Å²	10	29.5 Å²	29.5	6%	0.061	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	144.1	174.6	56.2	0	0	0	0	114.7	I2597 D2598 I2599 K2614 C2615 E2678 F2680	I2597-T2601 CarbonylContact C-O 3.53Å; I2597-T2601 WeakPolarHBondContact CA-O 3.4Å; D2598-T2601 PolarHBondContact N-O 3.22Å; D2598-T2601 PolarHBondContact O-N 2.9Å; D2598-T2601 VanDerWaalsContact O-O 3.11Å; I2599-T2601 VanDerWaalsContact C-N 3.25Å; I2599-T2601 PolarHBondContact O-N 3.37Å; T2601-K2614 HydrophobicContact CG2-CB 4.26Å; T2601-K2614 HydrophobicContact CG2-CD 4.48Å; T2601-C2615 CarbonylContact C-O 3.57Å; T2601-C2615 VanDerWaalsContact CA-O 3.26Å; T2601-C2615 WeakPolarHBondContact CA-O 3.32Å; T2601-C2615 WeakPolarHBondContact CB-O 3.32Å; T2601-E2678 WeakPolarHBondContact CG2-OE2 3.35Å; T2601-F2680 HydrophobicContact CG2-CE1 3.91Å; T2601-F2680 HydrophobicContact CG2-CZ 3.87Å
2602	A	80	Confident	76.9	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	135.2	171.1	0	0	0	0	0	111.3	W2552 I2595 I2596 C2615 L2617	W2552-A2602 HydrophobicContact CH2-CB 4.02Å; W2552-A2602 HydrophobicContact CZ2-CB 3.81Å; I2595-A2602 HydrophobicContact CG2-CB 3.96Å; I2596-A2602 CarbonylContact O-C 3.55Å; I2596-A2602 VanDerWaalsContact O-CA 3.29Å; I2596-A2602 WeakPolarHBondContact O-CA 3.36Å; A2602-C2615 PolarHBondContact N-O 3Å; A2602-C2615 VanDerWaalsContact O-CB 3.29Å; A2602-C2615 WeakPolarHBondContact O-CB 3.48Å; A2602-C2615 PolarHBondContact O-N 3.02Å; A2602-L2617 HydrophobicContact CB-CD1 4.07Å; A2602-L2617 HydrophobicContact CB-CD2 4.09Å; A2602-L2617 HydrophobicContact CB-CG 4.12Å
2603	Q	82.4	Confident	76.5	Confident	19 Å²	19	26.5 Å²	26.5	9%	0.089	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	133.4	168.2	-178	163.3	85.9	0	0	110.4	I2595 I2596 L2605 V2610 S2612 K2614 E2648 M2673	I2595-Q2603 CarbonylContact C-O 3.46Å; I2595-Q2603 WeakPolarHBondContact CA-O 3.45Å; I2596-Q2603 PolarHBondContact N-O 3.25Å; I2596-Q2603 PolarHBondContact O-N 3.19Å; Q2603-L2605 HydrophobicContact CG-CD1 4.39Å; Q2603-V2610 HydrophobicContact CG-CG1 3.95Å; Q2603-V2610 HydrophobicContact CG-CG2 3.94Å; Q2603-V2610 VanDerWaalsContact OE1-CG2 3.24Å; Q2603-S2612 PolarHBondContact NE2-O 3.39Å; Q2603-S2612 VanDerWaalsContact NE2-O 3.09Å; Q2603-K2614 HydrophobicContact CB-CG 4.36Å; Q2603-E2648 WeakPolarHBondContact CB-OE1 3.24Å; Q2603-E2648 WeakPolarHBondContact CG-OE1 3.29Å; Q2603-E2648 PolarHBondContact OE1-OE1 2.92Å; Q2603-E2648 PolarHBondContact OE1-OE2 3.1Å; Q2603-M2673 HydrophobicContact CB-CE 4.25Å; Q2603-M2673 PolarHBondContact OE1-SD 2.94Å
2604	I	87.2	Confident	75.6	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	132.3	-176.6	-47	178.6	0	0	0	109.7	W2552 A2554 W2563 I2565 F2579 L2593 I2594 I2595 I2611 S2612	W2552-I2604 HydrophobicContact CH2-CD1 4.15Å; W2552-I2604 HydrophobicContact CH2-CG1 4.46Å; A2554-I2604 HydrophobicContact CB-CD1 3.89Å; W2563-I2604 HydrophobicContact CE3-CD1 3.79Å; W2563-I2604 HydrophobicContact CH2-CG2 4.29Å; W2563-I2604 HydrophobicContact CZ3-CD1 3.81Å; W2563-I2604 HydrophobicContact CZ3-CG2 4.26Å; I2565-I2604 HydrophobicContact CD1-CD1 4.04Å; F2579-I2604 HydrophobicContact CZ-CD1 4.44Å; L2593-I2604 HydrophobicContact CD1-CG2 3.6Å; I2594-I2604 CarbonylContact O-C 3.58Å; I2594-I2604 WeakPolarHBondContact O-CA 3.49Å; I2595-I2604 HydrophobicContact CD1-CG1 4.49Å; I2595-I2604 HydrophobicContact CG1-CG1 4.31Å; I2595-I2604 HydrophobicContact CG1-CG2 4.31Å; I2604-I2611 HydrophobicContact CB-CD1 4.32Å; I2604-I2611 HydrophobicContact CB-CG1 4.03Å; I2604-I2611 HydrophobicContact CG2-CD1 3.83Å; I2604-I2611 HydrophobicContact CG2-CG1 3.91Å; I2604-I2611 VanDerWaalsContact O-CG1 3.29Å; I2604-I2611 WeakPolarHBondContact O-CG1 3.36Å; I2604-I2611 PolarHBondContact O-N 2.81Å; I2604-S2612 PolarHBondContact N-OG 3.18Å; I2604-S2612 PolarHBondContact O-N 3.27Å
2605	L	87.3	Confident	75.3	Confident	7 Å²	7	27.8 Å²	27.8	4%	0.037	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	140.9	175.7	-51.8	85.5	0	0	0	110.5	I2594 I2596 Q2603 Q2609 V2610 P2650	I2594-L2605 HydrophobicContact CB-CB 4.23Å; I2594-L2605 HydrophobicContact CB-CD1 4.25Å; I2594-L2605 HydrophobicContact CG2-CD1 4.25Å; I2594-L2605 PolarHBondContact N-O 3.24Å; I2594-L2605 WeakPolarHBondContact O-CD1 3.41Å; I2594-L2605 PolarHBondContact O-N 3.32Å; I2596-L2605 HydrophobicContact CD1-CD1 3.68Å; I2596-L2605 HydrophobicContact CG1-CD1 3.77Å; Q2603-L2605 HydrophobicContact CG-CD1 4.39Å; L2605-Q2609 CarbonylContact C-O 3.44Å; L2605-Q2609 WeakPolarHBondContact CA-O 3.36Å; L2605-Q2609 WeakPolarHBondContact CB-O 3.43Å; L2605-V2610 HydrophobicContact CD1-CG2 4.45Å; L2605-V2610 HydrophobicContact CD2-CG2 3.77Å; L2605-V2610 HydrophobicContact CG-CB 4.45Å; L2605-V2610 HydrophobicContact CG-CG2 3.81Å; L2605-P2650 HydrophobicContact CD2-CG 4.23Å
2606	I	84.6	Confident	74.5	Confident	0.5 Å²	0.5	29.4 Å²	29.4	0%	0.003	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	127.8	169.7	-68.2	179.1	0	0	0	108.5	W2563 Q2583 L2585 F2591 K2592 L2593 G2608 Q2609 I2611	W2563-I2606 HydrophobicContact CZ2-CD1 4.07Å; Q2583-I2606 HydrophobicContact CB-CB 4.09Å; Q2583-I2606 HydrophobicContact CB-CD1 4.34Å; Q2583-I2606 HydrophobicContact CB-CG2 4.04Å; Q2583-I2606 HydrophobicContact CG-CB 4.16Å; Q2583-I2606 HydrophobicContact CG-CG2 4.06Å; L2585-I2606 HydrophobicContact CD1-CD1 4.46Å; L2585-I2606 HydrophobicContact CD2-CD1 3.83Å; L2585-I2606 HydrophobicContact CG-CD1 4.25Å; F2591-I2606 HydrophobicContact CB-CG2 4.42Å; F2591-I2606 HydrophobicContact CD2-CG1 4.33Å; F2591-I2606 HydrophobicContact CD2-CG2 3.98Å; F2591-I2606 HydrophobicContact CE2-CD1 4.34Å; F2591-I2606 HydrophobicContact CE2-CG1 4.37Å; F2591-I2606 HydrophobicContact CG-CG2 4.42Å; K2592-I2606 CarbonylContact O-C 3.51Å; K2592-I2606 WeakPolarHBondContact O-CA 3.35Å; L2593-I2606 HydrophobicContact CD1-CG1 4.16Å; I2606-G2608 PolarHBondContact O-N 3.36Å; I2606-Q2609 PolarHBondContact N-O 3.41Å; I2606-Q2609 PolarHBondContact O-N 3.24Å; I2606-I2611 HydrophobicContact CB-CG2 4.05Å; I2606-I2611 HydrophobicContact CD1-CD1 3.68Å; I2606-I2611 HydrophobicContact CD1-CG1 4.44Å; I2606-I2611 HydrophobicContact CD1-CG2 4.24Å; I2606-I2611 HydrophobicContact CG1-CD1 3.9Å; I2606-I2611 HydrophobicContact CG1-CG1 4.24Å; I2606-I2611 HydrophobicContact CG1-CG2 4.15Å
2607	N	81.4	Confident	74.2	Confident	92.5 Å²	92.5	28.4 Å²	28.4	50%	0.495	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	24	-178.1	-64	-34	0	0	0	114.2	F2591 K2592	F2591-N2607 WeakPolarHBondContact CA-OD1 3.45Å; K2592-N2607 PolarHBondContact N-OD1 3.16Å; K2592-N2607 PolarHBondContact O-N 3.01Å
2608	G	66.9	Low	74.2	Confident	30.5 Å²	30.5	30.3 Å²	30.3	31%	0.314	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.6	1.2	-177.1	0	0	0	0	0	115.3	I2606 P2650	I2606-G2608 PolarHBondContact O-N 3.36Å; G2608-P2650 WeakPolarHBondContact O-CB 3.4Å
2609	Q	70.9	Confident	74.5	Confident	103.5 Å²	103.5	28.7 Å²	28.7	48%	0.484	16%	0.158	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	132.9	168.2	-63.8	-167.5	9.9	0	0	110.6	Q2583 L2605 I2606 I2611	Q2583-Q2609 HydrophobicContact CG-CB 4.36Å; Q2583-Q2609 VanDerWaalsContact NE2-CD 3.26Å; L2605-Q2609 CarbonylContact C-O 3.44Å; L2605-Q2609 WeakPolarHBondContact CA-O 3.36Å; L2605-Q2609 WeakPolarHBondContact CB-O 3.43Å; I2606-Q2609 PolarHBondContact N-O 3.41Å; I2606-Q2609 PolarHBondContact O-N 3.24Å; Q2609-I2611 PolarHBondContact O-N 2.83Å
2610	V	78	Confident	74.5	Confident	43 Å²	43	29.9 Å²	29.9	26%	0.261	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	129.4	172.8	170.6	0	0	0	0	110.2	Q2603 L2605 S2612 P2650 I2672	Q2603-V2610 HydrophobicContact CG-CG1 3.95Å; Q2603-V2610 HydrophobicContact CG-CG2 3.94Å; Q2603-V2610 VanDerWaalsContact OE1-CG2 3.24Å; L2605-V2610 HydrophobicContact CD1-CG2 4.45Å; L2605-V2610 HydrophobicContact CD2-CG2 3.77Å; L2605-V2610 HydrophobicContact CG-CB 4.45Å; L2605-V2610 HydrophobicContact CG-CG2 3.81Å; V2610-S2612 WeakPolarHBondContact CG1-O 3.37Å; V2610-P2650 HydrophobicContact CB-CG 4.09Å; V2610-P2650 HydrophobicContact CG2-CG 3.52Å; V2610-I2672 HydrophobicContact CG2-CG2 3.6Å
2611	I	83.7	Confident	74.7	Confident	19.5 Å²	19.5	28.9 Å²	28.9	10%	0.1	16%	0.159	C	C	.	.			trans	-112.9	-22.3	175.6	60.2	148.3	0	0	0	113.4	W2563 F2579 Q2583 I2604 I2606 Q2609	W2563-I2611 HydrophobicContact CD2-CD1 4.01Å; W2563-I2611 HydrophobicContact CE3-CD1 4.47Å; W2563-I2611 HydrophobicContact CG-CD1 4.43Å; W2563-I2611 HydrophobicContact CH2-CD1 4.12Å; W2563-I2611 HydrophobicContact CZ2-CD1 3.47Å; F2579-I2611 WeakPolarHBondContact CD2-O 3.29Å; F2579-I2611 HydrophobicContact CE2-CD1 4.25Å; F2579-I2611 HydrophobicContact CE2-CG1 4.44Å; F2579-I2611 VanDerWaalsContact CE2-O 3.27Å; F2579-I2611 WeakPolarHBondContact CE2-O 3.28Å; Q2583-I2611 HydrophobicContact CB-CG2 3.75Å; Q2583-I2611 HydrophobicContact CG-CG2 4.14Å; I2604-I2611 HydrophobicContact CB-CD1 4.32Å; I2604-I2611 HydrophobicContact CB-CG1 4.03Å; I2604-I2611 HydrophobicContact CG2-CD1 3.83Å; I2604-I2611 HydrophobicContact CG2-CG1 3.91Å; I2604-I2611 VanDerWaalsContact O-CG1 3.29Å; I2604-I2611 WeakPolarHBondContact O-CG1 3.36Å; I2604-I2611 PolarHBondContact O-N 2.81Å; I2606-I2611 HydrophobicContact CB-CG2 4.05Å; I2606-I2611 HydrophobicContact CD1-CD1 3.68Å; I2606-I2611 HydrophobicContact CD1-CG1 4.44Å; I2606-I2611 HydrophobicContact CD1-CG2 4.24Å; I2606-I2611 HydrophobicContact CG1-CD1 3.9Å; I2606-I2611 HydrophobicContact CG1-CG1 4.24Å; I2606-I2611 HydrophobicContact CG1-CG2 4.15Å; Q2609-I2611 PolarHBondContact O-N 2.83Å
2612	S	81.6	Confident	74.7	Confident	5.5 Å²	5.5	28.5 Å²	28.5	4%	0.038	16%	0.157	C	C	.	.	S	Bend	trans	-110.7	154.9	-179.2	80.2	0	0	0	0	112.1	Q2603 I2604 V2610	Q2603-S2612 PolarHBondContact NE2-O 3.39Å; Q2603-S2612 VanDerWaalsContact NE2-O 3.09Å; I2604-S2612 PolarHBondContact N-OG 3.18Å; I2604-S2612 PolarHBondContact O-N 3.27Å; V2610-S2612 WeakPolarHBondContact CG1-O 3.37Å
2613	P	74	Confident	74.4	Confident	40 Å²	40	31.8 Å²	31.8	26%	0.26	17%	0.172	S	C	.	.			trans	-61.7	173.3	153.9	32.8	-37	0	0	0	110.4	L2577 F2579 C2615 K2676	L2577-P2613 HydrophobicContact CD1-CG 4.41Å; L2577-P2613 HydrophobicContact CD2-CB 4.43Å; L2577-P2613 HydrophobicContact CD2-CG 3.48Å; L2577-P2613 VanDerWaalsContact CD2-CG 3.44Å; L2577-P2613 HydrophobicContact CG-CG 4.41Å; F2579-P2613 HydrophobicContact CD1-CG 4.3Å; P2613-C2615 PolarHBondContact O-N 3.26Å; P2613-C2615 VanDerWaalsContact O-N 3.11Å; P2613-C2615 PolarHBondContact O-SG 3.18Å; P2613-K2676 HydrophobicContact CB-CD 3.88Å
2614	K	68.5	Low	74.1	Confident	57.5 Å²	57.5	33.3 Å²	33.3	25%	0.25	18%	0.179	C	C	.	.			trans	-63.8	122.3	163.2	-79.3	-171	167.7	-165.2	0	108.7	D2598 T2601 Q2603 E2648 E2678	D2598-K2614 IonicContact OD2-NZ 3.22Å; D2598-K2614 PolarHBondContact OD2-NZ 3.17Å; T2601-K2614 HydrophobicContact CG2-CB 4.26Å; T2601-K2614 HydrophobicContact CG2-CD 4.48Å; Q2603-K2614 HydrophobicContact CB-CG 4.36Å; K2614-E2648 WeakPolarHBondContact CE-OE2 3.19Å; K2614-E2648 IonicContact NZ-OE2 2.76Å; K2614-E2678 HydrophobicContact CB-CG 4.39Å; K2614-E2678 WeakPolarHBondContact CB-OE2 3.32Å; K2614-E2678 HydrophobicContact CD-CB 4.29Å
2615	C	74	Confident	73.9	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	136.5	-176.6	-57.4	0	0	0	0	108.6	W2552 I2565 T2601 A2602 P2613	W2552-C2615 HydrophobicContact CZ2-CB 3.87Å; I2565-C2615 HydrophobicContact CG1-CB 4.35Å; I2565-C2615 HydrophobicContact CG2-CB 4.25Å; T2601-C2615 CarbonylContact C-O 3.57Å; T2601-C2615 VanDerWaalsContact CA-O 3.26Å; T2601-C2615 WeakPolarHBondContact CA-O 3.32Å; T2601-C2615 WeakPolarHBondContact CB-O 3.32Å; A2602-C2615 PolarHBondContact N-O 3Å; A2602-C2615 VanDerWaalsContact O-CB 3.29Å; A2602-C2615 WeakPolarHBondContact O-CB 3.48Å; A2602-C2615 PolarHBondContact O-N 3.02Å; P2613-C2615 PolarHBondContact O-N 3.26Å; P2613-C2615 VanDerWaalsContact O-N 3.11Å; P2613-C2615 PolarHBondContact O-SG 3.18Å
2616	P	68.1	Low	73.8	Confident	36.5 Å²	36.5	35.4 Å²	35.4	24%	0.237	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	140.1	-176.7	27.6	-34.5	0	0	0	112.4	W2552 T2801	W2552-P2616 VanDerWaalsContact CD1-O 3.25Å; W2552-P2616 PolarHBondContact NE1-O 3.11Å; W2552-P2616 VanDerWaalsContact NE1-O 3.11Å; P2616-T2801 HydrophobicContact CB-CG2 4.2Å; P2616-T2801 HydrophobicContact CG-CG2 4.3Å
2617	L	71.1	Confident	74	Confident	3.5 Å²	3.5	35.9 Å²	35.9	2%	0.018	19%	0.194	C	C	.	.			trans	-113.8	154	165.7	-62.1	173.6	0	0	0	109.3	L2546 W2552 I2597 Y2600 A2602	L2546-L2617 HydrophobicContact CD1-CB 4.05Å; L2546-L2617 HydrophobicContact CD1-CD2 4.16Å; L2546-L2617 HydrophobicContact CD2-CD1 4.29Å; L2546-L2617 HydrophobicContact CD2-CD2 4.31Å; W2552-L2617 HydrophobicContact CB-CD2 3.96Å; W2552-L2617 VanDerWaalsContact CD1-CD2 3.46Å; W2552-L2617 HydrophobicContact CD2-CD2 3.82Å; W2552-L2617 HydrophobicContact CG-CD2 3.51Å; W2552-L2617 VanDerWaalsContact CG-CD2 3.43Å; I2597-L2617 HydrophobicContact CB-CD1 4.35Å; I2597-L2617 HydrophobicContact CG1-CD1 4.12Å; I2597-L2617 HydrophobicContact CG2-CD1 3.78Å; Y2600-L2617 PolarHBondContact O-N 3.02Å; A2602-L2617 HydrophobicContact CB-CD1 4.07Å; A2602-L2617 HydrophobicContact CB-CD2 4.09Å; A2602-L2617 HydrophobicContact CB-CG 4.12Å
2618	L	70	Confident	74.3	Confident	46 Å²	46	33.1 Å²	33.1	24%	0.241	18%	0.182	C	C	.	.	S	Bend	trans	-95.5	-42.9	-179.3	-63.5	176.7	0	0	0	112.5	T2550 V2569 R2797	T2550-L2618 HydrophobicContact CG2-CB 4.32Å; T2550-L2618 HydrophobicContact CG2-CD1 4.34Å; V2569-L2618 HydrophobicContact CG2-CD1 3.55Å; V2569-L2618 VanDerWaalsContact CG2-CD1 3.49Å; L2618-R2797 PolarHBondContact O-NH1 2.94Å
2619	G	65.4	Low	75.4	Confident	3 Å²	3	33.9 Å²	33.9	3%	0.031	19%	0.19	C	C	.	.	S	Bend	trans	-79.9	173.4	169.3	0	0	0	0	0	114.5	D2547 D2548 Y2600	D2547-G2619 VanDerWaalsContact OD1-C 3.27Å; D2547-G2619 VanDerWaalsContact OD1-CA 3.22Å; D2547-G2619 WeakPolarHBondContact OD1-CA 3.43Å; D2548-G2619 PolarHBondContact OD2-N 3.01Å; Y2600-G2619 WeakPolarHBondContact CD1-O 3.28Å
2620	E	57.9	Low	76.4	Confident	81 Å²	81	31.2 Å²	31.2	38%	0.379	18%	0.179	S	C	.	.	S	Bend	trans	-86	-28.5	-178.7	-69.8	175.5	-164.3	0	0	112.4	K2520 D2547 Y2600	K2520-E2620 IonicContact NZ-OE1 2.71Å; K2520-E2620 PolarHBondContact NZ-OE1 2.87Å; K2520-E2620 VanDerWaalsContact NZ-OE1 3.11Å; K2520-E2620 IonicContact NZ-OE2 2.77Å; K2520-E2620 PolarHBondContact NZ-OE2 3.4Å; D2547-E2620 PolarHBondContact OD1-N 2.83Å; Y2600-E2620 HydrophobicContact CD1-CG 4.33Å; Y2600-E2620 HydrophobicContact CE1-CB 4.38Å; Y2600-E2620 HydrophobicContact CE1-CG 3.36Å; Y2600-E2620 VanDerWaalsContact CE1-CG 3.42Å; Y2600-E2620 WeakPolarHBondContact OH-CG 3.41Å; Y2600-E2620 PolarHBondContact OH-OE1 2.94Å; Y2600-E2620 VanDerWaalsContact OH-OE1 3.13Å
2621	S	64.4	Low	76.9	Confident	7.5 Å²	7.5	29.5 Å²	29.5	5%	0.052	17%	0.169	C	C	.	.	S	Bend	trans	-154.8	161.7	179.4	65	0	0	0	0	114.1	D2523 L2546 D2547	D2523-S2621 VanDerWaalsContact CB-CB 3.48Å; D2523-S2621 WeakPolarHBondContact OD1-CB 3.45Å; D2523-S2621 PolarHBondContact OD1-OG 2.98Å; L2546-S2621 CarbonylContact C-O 3.54Å; L2546-S2621 VanDerWaalsContact CA-O 3.26Å; L2546-S2621 WeakPolarHBondContact CA-O 3.42Å; L2546-S2621 WeakPolarHBondContact CD2-O 3.33Å; D2547-S2621 PolarHBondContact N-O 2.86Å; D2547-S2621 PolarHBondContact OD1-N 3.01Å
2622	A	71.6	Confident	76.9	Confident	1.5 Å²	1.5	31.2 Å²	31.2	1%	0.012	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	133	173.2	0	0	0	0	0	112.4	M2524 Q2525 I2527 I2544 L2546 I2597 Y2640	M2524-A2622 HydrophobicContact CB-CB 4.16Å; M2524-A2622 VanDerWaalsContact CG-O 3.27Å; M2524-A2622 WeakPolarHBondContact CG-O 3.49Å; M2524-A2622 HydrophobicContact SD-CB 4.12Å; Q2525-A2622 PolarHBondContact NE2-O 2.88Å; I2527-A2622 HydrophobicContact CD1-CB 4.5Å; I2544-A2622 HydrophobicContact CG2-CB 3.34Å; L2546-A2622 HydrophobicContact CD2-CB 4.27Å; I2597-A2622 HydrophobicContact CD1-CB 3.52Å; I2597-A2622 VanDerWaalsContact CD1-CB 3.49Å; A2622-Y2640 PolarHBondContact O-OH 2.88Å
2623	K	72.4	Confident	76.8	Confident	70.5 Å²	70.5	31.9 Å²	31.9	31%	0.307	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	-31	176	-126.9	175.3	179.3	162.2	0	112.6	L2521 M2524 K2545 D2547 E2549	L2521-K2623 HydrophobicContact CD1-CG 4.49Å; M2524-K2623 WeakPolarHBondContact CE-O 3.36Å; K2545-K2623 WeakPolarHBondContact O-CB 3.17Å; K2545-K2623 PolarHBondContact O-N 3.04Å; D2547-K2623 WeakPolarHBondContact O-CE 3.31Å; D2547-K2623 PolarHBondContact O-NZ 3.41Å; E2549-K2623 IonicContact OE1-NZ 3.52Å; E2549-K2623 PolarHBondContact OE1-NZ 3Å
2624	Q	77.5	Confident	76.7	Confident	51 Å²	51	35.8 Å²	35.8	24%	0.238	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	148.6	-178.7	-169.1	178.4	1.7	0	0	109.9	Y2471 L2502 I2544 K2545	Y2471-Q2624 PolarHBondContact OH-NE2 3.1Å; Y2471-Q2624 VanDerWaalsContact OH-NE2 3.13Å; L2502-Q2624 HydrophobicContact CD2-CG 3.96Å; I2544-Q2624 CarbonylContact C-O 3.4Å; I2544-Q2624 WeakPolarHBondContact CA-O 3.36Å; K2545-Q2624 HydrophobicContact CB-CB 4.15Å; K2545-Q2624 PolarHBondContact N-O 3.08Å; K2545-Q2624 PolarHBondContact O-N 3.09Å
2625	V	83.3	Confident	76.6	Confident	5 Å²	5	33.9 Å²	33.9	3%	0.03	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	137.3	170.4	122.2	0	0	0	0	109.5	Q2478 I2527 V2542 H2543 I2544 I2636 T2638	Q2478-V2625 PolarHBondContact N-O 3.15Å; I2527-V2625 HydrophobicContact CD1-CB 3.83Å; I2527-V2625 HydrophobicContact CD1-CG1 4.22Å; I2527-V2625 HydrophobicContact CD1-CG2 3.7Å; I2527-V2625 VanDerWaalsContact CD1-CG2 3.45Å; I2527-V2625 HydrophobicContact CG1-CB 4.26Å; I2527-V2625 HydrophobicContact CG1-CG1 4.01Å; I2527-V2625 HydrophobicContact CG1-CG2 3.86Å; I2527-V2625 HydrophobicContact CG2-CB 4.41Å; I2527-V2625 HydrophobicContact CG2-CG1 4.01Å; I2527-V2625 HydrophobicContact CG2-CG2 4.19Å; V2542-V2625 HydrophobicContact CG1-CG1 4.09Å; V2542-V2625 HydrophobicContact CG1-CG2 3.84Å; H2543-V2625 CarbonylContact O-C 3.58Å; H2543-V2625 VanDerWaalsContact O-CA 3.3Å; H2543-V2625 WeakPolarHBondContact O-CA 3.4Å; H2543-V2625 WeakPolarHBondContact O-CG2 3.47Å; I2544-V2625 HydrophobicContact CG1-CG2 4.24Å; V2625-I2636 HydrophobicContact CB-CG2 4.46Å; V2625-I2636 HydrophobicContact CG1-CG2 4.23Å; V2625-T2638 HydrophobicContact CG1-CG2 4.11Å
2626	T	84	Confident	76.3	Confident	45.5 Å²	45.5	35.1 Å²	35.1	28%	0.279	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	149	168.6	8.1	0	0	0	0	109.6	Y2471 F2476 H2543	Y2471-T2626 HydrophobicContact CD2-CG2 4.39Å; Y2471-T2626 HydrophobicContact CE2-CG2 3.75Å; F2476-T2626 CarbonylContact O-C 3.54Å; F2476-T2626 VanDerWaalsContact O-CA 3.26Å; F2476-T2626 WeakPolarHBondContact O-CA 3.24Å; H2543-T2626 PolarHBondContact N-O 2.95Å; H2543-T2626 PolarHBondContact O-N 3.11Å
2627	I	89.2	Confident	76	Confident	10 Å²	10	37.8 Å²	37.8	5%	0.051	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	131.2	174.2	-53.2	179.9	0	0	0	107.4	S2475 F2476 A2529 V2531 F2540 A2541 V2542 L2593 V2631 V2633 I2636	S2475-I2627 WeakPolarHBondContact CA-O 3.32Å; S2475-I2627 WeakPolarHBondContact CB-O 3.5Å; F2476-I2627 PolarHBondContact N-O 2.83Å; F2476-I2627 PolarHBondContact O-N 2.93Å; A2529-I2627 HydrophobicContact CB-CD1 3.57Å; A2529-I2627 VanDerWaalsContact CB-CD1 3.45Å; V2531-I2627 HydrophobicContact CG2-CD1 4.19Å; F2540-I2627 HydrophobicContact CD2-CG2 4.26Å; A2541-I2627 CarbonylContact O-C 3.54Å; A2541-I2627 VanDerWaalsContact O-CA 3.31Å; A2541-I2627 WeakPolarHBondContact O-CA 3.43Å; A2541-I2627 WeakPolarHBondContact O-CG2 3.23Å; V2542-I2627 HydrophobicContact CG1-CG1 4.18Å; V2542-I2627 HydrophobicContact CG2-CD1 4.39Å; V2542-I2627 HydrophobicContact CG2-CG1 4.25Å; V2542-I2627 HydrophobicContact CG2-CG2 4.41Å; L2593-I2627 HydrophobicContact CD2-CD1 3.94Å; I2627-V2631 HydrophobicContact CG2-CG2 4.04Å; I2627-V2633 HydrophobicContact CB-CG2 4.04Å; I2627-V2633 HydrophobicContact CD1-CG1 4.28Å; I2627-V2633 HydrophobicContact CG2-CG2 3.96Å; I2627-I2636 HydrophobicContact CD1-CD1 4.09Å; I2627-I2636 HydrophobicContact CD1-CG1 4.29Å; I2627-I2636 HydrophobicContact CG1-CD1 4.11Å
2628	S	88.6	Confident	75.3	Confident	34.5 Å²	34.5	38.8 Å²	38.8	24%	0.241	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	166.3	-168.3	57.4	0	0	0	0	111.7	F2540 A2541 H2543	F2540-S2628 CarbonylContact C-O 3.57Å; F2540-S2628 VanDerWaalsContact CA-O 3.31Å; F2540-S2628 WeakPolarHBondContact CA-O 3.35Å; F2540-S2628 VanDerWaalsContact CB-O 3.32Å; F2540-S2628 WeakPolarHBondContact CB-O 3.3Å; A2541-S2628 PolarHBondContact N-O 3.1Å; A2541-S2628 PolarHBondContact O-N 2.83Å; A2541-S2628 PolarHBondContact O-OG 2.65Å; H2543-S2628 PolarHBondContact NE2-OG 2.88Å
2629	G	89.4	Confident	74.5	Confident	47 Å²	47	38.2 Å²	38.2	49%	0.485	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	88.5	-153.7	-169.1	0	0	0	0	0	111.9	V2631	G2629-V2631 VanDerWaalsContact C-N 3.27Å; G2629-V2631 WeakPolarHBondContact O-CG2 3.4Å; G2629-V2631 PolarHBondContact O-N 2.92Å
2630	D	91	Very high	73.7	Confident	47.5 Å²	47.5	41.3 Å²	41.3	25%	0.254	21%	0.214	S	C	.	.	S	Bend	trans	-83.7	59.4	-156.8	-45	-25.9	0	0	0	112.9	E2534 A2537 E2538 S2539	E2534-D2630 HydrophobicContact CB-CB 4.46Å; E2534-D2630 PolarHBondContact N-O 3.12Å; A2537-D2630 HydrophobicContact CB-CB 3.54Å; A2537-D2630 WeakPolarHBondContact CB-O 3.43Å; E2538-D2630 PolarHBondContact N-OD2 2.81Å; S2539-D2630 PolarHBondContact N-OD2 2.7Å; S2539-D2630 WeakPolarHBondContact O-CB 3.33Å; S2539-D2630 PolarHBondContact O-N 2.82Å; S2539-D2630 VanDerWaalsContact O-OD2 3.1Å
2631	V	89.8	Confident	72.7	Confident	7 Å²	7	40 Å²	40	4%	0.042	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	132	-166.7	-76.2	0	0	0	0	116.3	F2476 V2531 R2532 L2533 F2540 I2627 G2629 V2633	F2476-V2631 WeakPolarHBondContact CE2-O 3.21Å; V2531-V2631 HydrophobicContact CG1-CB 3.83Å; V2531-V2631 HydrophobicContact CG1-CG1 3.46Å; V2531-V2631 VanDerWaalsContact CG1-CG1 3.46Å; R2532-V2631 CarbonylContact O-C 3.57Å; R2532-V2631 VanDerWaalsContact O-CA 3.25Å; R2532-V2631 WeakPolarHBondContact O-CA 3.4Å; L2533-V2631 HydrophobicContact CD2-CG1 3.84Å; F2540-V2631 HydrophobicContact CB-CG1 3.77Å; F2540-V2631 HydrophobicContact CB-CG2 4.16Å; F2540-V2631 HydrophobicContact CD1-CG1 3.97Å; F2540-V2631 HydrophobicContact CD2-CG1 4.4Å; F2540-V2631 HydrophobicContact CG-CG1 3.85Å; I2627-V2631 HydrophobicContact CG2-CG2 4.04Å; G2629-V2631 VanDerWaalsContact C-N 3.27Å; G2629-V2631 WeakPolarHBondContact O-CG2 3.4Å; G2629-V2631 PolarHBondContact O-N 2.92Å; V2631-V2633 HydrophobicContact CB-CG2 4.18Å; V2631-V2633 HydrophobicContact CG2-CG2 3.93Å; V2631-V2633 PolarHBondContact O-N 2.79Å
2632	D	84	Confident	71.2	Confident	54.5 Å²	54.5	42.3 Å²	42.3	29%	0.291	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	102.6	160.7	156.3	36.5	0	0	0	109.1	R2532 R2634	R2532-D2632 HydrophobicContact CB-CB 3.95Å; R2532-D2632 WeakPolarHBondContact CB-O 3.29Å; R2532-D2632 VanDerWaalsContact CD-OD2 3.31Å; R2532-D2632 WeakPolarHBondContact CD-OD2 3.39Å; R2532-D2632 HydrophobicContact CG-CB 4.45Å; R2532-D2632 PolarHBondContact N-O 3.16Å; R2532-D2632 IonicContact NH1-OD2 2.7Å; R2532-D2632 PolarHBondContact O-N 3.01Å; D2632-R2634 PolarHBondContact O-N 2.88Å; D2632-R2634 WeakPolarHBondContact OD1-CG 3.48Å; D2632-R2634 IonicContact OD2-CZ 3.28Å; D2632-R2634 IonicContact OD2-NE 3.28Å; D2632-R2634 PolarHBondContact OD2-NE 2.86Å; D2632-R2634 IonicContact OD2-NH2 3.17Å; D2632-R2634 PolarHBondContact OD2-NH2 3.06Å
2633	V	78	Confident	69.3	Low	21 Å²	21	47.5 Å²	47.5	13%	0.127	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	99.2	-179.6	-173.1	0	0	0	0	110.4	P2468 F2476 V2531 I2627 V2631 A2635 I2636	P2468-V2633 WeakPolarHBondContact CG-O 3.33Å; F2476-V2633 HydrophobicContact CB-CB 3.67Å; F2476-V2633 HydrophobicContact CB-CG1 4.29Å; F2476-V2633 HydrophobicContact CB-CG2 3.91Å; F2476-V2633 HydrophobicContact CD1-CB 3.94Å; F2476-V2633 HydrophobicContact CD2-CB 4.05Å; F2476-V2633 HydrophobicContact CD2-CG2 3.84Å; F2476-V2633 HydrophobicContact CG-CB 3.62Å; F2476-V2633 HydrophobicContact CG-CG2 3.89Å; V2531-V2633 HydrophobicContact CG2-CG1 4.47Å; V2531-V2633 HydrophobicContact CG2-CG2 4.48Å; I2627-V2633 HydrophobicContact CB-CG2 4.04Å; I2627-V2633 HydrophobicContact CD1-CG1 4.28Å; I2627-V2633 HydrophobicContact CG2-CG2 3.96Å; V2631-V2633 HydrophobicContact CB-CG2 4.18Å; V2631-V2633 HydrophobicContact CG2-CG2 3.93Å; V2631-V2633 PolarHBondContact O-N 2.79Å; V2633-A2635 VanDerWaalsContact C-N 3.35Å; V2633-A2635 PolarHBondContact O-N 3.25Å; V2633-I2636 HydrophobicContact CG1-CD1 4Å; V2633-I2636 HydrophobicContact CG1-CG1 3.59Å
2634	R	71.7	Confident	67.2	Low	122 Å²	122	48.4 Å²	48.4	46%	0.46	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	-25.1	-172.7	-63.2	178.2	172.1	-161.4	-13.2	114.5	S2494 T2530 T2590 D2632	S2494-R2634 WeakPolarHBondContact CB-O 3.48Å; T2530-R2634 HydrophobicContact CG2-CB 4.4Å; T2530-R2634 PolarHBondContact O-N 2.89Å; T2590-R2634 PolarHBondContact OG1-NH1 2.88Å; D2632-R2634 PolarHBondContact O-N 2.88Å; D2632-R2634 WeakPolarHBondContact OD1-CG 3.48Å; D2632-R2634 IonicContact OD2-CZ 3.28Å; D2632-R2634 IonicContact OD2-NE 3.28Å; D2632-R2634 PolarHBondContact OD2-NE 2.86Å; D2632-R2634 IonicContact OD2-NH2 3.17Å; D2632-R2634 PolarHBondContact OD2-NH2 3.06Å
2635	A	67.4	Low	64.9	Low	17 Å²	17	50.4 Å²	50.4	14%	0.14	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	144.3	174.3	0	0	0	0	0	110.6	A2529 T2530 V2633	A2529-A2635 CarbonylContact C-O 3.52Å; A2529-A2635 VanDerWaalsContact CA-O 3.22Å; A2529-A2635 WeakPolarHBondContact CA-O 3.32Å; T2530-A2635 PolarHBondContact N-O 2.93Å; T2530-A2635 PolarHBondContact O-N 2.84Å; V2633-A2635 VanDerWaalsContact C-N 3.35Å; V2633-A2635 PolarHBondContact O-N 3.25Å
2636	I	68.7	Low	62.4	Low	26 Å²	26	52.2 Å²	52.2	13%	0.133	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	126.8	162.8	-54.9	177.6	0	0	0	107.5	S2465 P2468 F2476 Q2478 P2493 I2527 A2529 V2625 I2627 V2633	S2465-I2636 VanDerWaalsContact CB-O 3.3Å; S2465-I2636 WeakPolarHBondContact CB-O 3.38Å; P2468-I2636 HydrophobicContact CB-CD1 4.18Å; P2468-I2636 HydrophobicContact CB-CG1 4.17Å; F2476-I2636 HydrophobicContact CB-CD1 4.44Å; F2476-I2636 VanDerWaalsContact O-CD1 3.28Å; F2476-I2636 WeakPolarHBondContact O-CD1 3.49Å; Q2478-I2636 HydrophobicContact CB-CB 4.48Å; Q2478-I2636 HydrophobicContact CB-CG2 4.06Å; Q2478-I2636 HydrophobicContact CG-CG2 4.47Å; P2493-I2636 WeakPolarHBondContact CG-O 3.38Å; I2527-I2636 HydrophobicContact CG2-CG2 4.07Å; A2529-I2636 HydrophobicContact CB-CG1 4.27Å; V2625-I2636 HydrophobicContact CB-CG2 4.46Å; V2625-I2636 HydrophobicContact CG1-CG2 4.23Å; I2627-I2636 HydrophobicContact CD1-CD1 4.09Å; I2627-I2636 HydrophobicContact CD1-CG1 4.29Å; I2627-I2636 HydrophobicContact CG1-CD1 4.11Å; V2633-I2636 HydrophobicContact CG1-CD1 4Å; V2633-I2636 HydrophobicContact CG1-CG1 3.59Å
2637	R	60.1	Low	59.8	Low	92 Å²	92	53.5 Å²	53.5	35%	0.347	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	131.2	176.2	-60.3	-178.6	-177.6	-176	-2.1	109.5	H2419 N2464 S2492 I2527 H2528	H2419-R2637 PolarHBondContact NE2-NH1 2.82Å; N2464-R2637 WeakPolarHBondContact OD1-CD 3.31Å; N2464-R2637 PolarHBondContact OD1-NE 2.91Å; S2492-R2637 PolarHBondContact OG-NH2 2.9Å; I2527-R2637 CarbonylContact C-O 3.55Å; I2527-R2637 WeakPolarHBondContact CA-O 3.26Å; H2528-R2637 HydrophobicContact CB-CB 4.41Å; H2528-R2637 PolarHBondContact N-O 2.89Å; H2528-R2637 PolarHBondContact O-N 2.85Å
2638	T	57.9	Low	57.1	Low	25 Å²	25	56.5 Å²	56.5	15%	0.153	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	117.8	177.3	-7.3	0	0	0	0	109.6	Q2478 I2481 M2524 Q2525 S2526 I2527 V2625 Y2640	Q2478-T2638 PolarHBondContact OE1-OG1 2.96Å; I2481-T2638 HydrophobicContact CD1-CG2 4.12Å; M2524-T2638 HydrophobicContact CE-CG2 3.88Å; M2524-T2638 HydrophobicContact CG-CG2 4.44Å; M2524-T2638 HydrophobicContact SD-CG2 3.73Å; Q2525-T2638 HydrophobicContact CG-CG2 3.93Å; S2526-T2638 CarbonylContact O-C 3.57Å; S2526-T2638 WeakPolarHBondContact O-CA 3.12Å; I2527-T2638 HydrophobicContact CG1-CG2 4.39Å; V2625-T2638 HydrophobicContact CG1-CG2 4.11Å; T2638-Y2640 HydrophobicContact CG2-CD2 4.26Å; T2638-Y2640 HydrophobicContact CG2-CE2 3.55Å; T2638-Y2640 WeakPolarHBondContact O-CD2 3.2Å; T2638-Y2640 WeakPolarHBondContact OG1-CE2 3.46Å; T2638-Y2640 PolarHBondContact OG1-OH 2.89Å
2639	V	52.2	Low	54.2	Low	34.5 Å²	34.5	59 Å²	59	21%	0.209	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	127.7	176.4	-176.2	0	0	0	0	107.8	V2460 W2462 Q2525 S2526 W2641	V2460-V2639 HydrophobicContact CG1-CG1 3.92Å; W2462-V2639 VanDerWaalsContact CD1-CG2 3.43Å; W2462-V2639 HydrophobicContact CG-CG2 4.14Å; Q2525-V2639 CarbonylContact C-O 3.58Å; Q2525-V2639 VanDerWaalsContact CA-O 3.3Å; Q2525-V2639 WeakPolarHBondContact CA-O 3.2Å; Q2525-V2639 PolarHBondContact N-O 2.75Å; S2526-V2639 PolarHBondContact N-O 2.76Å; S2526-V2639 PolarHBondContact O-N 3.03Å; S2526-V2639 WeakPolarHBondContact OG-CB 3.03Å; V2639-W2641 HydrophobicContact CG1-CZ2 4.32Å
2640	Y	47.9	Very low	51.4	Low	67.5 Å²	67.5	59.8 Å²	59.8	27%	0.265	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	146.5	178.2	-67.2	-91.6	0	0	0	110.8	I2481 L2486 R2522 D2523 M2524 Q2525 A2622 T2638 N2642	I2481-Y2640 HydrophobicContact CD1-CE2 4.02Å; L2486-Y2640 HydrophobicContact CD1-CE1 4.13Å; L2486-Y2640 HydrophobicContact CD1-CE2 4.14Å; L2486-Y2640 HydrophobicContact CD2-CD2 3.59Å; L2486-Y2640 HydrophobicContact CD2-CE2 3.23Å; L2486-Y2640 HydrophobicContact CD2-CG 4.41Å; L2486-Y2640 HydrophobicContact CG-CE2 4.27Å; R2522-Y2640 HydrophobicContact CB-CD1 3.98Å; R2522-Y2640 HydrophobicContact CB-CG 4.27Å; R2522-Y2640 VanDerWaalsContact O-CD1 3.31Å; R2522-Y2640 WeakPolarHBondContact O-CD1 3.22Å; D2523-Y2640 CarbonylContact O-C 3.5Å; D2523-Y2640 WeakPolarHBondContact O-CA 3.38Å; M2524-Y2640 HydrophobicContact CE-CE1 3.85Å; M2524-Y2640 WeakPolarHBondContact CE-OH 3.37Å; M2524-Y2640 HydrophobicContact CG-CD1 3.85Å; M2524-Y2640 HydrophobicContact CG-CE1 3.5Å; M2524-Y2640 VanDerWaalsContact CG-CE1 3.5Å; Q2525-Y2640 HydrophobicContact CB-CD1 4.05Å; Q2525-Y2640 HydrophobicContact CB-CE1 4.32Å; Q2525-Y2640 HydrophobicContact CG-CD1 3.89Å; Q2525-Y2640 HydrophobicContact CG-CE1 3.81Å; Q2525-Y2640 HydrophobicContact CG-CE2 4.49Å; Q2525-Y2640 HydrophobicContact CG-CG 4.3Å; Q2525-Y2640 VanDerWaalsContact NE2-CE1 3.34Å; Q2525-Y2640 PolarHBondContact NE2-OH 2.71Å; A2622-Y2640 PolarHBondContact O-OH 2.88Å; T2638-Y2640 HydrophobicContact CG2-CD2 4.26Å; T2638-Y2640 HydrophobicContact CG2-CE2 3.55Å; T2638-Y2640 WeakPolarHBondContact O-CD2 3.2Å; T2638-Y2640 WeakPolarHBondContact OG1-CE2 3.46Å; T2638-Y2640 PolarHBondContact OG1-OH 2.89Å; Y2640-N2642 VanDerWaalsContact C-N 3.34Å; Y2640-N2642 PolarHBondContact O-N 2.86Å
2641	W	37.4	Very low	48.4	Very low	52.5 Å²	52.5	62.6 Å²	62.6	20%	0.199	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	95.6	178.5	-64.7	83.5	0	0	0	110	M2346 V2460 D2523 M2524 Q2525 S2526 V2639 T2645	M2346-W2641 HydrophobicContact CE-CH2 3.51Å; M2346-W2641 HydrophobicContact CE-CZ3 3.65Å; M2346-W2641 HydrophobicContact SD-CH2 4.27Å; V2460-W2641 HydrophobicContact CG1-CZ3 4.43Å; V2460-W2641 HydrophobicContact CG2-CE3 4.31Å; V2460-W2641 HydrophobicContact CG2-CZ3 3.87Å; D2523-W2641 HydrophobicContact CB-CB 4.16Å; D2523-W2641 VanDerWaalsContact CB-CD1 3.44Å; D2523-W2641 HydrophobicContact CB-CG 3.98Å; D2523-W2641 VanDerWaalsContact O-CD1 3.29Å; D2523-W2641 PolarHBondContact O-N 3.27Å; M2524-W2641 HydrophobicContact CB-CB 4.09Å; M2524-W2641 HydrophobicContact CG-CB 4.37Å; M2524-W2641 HydrophobicContact CG-CG 4.27Å; M2524-W2641 PolarHBondContact N-O 3.08Å; M2524-W2641 PolarHBondContact O-N 2.8Å; Q2525-W2641 HydrophobicContact CB-CD2 4.5Å; Q2525-W2641 HydrophobicContact CB-CG 4.26Å; Q2525-W2641 HydrophobicContact CG-CD2 4.46Å; Q2525-W2641 HydrophobicContact CG-CZ2 4.06Å; S2526-W2641 PolarHBondContact OG-NE1 3.09Å; V2639-W2641 HydrophobicContact CG1-CZ2 4.32Å; W2641-T2645 HydrophobicContact CH2-CG2 3.84Å; W2641-T2645 HydrophobicContact CZ3-CG2 3.49Å; W2641-T2645 VanDerWaalsContact CZ3-CG2 3.49Å
2642	N	34.1	Very low	45.5	Very low	56 Å²	56	69.4 Å²	69.4	30%	0.299	36%	0.363	S	S	.	.			trans	-83.9	142.2	158.1	-68.5	-15.3	0	0	0	109.1	N2489 L2521 R2522 Y2640 L2644	N2489-N2642 PolarHBondContact ND2-O 3.08Å; L2521-N2642 PolarHBondContact O-OD1 2.96Å; R2522-N2642 PolarHBondContact NH1-OD1 2.83Å; Y2640-N2642 VanDerWaalsContact C-N 3.34Å; Y2640-N2642 PolarHBondContact O-N 2.86Å; N2642-L2644 PolarHBondContact O-N 3.15Å; N2642-L2644 VanDerWaalsContact O-N 3.13Å
2643	I	30.4	Very low	42.9	Very low	111.5 Å²	111.5	69.4 Å²	69.4	57%	0.572	37%	0.371	S	S	*	.			trans	-78.3	82.5	170.3	-56.8	-178.8	0	0	0	108.5	T2645 I2665	I2643-T2645 HydrophobicContact CG2-CG2 4.46Å; I2643-T2645 PolarHBondContact O-N 3.06Å; I2643-I2665 HydrophobicContact CD1-CD1 3.76Å; I2643-I2665 HydrophobicContact CD1-CG1 4.18Å
2644	L	28.4	Very low	40.5	Very low	90 Å²	90	74.5 Å²	74.5	47%	0.471	39%	0.391	S	S	.	.			trans	-113.6	89.9	178.2	-70	177	0	0	0	109.1	K2501 N2642 G2646	K2501-L2644 HydrophobicContact CD-CD1 4.28Å; N2642-L2644 PolarHBondContact O-N 3.15Å; N2642-L2644 VanDerWaalsContact O-N 3.13Å; L2644-G2646 PolarHBondContact O-N 2.87Å; L2644-G2646 VanDerWaalsContact O-N 3.07Å
2645	T	30.1	Very low	38.4	Very low	93 Å²	93	71.9 Å²	71.9	57%	0.571	40%	0.402	S	S	*	.			trans	-66	127.4	172.2	46.2	0	0	0	0	111.3	K2501 W2641 I2643	K2501-T2645 PolarHBondContact NZ-O 3.24Å; W2641-T2645 HydrophobicContact CH2-CG2 3.84Å; W2641-T2645 HydrophobicContact CZ3-CG2 3.49Å; W2641-T2645 VanDerWaalsContact CZ3-CG2 3.49Å; I2643-T2645 HydrophobicContact CG2-CG2 4.46Å; I2643-T2645 PolarHBondContact O-N 3.06Å
2646	G	29.3	Very low	36.5	Very low	42 Å²	42	80.6 Å²	80.6	43%	0.433	44%	0.44	S	S	.	.			trans	-67.8	-177.2	179.8	0	0	0	0	0	114.2	Q2525 L2644 E2648	Q2525-G2646 VanDerWaalsContact OE1-CA 3.27Å; L2644-G2646 PolarHBondContact O-N 2.87Å; L2644-G2646 VanDerWaalsContact O-N 3.07Å; G2646-E2648 VanDerWaalsContact C-N 3.28Å; G2646-E2648 PolarHBondContact O-N 2.91Å; G2646-E2648 VanDerWaalsContact O-N 3.14Å
2647	P	31.1	Very low	34.5	Very low	73.5 Å²	73.5	87.6 Å²	87.6	48%	0.477	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	49.3	-139	34.6	-30.3	0	0	0	116.9	I2596	I2596-P2647 WeakPolarHBondContact CD1-O 3.05Å
2648	E	30.9	Very low	32.9	Very low	73.5 Å²	73.5	91.6 Å²	91.6	34%	0.343	50%	0.495	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.4	66.5	174	-68.1	-144.4	141.2	0	0	114.6	V2296 I2596 Q2603 K2614 G2646 P2650 K2718	V2296-E2648 WeakPolarHBondContact CG2-OE2 3Å; I2596-E2648 HydrophobicContact CB-CG 4.05Å; I2596-E2648 HydrophobicContact CD1-CG 3.97Å; I2596-E2648 HydrophobicContact CG2-CG 3.64Å; Q2603-E2648 WeakPolarHBondContact CB-OE1 3.24Å; Q2603-E2648 WeakPolarHBondContact CG-OE1 3.29Å; Q2603-E2648 PolarHBondContact OE1-OE1 2.92Å; Q2603-E2648 PolarHBondContact OE1-OE2 3.1Å; K2614-E2648 WeakPolarHBondContact CE-OE2 3.19Å; K2614-E2648 IonicContact NZ-OE2 2.76Å; G2646-E2648 VanDerWaalsContact C-N 3.28Å; G2646-E2648 PolarHBondContact O-N 2.91Å; G2646-E2648 VanDerWaalsContact O-N 3.14Å; E2648-P2650 WeakPolarHBondContact O-CD 3.3Å; E2648-K2718 PolarHBondContact O-NZ 3.43Å; E2648-K2718 VanDerWaalsContact O-NZ 3.1Å
2649	D	29.3	Very low	31.4	Very low	85.5 Å²	85.5	100.4 Å²	100.4	46%	0.457	53%	0.531	S	S	.	.			trans	-140.4	100.4	153.9	-101.8	-5.5	0	0	0	111.3	L2651 F2654 K2718	D2649-L2651 PolarHBondContact O-N 3.29Å; D2649-F2654 WeakPolarHBondContact OD1-CZ 3.29Å; D2649-K2718 HydrophobicContact CB-CD 4.03Å; D2649-K2718 VanDerWaalsContact CG-CD 3.5Å; D2649-K2718 VanDerWaalsContact CG-NZ 3.32Å; D2649-K2718 WeakPolarHBondContact OD1-CE 3.39Å; D2649-K2718 IonicContact OD1-NZ 2.81Å; D2649-K2718 PolarHBondContact OD1-NZ 3.02Å; D2649-K2718 VanDerWaalsContact OD2-CD 3.32Å; D2649-K2718 WeakPolarHBondContact OD2-CD 3.3Å; D2649-K2718 IonicContact OD2-NZ 2.72Å
2650	P	29.3	Very low	30.3	Very low	63.5 Å²	63.5	103.1 Å²	103.1	41%	0.412	55%	0.551	S	S	.	*			trans	-72.4	126.4	163.9	9	-2.2	0	0	0	109.9	L2605 G2608 V2610 E2648 Q2652	L2605-P2650 HydrophobicContact CD2-CG 4.23Å; G2608-P2650 WeakPolarHBondContact O-CB 3.4Å; V2610-P2650 HydrophobicContact CB-CG 4.09Å; V2610-P2650 HydrophobicContact CG2-CG 3.52Å; E2648-P2650 WeakPolarHBondContact O-CD 3.3Å; P2650-Q2652 VanDerWaalsContact C-N 3.28Å; P2650-Q2652 HydrophobicContact CB-CG 4.42Å; P2650-Q2652 PolarHBondContact O-N 2.88Å
2651	L	29.3	Very low	29.3	Very low	108 Å²	108	105.7 Å²	105.7	57%	0.565	58%	0.576	S	S	*	*			trans	-70.6	69.4	-177.9	-67.1	167.2	0	0	0	113.1	D2649 A2653 L2724 V2799	D2649-L2651 PolarHBondContact O-N 3.29Å; L2651-A2653 PolarHBondContact O-N 2.87Å; L2651-L2724 HydrophobicContact CD2-CD1 3.33Å; L2651-L2724 HydrophobicContact CD2-CD2 3.66Å; L2651-L2724 HydrophobicContact CD2-CG 4.14Å; L2651-V2799 HydrophobicContact CD1-CB 3.79Å; L2651-V2799 HydrophobicContact CD1-CG1 3.81Å; L2651-V2799 HydrophobicContact CD1-CG2 4.1Å
2652	Q	28.2	Very low	29.1	Very low	148 Å²	148	112.8 Å²	112.8	69%	0.692	60%	0.603	S	S	*	*			trans	-104.7	92.5	175.4	-62.3	-169	15.6	0	0	110.6	P2650	P2650-Q2652 VanDerWaalsContact C-N 3.28Å; P2650-Q2652 HydrophobicContact CB-CG 4.42Å; P2650-Q2652 PolarHBondContact O-N 2.88Å
2653	A	28.5	Very low	28.9	Very low	55 Å²	55	113 Å²	113	46%	0.455	61%	0.609	S	S	.	*			trans	147.1	30.4	177	0	0	0	0	0	116.1	L2651 G2655 L2724 Q2726 Y2741	L2651-A2653 PolarHBondContact O-N 2.87Å; A2653-G2655 PolarHBondContact O-N 2.99Å; A2653-L2724 HydrophobicContact CB-CD2 3.96Å; A2653-Q2726 PolarHBondContact O-NE2 2.94Å; A2653-Q2726 PolarHBondContact O-OE1 2.81Å; A2653-Y2741 HydrophobicContact CB-CD1 4.45Å; A2653-Y2741 HydrophobicContact CB-CD2 4.03Å; A2653-Y2741 HydrophobicContact CB-CE1 4.03Å; A2653-Y2741 HydrophobicContact CB-CE2 3.6Å; A2653-Y2741 HydrophobicContact CB-CG 4.45Å; A2653-Y2741 PolarHBondContact O-OH 2.83Å
2654	F	28.9	Very low	29	Very low	129 Å²	129	110.7 Å²	110.7	57%	0.566	60%	0.6	S	S	*	*			trans	-96.2	100.1	162.1	-81.5	-77.7	0	0	0	110.1	D2649 V2728	D2649-F2654 WeakPolarHBondContact OD1-CZ 3.29Å; F2654-V2728 HydrophobicContact CE1-CG1 3.87Å; F2654-V2728 HydrophobicContact CE1-CG2 4.07Å; F2654-V2728 HydrophobicContact CZ-CG1 4.07Å; F2654-V2728 HydrophobicContact CZ-CG2 3.81Å
2655	G	27.2	Very low	29.2	Very low	66.5 Å²	66.5	109.8 Å²	109.8	69%	0.686	60%	0.595	S	S	*	*			trans	-79.5	153	169.9	0	0	0	0	0	111.9	A2653 Q2657	A2653-G2655 PolarHBondContact O-N 2.99Å; G2655-Q2657 PolarHBondContact O-N 2.86Å
2656	Q	26.5	Very low	29.3	Very low	200 Å²	200	109.2 Å²	109.2	94%	0.935	59%	0.585	S	S	*	*	S	Bend	trans	-4	111.8	179.4	-65.6	-174.8	-5.4	0	0	114.8
2657	Q	28.6	Very low	29.7	Very low	173.5 Å²	173.5	111.5 Å²	111.5	81%	0.811	58%	0.584	S	S	*	*			trans	142.7	93.3	164	-66	-163.4	-13.5	0	0	113.8	G2655	G2655-Q2657 PolarHBondContact O-N 2.86Å
2658	Q	26.5	Very low	29.8	Very low	176.5 Å²	176.5	109.3 Å²	109.3	83%	0.825	57%	0.569	S	S	*	*			trans	-49.1	122.1	137.8	-129.7	167.4	10	0	0	113.9	S2660	Q2658-S2660 PolarHBondContact O-N 3.13Å
2659	K	26.5	Very low	30	Very low	209 Å²	209	109.7 Å²	109.7	91%	0.909	57%	0.568	S	S	*	*			trans	-58	127.2	163.3	-65.3	173.7	-179.9	174.7	0	107.8
2660	S	28	Very low	30.2	Very low	91.5 Å²	91.5	106 Å²	106	64%	0.64	55%	0.549	S	S	*	.			trans	-86.1	135.6	170.4	57.6	0	0	0	0	109.7	Q2658 R2662	Q2658-S2660 PolarHBondContact O-N 3.13Å; S2660-R2662 VanDerWaalsContact C-N 3.25Å; S2660-R2662 PolarHBondContact O-N 2.96Å
2661	P	27.6	Very low	30.4	Very low	121 Å²	121	106.9 Å²	106.9	79%	0.786	55%	0.548	S	S	*	.			trans	-68.7	68.1	-166.8	2.8	0.5	0	0	0	112.4	S2663	P2661-S2663 WeakPolarHBondContact O-CA 3.47Å; P2661-S2663 PolarHBondContact O-N 3.41Å
2662	R	31.7	Very low	30.7	Very low	203 Å²	203	103.9 Å²	103.9	77%	0.766	53%	0.532	S	S	*	.			trans	-89.6	52.6	-166.2	-72.1	-174.5	166.4	161.9	-5.6	113.3	S2660 V2664 E2666	S2660-R2662 VanDerWaalsContact C-N 3.25Å; S2660-R2662 PolarHBondContact O-N 2.96Å; R2662-V2664 PolarHBondContact O-N 2.88Å; R2662-E2666 WeakPolarHBondContact CG-OE2 3.24Å; R2662-E2666 IonicContact NE-OE2 3.23Å
2663	S	30.7	Very low	30.8	Very low	59.5 Å²	59.5	100.8 Å²	100.8	42%	0.416	52%	0.519	S	S	.	.			trans	-68.7	136	-171.8	59.3	0	0	0	0	111.4	P2661 I2665 E2666 K2667	P2661-S2663 WeakPolarHBondContact O-CA 3.47Å; P2661-S2663 PolarHBondContact O-N 3.41Å; S2663-I2665 PolarHBondContact O-N 3.12Å; S2663-E2666 PolarHBondContact O-N 3.21Å; S2663-E2666 PolarHBondContact OG-N 3.01Å; S2663-E2666 VanDerWaalsContact OG-N 3.07Å; S2663-K2667 PolarHBondContact O-N 3.45Å
2664	V	31.8	Very low	31	Very low	62.5 Å²	62.5	102.2 Å²	102.2	38%	0.379	51%	0.512	S	S	.	.	H	α-helix	trans	-72.2	29.1	172.6	170.9	0	0	0	0	109.8	F2348 K2369 R2662 E2666 K2667 V2668	F2348-V2664 HydrophobicContact CD1-CG1 3.71Å; F2348-V2664 HydrophobicContact CE1-CB 4.31Å; F2348-V2664 HydrophobicContact CE1-CG1 3.58Å; F2348-V2664 HydrophobicContact CE1-CG2 4.25Å; F2348-V2664 HydrophobicContact CZ-CG1 4.37Å; K2369-V2664 VanDerWaalsContact NZ-CG1 3.33Å; R2662-V2664 PolarHBondContact O-N 2.88Å; V2664-E2666 HydrophobicContact CG1-CG 4.46Å; V2664-E2666 PolarHBondContact O-N 2.88Å; V2664-E2666 VanDerWaalsContact O-N 3.15Å; V2664-K2667 CarbonylContact O-C 3.57Å; V2664-K2667 WeakPolarHBondContact O-CB 3.18Å; V2664-K2667 PolarHBondContact O-N 3Å; V2664-V2668 HydrophobicContact CG1-CG2 3.91Å; V2664-V2668 WeakPolarHBondContact O-CB 3.19Å; V2664-V2668 WeakPolarHBondContact O-CG2 3.43Å; V2664-V2668 PolarHBondContact O-N 3.39Å
2665	I	33.1	Very low	31	Very low	72 Å²	72	102.9 Å²	102.9	37%	0.369	52%	0.517	S	S	.	.	H	α-helix	trans	-70.4	29.9	177.5	-56.1	166	0	0	0	111.3	M2524 I2643 S2663 K2667 V2668 Y2669 G2670	M2524-I2665 HydrophobicContact CB-CD1 3.72Å; M2524-I2665 HydrophobicContact CE-CD1 3.84Å; M2524-I2665 HydrophobicContact CE-CG1 4.24Å; M2524-I2665 HydrophobicContact CE-CG2 3.64Å; M2524-I2665 HydrophobicContact CG-CD1 4.25Å; M2524-I2665 HydrophobicContact SD-CB 4.45Å; M2524-I2665 HydrophobicContact SD-CD1 3.59Å; M2524-I2665 VanDerWaalsContact SD-CD1 3.59Å; M2524-I2665 HydrophobicContact SD-CG1 3.66Å; M2524-I2665 HydrophobicContact SD-CG2 3.9Å; I2643-I2665 HydrophobicContact CD1-CD1 3.76Å; I2643-I2665 HydrophobicContact CD1-CG1 4.18Å; S2663-I2665 PolarHBondContact O-N 3.12Å; I2665-K2667 HydrophobicContact CG2-CG 4.43Å; I2665-K2667 PolarHBondContact O-N 3.44Å; I2665-V2668 PolarHBondContact O-N 3.23Å; I2665-Y2669 HydrophobicContact CG2-CD2 4.35Å; I2665-Y2669 PolarHBondContact O-N 2.84Å; I2665-G2670 PolarHBondContact O-N 3.48Å
2666	E	33.4	Very low	31	Very low	80 Å²	80	103.4 Å²	103.4	37%	0.374	50%	0.5	S	S	.	.	H	α-helix	trans	-79.6	63	168.5	-108.9	-167.1	-168.7	0	0	111.5	K2369 R2662 S2663 V2664 G2670	K2369-E2666 IonicContact NZ-OE1 3.35Å; K2369-E2666 PolarHBondContact NZ-OE1 2.81Å; R2662-E2666 WeakPolarHBondContact CG-OE2 3.24Å; R2662-E2666 IonicContact NE-OE2 3.23Å; S2663-E2666 PolarHBondContact O-N 3.21Å; S2663-E2666 PolarHBondContact OG-N 3.01Å; S2663-E2666 VanDerWaalsContact OG-N 3.07Å; V2664-E2666 HydrophobicContact CG1-CG 4.46Å; V2664-E2666 PolarHBondContact O-N 2.88Å; V2664-E2666 VanDerWaalsContact O-N 3.15Å; E2666-G2670 VanDerWaalsContact O-CA 3.26Å; E2666-G2670 WeakPolarHBondContact O-CA 3.11Å
2667	K	35.9	Very low	31.1	Very low	90.5 Å²	90.5	96.1 Å²	96.1	39%	0.393	47%	0.466	S	S	.	.			trans	-101.5	32.6	170.8	-65.8	-173.2	-177.5	177	0	110	F2348 T2350 L2413 E2456 S2663 V2664 I2665	F2348-K2667 HydrophobicContact CZ-CB 3.72Å; F2348-K2667 HydrophobicContact CZ-CD 4.32Å; T2350-K2667 HydrophobicContact CG2-CD 3.67Å; T2350-K2667 PolarHBondContact OG1-NZ 3.22Å; L2413-K2667 HydrophobicContact CD1-CB 3.76Å; L2413-K2667 VanDerWaalsContact CD2-O 3.24Å; L2413-K2667 WeakPolarHBondContact CD2-O 3.28Å; E2456-K2667 IonicContact OE2-NZ 3.76Å; E2456-K2667 PolarHBondContact OE2-NZ 2.79Å; S2663-K2667 PolarHBondContact O-N 3.45Å; V2664-K2667 CarbonylContact O-C 3.57Å; V2664-K2667 WeakPolarHBondContact O-CB 3.18Å; V2664-K2667 PolarHBondContact O-N 3Å; I2665-K2667 HydrophobicContact CG2-CG 4.43Å; I2665-K2667 PolarHBondContact O-N 3.44Å
2668	V	34.4	Very low	31.2	Very low	28 Å²	28	89.7 Å²	89.7	17%	0.17	44%	0.436	C	S	.	.	H	α-helix	trans	-84.3	-142.6	177.9	179.6	0	0	0	0	110.3	F2348 L2415 V2664 I2665 V2800	F2348-V2668 HydrophobicContact CD1-CG2 4.13Å; F2348-V2668 HydrophobicContact CD2-CG2 3.45Å; F2348-V2668 VanDerWaalsContact CD2-CG2 3.45Å; F2348-V2668 HydrophobicContact CE1-CG2 4Å; F2348-V2668 HydrophobicContact CE2-CB 4.23Å; F2348-V2668 HydrophobicContact CE2-CG2 3.28Å; F2348-V2668 HydrophobicContact CG-CG2 3.84Å; F2348-V2668 HydrophobicContact CZ-CG2 3.55Å; L2415-V2668 HydrophobicContact CD1-CG1 4.44Å; V2664-V2668 HydrophobicContact CG1-CG2 3.91Å; V2664-V2668 WeakPolarHBondContact O-CB 3.19Å; V2664-V2668 WeakPolarHBondContact O-CG2 3.43Å; V2664-V2668 PolarHBondContact O-N 3.39Å; I2665-V2668 PolarHBondContact O-N 3.23Å; V2668-V2800 HydrophobicContact CB-CB 4.33Å; V2668-V2800 PolarHBondContact N-O 2.63Å; V2668-V2800 PolarHBondContact O-N 2.75Å
2669	Y	35.4	Very low	31.4	Very low	81.5 Å²	81.5	86.3 Å²	86.3	32%	0.32	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	61.7	-176.6	-63.3	-65.7	0	0	0	111.3	I2596 I2665 E2671 I2672 M2673 R2797 V2799	I2596-Y2669 HydrophobicContact CD1-CD1 3.87Å; I2596-Y2669 HydrophobicContact CD1-CD2 4.27Å; I2596-Y2669 HydrophobicContact CD1-CE1 3.6Å; I2596-Y2669 HydrophobicContact CD1-CE2 4.02Å; I2596-Y2669 HydrophobicContact CD1-CG 4.2Å; I2665-Y2669 HydrophobicContact CG2-CD2 4.35Å; I2665-Y2669 PolarHBondContact O-N 2.84Å; Y2669-E2671 PolarHBondContact O-N 2.88Å; Y2669-I2672 CarbonylContact O-C 3.59Å; Y2669-I2672 WeakPolarHBondContact O-CA 3.48Å; Y2669-I2672 PolarHBondContact O-N 3.5Å; Y2669-M2673 WeakPolarHBondContact O-CB 3.37Å; Y2669-M2673 PolarHBondContact O-N 2.87Å; Y2669-R2797 VanDerWaalsContact CE1-NH2 3.3Å; Y2669-V2799 HydrophobicContact CD1-CG1 4.19Å; Y2669-V2799 HydrophobicContact CD1-CG2 4.2Å; Y2669-V2799 HydrophobicContact CE1-CG1 4.08Å; Y2669-V2799 HydrophobicContact CE1-CG2 4.41Å
2670	G	33.9	Very low	31.6	Very low	6.5 Å²	6.5	81.6 Å²	81.6	7%	0.067	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	53.2	179.5	0	0	0	0	0	113.3	I2665 E2666 R2674 V2798	I2665-G2670 PolarHBondContact O-N 3.48Å; E2666-G2670 VanDerWaalsContact O-CA 3.26Å; E2666-G2670 WeakPolarHBondContact O-CA 3.11Å; G2670-R2674 WeakPolarHBondContact O-CA 3.24Å; G2670-R2674 WeakPolarHBondContact O-CB 3.46Å; G2670-R2674 VanDerWaalsContact O-CG 3.28Å; G2670-R2674 WeakPolarHBondContact O-CG 3.42Å; G2670-R2674 PolarHBondContact O-N 2.79Å; G2670-V2798 PolarHBondContact N-O 2.75Å; G2670-V2798 PolarHBondContact O-N 2.88Å
2671	E	33.1	Very low	31.9	Very low	82.5 Å²	82.5	84.7 Å²	84.7	39%	0.386	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.4	56.7	167.4	-79.9	174.9	176.9	0	0	111.3	R2407 T2429 Y2669 M2673 R2674	R2407-E2671 IonicContact CZ-OE1 2.68Å; R2407-E2671 IonicContact CZ-OE2 3.29Å; R2407-E2671 IonicContact NH1-OE1 3.18Å; R2407-E2671 IonicContact NH1-OE2 3.94Å; R2407-E2671 PolarHBondContact NH1-OE2 3.46Å; R2407-E2671 IonicContact NH2-OE1 3.87Å; R2407-E2671 PolarHBondContact NH2-OE1 2.89Å; R2407-E2671 IonicContact NH2-OE2 3.56Å; R2407-E2671 PolarHBondContact NH2-OE2 2.75Å; T2429-E2671 HydrophobicContact CG2-CB 3.74Å; Y2669-E2671 PolarHBondContact O-N 2.88Å; E2671-M2673 PolarHBondContact O-N 2.85Å; E2671-R2674 VanDerWaalsContact CG-NH2 3.25Å; E2671-R2674 IonicContact OE1-CZ 3.65Å; E2671-R2674 IonicContact OE1-NH1 2.69Å; E2671-R2674 PolarHBondContact OE1-NH1 2.79Å; E2671-R2674 IonicContact OE1-NH2 2.63Å; E2671-R2674 PolarHBondContact OE1-NH2 2.85Å
2672	I	35.4	Very low	32	Very low	45.5 Å²	45.5	83 Å²	83	23%	0.233	39%	0.386	C	S	.	.			trans	-83.6	34.2	172	-62.1	179.2	0	0	0	108.8	V2610 Y2669 R2674 W2698 I2700 L2795 V2798	V2610-I2672 HydrophobicContact CG2-CG2 3.6Å; Y2669-I2672 CarbonylContact O-C 3.59Å; Y2669-I2672 WeakPolarHBondContact O-CA 3.48Å; Y2669-I2672 PolarHBondContact O-N 3.5Å; I2672-R2674 HydrophobicContact CG2-CG 4.29Å; I2672-R2674 WeakPolarHBondContact O-CD 3.23Å; I2672-R2674 WeakPolarHBondContact O-CG 3.38Å; I2672-R2674 PolarHBondContact O-N 2.82Å; I2672-W2698 HydrophobicContact CG2-CE3 3.98Å; I2672-W2698 HydrophobicContact CG2-CH2 3.62Å; I2672-W2698 HydrophobicContact CG2-CZ2 4.46Å; I2672-W2698 HydrophobicContact CG2-CZ3 3.34Å; I2672-I2700 HydrophobicContact CD1-CD1 4.09Å; I2672-I2700 HydrophobicContact CD1-CG1 4.28Å; I2672-L2795 HydrophobicContact CD1-CB 3.54Å; I2672-L2795 HydrophobicContact CD1-CD1 3.9Å; I2672-L2795 HydrophobicContact CD1-CG 4.38Å; I2672-V2798 HydrophobicContact CD1-CG2 3.9Å; I2672-V2798 HydrophobicContact CG1-CG2 4.04Å
2673	M	29.8	Very low	32	Very low	82.5 Å²	82.5	81.1 Å²	81.1	41%	0.406	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-70	49.5	179.2	-80.4	-86.2	-122.8	0	0	111.8	I2596 Q2603 Y2669 E2671 E2675 K2676	I2596-M2673 HydrophobicContact CD1-CE 4.18Å; I2596-M2673 HydrophobicContact CG2-CE 4.21Å; Q2603-M2673 HydrophobicContact CB-CE 4.25Å; Q2603-M2673 PolarHBondContact OE1-SD 2.94Å; Y2669-M2673 WeakPolarHBondContact O-CB 3.37Å; Y2669-M2673 PolarHBondContact O-N 2.87Å; E2671-M2673 PolarHBondContact O-N 2.85Å; M2673-E2675 PolarHBondContact O-N 2.84Å; M2673-K2676 PolarHBondContact O-N 2.8Å; M2673-K2676 VanDerWaalsContact O-N 3.07Å
2674	R	32.6	Very low	32.1	Very low	84.5 Å²	84.5	81.6 Å²	81.6	32%	0.319	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-77.4	27.8	-174.3	-106.8	155.3	-178	-133.8	1.1	111.4	D2308 I2309 G2670 E2671 I2672 W2698 L2795	D2308-R2674 PolarHBondContact O-NH1 2.86Å; D2308-R2674 PolarHBondContact O-NH2 2.77Å; D2308-R2674 IonicContact OD1-CZ 3.54Å; D2308-R2674 VanDerWaalsContact OD1-CZ 3.22Å; D2308-R2674 IonicContact OD1-NE 3.54Å; D2308-R2674 IonicContact OD1-NH1 3.3Å; D2308-R2674 PolarHBondContact OD1-NH1 2.75Å; D2308-R2674 IonicContact OD1-NH2 3.98Å; D2308-R2674 IonicContact OD2-CZ 2.68Å; D2308-R2674 IonicContact OD2-NE 2.72Å; D2308-R2674 PolarHBondContact OD2-NE 2.84Å; D2308-R2674 IonicContact OD2-NH1 2.77Å; D2308-R2674 PolarHBondContact OD2-NH1 2.81Å; D2308-R2674 IonicContact OD2-NH2 2.64Å; D2308-R2674 PolarHBondContact OD2-NH2 2.92Å; I2309-R2674 HydrophobicContact CG1-CB 4.3Å; I2309-R2674 HydrophobicContact CG1-CG 4.45Å; G2670-R2674 WeakPolarHBondContact O-CA 3.24Å; G2670-R2674 WeakPolarHBondContact O-CB 3.46Å; G2670-R2674 VanDerWaalsContact O-CG 3.28Å; G2670-R2674 WeakPolarHBondContact O-CG 3.42Å; G2670-R2674 PolarHBondContact O-N 2.79Å; E2671-R2674 VanDerWaalsContact CG-NH2 3.25Å; E2671-R2674 IonicContact OE1-CZ 3.65Å; E2671-R2674 IonicContact OE1-NH1 2.69Å; E2671-R2674 PolarHBondContact OE1-NH1 2.79Å; E2671-R2674 IonicContact OE1-NH2 2.63Å; E2671-R2674 PolarHBondContact OE1-NH2 2.85Å; I2672-R2674 HydrophobicContact CG2-CG 4.29Å; I2672-R2674 WeakPolarHBondContact O-CD 3.23Å; I2672-R2674 WeakPolarHBondContact O-CG 3.38Å; I2672-R2674 PolarHBondContact O-N 2.82Å; R2674-W2698 HydrophobicContact CG-CH2 4.03Å; R2674-L2795 PolarHBondContact NE-O 2.75Å
2675	E	28.9	Very low	32.1	Very low	143.5 Å²	143.5	89.1 Å²	89.1	67%	0.671	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-67.2	65.9	176.9	-65.4	-163.9	138	0	0	112.6	M2673 L2707 W2709	M2673-E2675 PolarHBondContact O-N 2.84Å; E2675-L2707 WeakPolarHBondContact O-CD1 3.43Å; E2675-L2707 WeakPolarHBondContact O-CD2 3.3Å; E2675-W2709 HydrophobicContact CB-CH2 3.98Å; E2675-W2709 HydrophobicContact CB-CZ2 3.73Å; E2675-W2709 HydrophobicContact CG-CH2 3.86Å; E2675-W2709 HydrophobicContact CG-CZ2 4.15Å; E2675-W2709 WeakPolarHBondContact O-CZ2 3.45Å; E2675-W2709 WeakPolarHBondContact OE1-CH2 3.13Å
2676	K	28	Very low	32	Very low	77.5 Å²	77.5	88.4 Å²	88.4	34%	0.337	42%	0.417	S	S	.	.			trans	-93.5	110.3	-172.8	-56.7	-167.4	-174.2	-162.9	0	114.3	T2311 P2613 M2673 E2678 L2707 D2803	T2311-K2676 HydrophobicContact CG2-CB 4.4Å; T2311-K2676 HydrophobicContact CG2-CD 3.9Å; T2311-K2676 HydrophobicContact CG2-CG 3.75Å; T2311-K2676 WeakPolarHBondContact OG1-CA 3.26Å; T2311-K2676 WeakPolarHBondContact OG1-CB 3.12Å; T2311-K2676 WeakPolarHBondContact OG1-CG 3.35Å; P2613-K2676 HydrophobicContact CB-CD 3.88Å; M2673-K2676 PolarHBondContact O-N 2.8Å; M2673-K2676 VanDerWaalsContact O-N 3.07Å; K2676-E2678 HydrophobicContact CD-CG 4.23Å; K2676-E2678 WeakPolarHBondContact CD-OE1 3.39Å; K2676-E2678 IonicContact NZ-OE1 3.54Å; K2676-E2678 PolarHBondContact NZ-OE1 3.15Å; K2676-L2707 HydrophobicContact CG-CD1 4.08Å; K2676-D2803 IonicContact NZ-OD1 3.33Å; K2676-D2803 PolarHBondContact NZ-OD1 3.03Å
2677	Q	28.5	Very low	32	Very low	47 Å²	47	90.1 Å²	90.1	22%	0.22	43%	0.428	C	S	.	.			trans	-95.8	93.8	165	-68.4	-172.1	-42.2	0	0	111.4	I2309 V2310 Y2679 I2805	I2309-Q2677 HydrophobicContact CD1-CG 3.81Å; I2309-Q2677 HydrophobicContact CG2-CB 3.65Å; I2309-Q2677 HydrophobicContact CG2-CG 3.8Å; I2309-Q2677 VanDerWaalsContact CG2-OE1 3.27Å; V2310-Q2677 PolarHBondContact O-N 2.92Å; Q2677-Y2679 VanDerWaalsContact C-N 3.35Å; Q2677-Y2679 HydrophobicContact CB-CD2 4.17Å; Q2677-Y2679 HydrophobicContact CB-CE2 3.87Å; Q2677-Y2679 VanDerWaalsContact CD-CE2 3.4Å; Q2677-Y2679 HydrophobicContact CG-CE2 4.21Å; Q2677-Y2679 PolarHBondContact NE2-OH 2.94Å; Q2677-Y2679 VanDerWaalsContact NE2-OH 3.1Å; Q2677-Y2679 WeakPolarHBondContact O-CD2 3.41Å; Q2677-Y2679 VanDerWaalsContact O-CE2 3.23Å; Q2677-Y2679 WeakPolarHBondContact O-CE2 3.2Å; Q2677-Y2679 PolarHBondContact O-N 3.05Å; Q2677-I2805 HydrophobicContact CB-CG1 4.36Å; Q2677-I2805 HydrophobicContact CB-CG2 4.23Å
2678	E	29.4	Very low	31.8	Very low	39 Å²	39	92.8 Å²	92.8	18%	0.182	45%	0.446	C	S	.	.			trans	-80.3	116.8	161.7	-67.5	179.2	-163.1	0	0	109.3	E2312 T2601 K2614 K2676 F2680 V2800 T2801 G2802	E2312-E2678 HydrophobicContact CG-CG 4.24Å; T2601-E2678 WeakPolarHBondContact CG2-OE2 3.35Å; K2614-E2678 HydrophobicContact CB-CG 4.39Å; K2614-E2678 WeakPolarHBondContact CB-OE2 3.32Å; K2614-E2678 HydrophobicContact CD-CB 4.29Å; K2676-E2678 HydrophobicContact CD-CG 4.23Å; K2676-E2678 WeakPolarHBondContact CD-OE1 3.39Å; K2676-E2678 IonicContact NZ-OE1 3.54Å; K2676-E2678 PolarHBondContact NZ-OE1 3.15Å; E2678-F2680 VanDerWaalsContact C-N 3.33Å; E2678-F2680 HydrophobicContact CB-CD2 4.26Å; E2678-F2680 HydrophobicContact CB-CE2 4.32Å; E2678-F2680 PolarHBondContact O-N 3.32Å; E2678-V2800 WeakPolarHBondContact CB-O 3.21Å; E2678-V2800 WeakPolarHBondContact CG-O 3.37Å; E2678-T2801 VanDerWaalsContact OE1-CA 3.24Å; E2678-T2801 WeakPolarHBondContact OE1-CA 3.46Å; E2678-G2802 PolarHBondContact OE1-N 2.81Å
2679	Y	30.8	Very low	31.7	Very low	105.5 Å²	105.5	98.6 Å²	98.6	41%	0.414	48%	0.476	S	S	.	.			trans	-99.9	112.6	-175.9	-81.6	-89.3	0	0	0	112.2	Q2677 Y2681 I2805 A2806 Q2807	Q2677-Y2679 VanDerWaalsContact C-N 3.35Å; Q2677-Y2679 HydrophobicContact CB-CD2 4.17Å; Q2677-Y2679 HydrophobicContact CB-CE2 3.87Å; Q2677-Y2679 VanDerWaalsContact CD-CE2 3.4Å; Q2677-Y2679 HydrophobicContact CG-CE2 4.21Å; Q2677-Y2679 PolarHBondContact NE2-OH 2.94Å; Q2677-Y2679 VanDerWaalsContact NE2-OH 3.1Å; Q2677-Y2679 WeakPolarHBondContact O-CD2 3.41Å; Q2677-Y2679 VanDerWaalsContact O-CE2 3.23Å; Q2677-Y2679 WeakPolarHBondContact O-CE2 3.2Å; Q2677-Y2679 PolarHBondContact O-N 3.05Å; Y2679-Y2681 VanDerWaalsContact C-N 3.33Å; Y2679-Y2681 HydrophobicContact CD1-CD2 4Å; Y2679-Y2681 AromaticContact CD1-CE2 3.64Å; Y2679-Y2681 HydrophobicContact CD1-CE2 3.64Å; Y2679-Y2681 AromaticContact CE1-CE2 3.9Å; Y2679-Y2681 HydrophobicContact CE1-CE2 3.9Å; Y2679-Y2681 PolarHBondContact O-N 2.84Å; Y2679-I2805 HydrophobicContact CE2-CG2 3.77Å; Y2679-I2805 WeakPolarHBondContact OH-CG2 3.34Å; Y2679-A2806 VanDerWaalsContact CB-O 3.24Å; Y2679-A2806 WeakPolarHBondContact CB-O 3.21Å; Y2679-A2806 WeakPolarHBondContact CD1-O 3.39Å; Y2679-A2806 VanDerWaalsContact CD2-C 3.44Å; Y2679-A2806 HydrophobicContact CD2-CB 3.86Å; Y2679-A2806 VanDerWaalsContact CD2-N 3.27Å; Y2679-A2806 VanDerWaalsContact CD2-O 3.26Å; Y2679-A2806 WeakPolarHBondContact CD2-O 3.4Å; Y2679-A2806 HydrophobicContact CG-CB 4.3Å; Y2679-Q2807 WeakPolarHBondContact CE1-O 3.42Å
2680	F	30.8	Very low	31.5	Very low	111 Å²	111	98.9 Å²	98.9	49%	0.487	49%	0.49	S	S	.	.	B	Isolated β-bridge	trans	-97.2	114	177	-65.9	-74.5	0	0	0	112	I2599 Y2600 T2601 E2678 S2682	I2599-F2680 WeakPolarHBondContact O-CE1 3.43Å; I2599-F2680 WeakPolarHBondContact O-CZ 3.29Å; Y2600-F2680 HydrophobicContact CD2-CD1 4.14Å; T2601-F2680 HydrophobicContact CG2-CE1 3.91Å; T2601-F2680 HydrophobicContact CG2-CZ 3.87Å; E2678-F2680 VanDerWaalsContact C-N 3.33Å; E2678-F2680 HydrophobicContact CB-CD2 4.26Å; E2678-F2680 HydrophobicContact CB-CE2 4.32Å; E2678-F2680 PolarHBondContact O-N 3.32Å; F2680-S2682 PolarHBondContact O-N 3.44Å
2681	Y	34.7	Very low	31.6	Very low	156 Å²	156	109.7 Å²	109.7	61%	0.612	53%	0.529	S	S	*	.			trans	-111.4	111.5	168.2	-125.9	-85.7	0	0	0	113.2	Y2679 K2683 I2809	Y2679-Y2681 VanDerWaalsContact C-N 3.33Å; Y2679-Y2681 HydrophobicContact CD1-CD2 4Å; Y2679-Y2681 AromaticContact CD1-CE2 3.64Å; Y2679-Y2681 HydrophobicContact CD1-CE2 3.64Å; Y2679-Y2681 AromaticContact CE1-CE2 3.9Å; Y2679-Y2681 HydrophobicContact CE1-CE2 3.9Å; Y2679-Y2681 PolarHBondContact O-N 2.84Å; Y2681-K2683 PolarHBondContact O-N 3.48Å; Y2681-I2809 WeakPolarHBondContact CD2-O 3.36Å; Y2681-I2809 HydrophobicContact CG-CB 4.29Å; Y2681-I2809 VanDerWaalsContact CG-O 3.29Å
2682	S	30.1	Very low	31.9	Very low	85 Å²	85	114 Å²	114	59%	0.594	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-73.8	132.2	178.2	61.8	0	0	0	0	112.5	F2680 P2684	F2680-S2682 PolarHBondContact O-N 3.44Å; S2682-P2684 WeakPolarHBondContact O-CD 3.49Å
2683	K	30.3	Very low	32	Very low	164 Å²	164	115.6 Å²	115.6	71%	0.713	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-51.6	128.3	174.3	-126.1	-177.8	178.1	179.9	0	111.4	Y2681 R2685 I2687	Y2681-K2683 PolarHBondContact O-N 3.48Å; K2683-R2685 PolarHBondContact O-N 3Å; K2683-I2687 HydrophobicContact CG-CD1 4.11Å
2684	P	33.1	Very low	32.6	Very low	68.5 Å²	68.5	117.4 Å²	117.4	45%	0.445	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-56.5	127.4	164	-22.5	33.4	0	0	0	110.6	S2682 G2686 I2687 W2698 L2795 G2796	S2682-P2684 WeakPolarHBondContact O-CD 3.49Å; P2684-G2686 PolarHBondContact O-N 3.38Å; P2684-I2687 HydrophobicContact CB-CD1 4.28Å; P2684-I2687 WeakPolarHBondContact O-CD1 3.44Å; P2684-W2698 HydrophobicContact CB-CH2 3.71Å; P2684-W2698 HydrophobicContact CB-CZ3 3.79Å; P2684-L2795 WeakPolarHBondContact CD-O 3.47Å; P2684-L2795 HydrophobicContact CG-CB 4.14Å; P2684-G2796 WeakPolarHBondContact CD-O 3.3Å
2685	R	31.9	Very low	33.3	Very low	220.5 Å²	220.5	117.8 Å²	117.8	83%	0.832	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	121.6	173.3	-81.9	-175.8	172.9	174.6	0	109.6	K2683 Y2826	K2683-R2685 PolarHBondContact O-N 3Å; R2685-Y2826 PolarHBondContact NH1-OH 2.84Å
2686	G	31.4	Very low	34.6	Very low	57 Å²	57	112.9 Å²	112.9	59%	0.588	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	111.3	78.2	167.7	0	0	0	0	0	116.4	P2684 L2688	P2684-G2686 PolarHBondContact O-N 3.38Å; G2686-L2688 PolarHBondContact O-N 2.81Å; G2686-L2688 VanDerWaalsContact O-N 3.13Å
2687	I	33.9	Very low	36.5	Very low	115.5 Å²	115.5	112.7 Å²	112.7	59%	0.592	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	7.3	39.8	-172.8	-59.5	174.1	0	0	0	115.3	K2683 P2684 N2689 L2795	K2683-I2687 HydrophobicContact CG-CD1 4.11Å; P2684-I2687 HydrophobicContact CB-CD1 4.28Å; P2684-I2687 WeakPolarHBondContact O-CD1 3.44Å; I2687-N2689 PolarHBondContact O-N 3.18Å; I2687-L2795 WeakPolarHBondContact CD1-O 3.39Å
2688	L	30.9	Very low	38.8	Very low	148.5 Å²	148.5	111.7 Å²	111.7	78%	0.777	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	-108.1	-177.1	-101.6	71.3	0	0	0	113.7	G2686	G2686-L2688 PolarHBondContact O-N 2.81Å; G2686-L2688 VanDerWaalsContact O-N 3.13Å
2689	N	31.7	Very low	41.2	Very low	150 Å²	150	111.8 Å²	111.8	80%	0.802	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	153.3	41.9	178.7	-64.8	-12.6	0	0	0	116.9	I2687 R2691	I2687-N2689 PolarHBondContact O-N 3.18Å; N2689-R2691 PolarHBondContact O-N 2.89Å
2690	S	32.3	Very low	43.7	Very low	86.5 Å²	86.5	106.9 Å²	106.9	61%	0.605	52%	0.521	S	S	*	.			trans	-110.4	134.2	160.6	-171	0	0	0	0	110.7
2691	R	35.9	Very low	46.3	Very low	234.5 Å²	234.5	102.9 Å²	102.9	89%	0.885	51%	0.505	S	S	*	.	S	Bend	trans	-105.8	47.6	-174.8	-74.9	-177.5	171.8	-178.9	-3.1	113.4	N2689	N2689-R2691 PolarHBondContact O-N 2.89Å
2692	R	38.8	Very low	48.8	Very low	172.5 Å²	172.5	95.4 Å²	95.4	65%	0.651	48%	0.476	S	S	*	.			trans	-163.3	116.4	162.9	-82.3	172	-171.4	179.3	5.1	111.8	E2694 E2695 E2857	R2692-E2694 VanDerWaalsContact C-N 3.32Å; R2692-E2694 WeakPolarHBondContact CA-OE1 3.35Å; R2692-E2694 PolarHBondContact O-N 3.34Å; R2692-E2695 HydrophobicContact CB-CG 4.15Å; R2692-E2695 WeakPolarHBondContact CD-OE1 3.35Å; R2692-E2695 IonicContact CZ-OE1 2.72Å; R2692-E2695 IonicContact NE-OE1 3.87Å; R2692-E2695 IonicContact NH1-OE1 3.72Å; R2692-E2695 PolarHBondContact NH1-OE1 2.67Å; R2692-E2857 IonicContact CZ-OE2 2.71Å; R2692-E2857 IonicContact NH2-OE2 2.77Å; R2692-E2857 PolarHBondContact NH2-OE2 3.28Å
2693	P	37.3	Very low	51.3	Low	78 Å²	78	92 Å²	92	51%	0.506	45%	0.451	S	S	.	.	G	3₁₀ helix	trans	-70.9	-114.3	176.5	5.7	0	0	0	0	113.1	E2695 L2696 R2793	P2693-E2695 VanDerWaalsContact C-N 3.26Å; P2693-E2695 PolarHBondContact O-N 2.68Å; P2693-L2696 WeakPolarHBondContact O-CB 3.47Å; P2693-L2696 PolarHBondContact O-N 2.74Å; P2693-L2696 VanDerWaalsContact O-N 3.07Å; P2693-R2793 HydrophobicContact CB-CB 4.03Å; P2693-R2793 WeakPolarHBondContact CB-O 3.32Å; P2693-R2793 HydrophobicContact CG-CB 3.9Å; P2693-R2793 HydrophobicContact CG-CG 4.38Å
2694	E	43.2	Very low	54	Low	121 Å²	121	84.2 Å²	84.2	57%	0.565	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-63	56.5	178.2	-8.2	-135.5	-179.2	0	0	114	R2692 L2696 S2772	R2692-E2694 VanDerWaalsContact C-N 3.32Å; R2692-E2694 WeakPolarHBondContact CA-OE1 3.35Å; R2692-E2694 PolarHBondContact O-N 3.34Å; E2694-L2696 VanDerWaalsContact C-N 3.27Å; E2694-L2696 PolarHBondContact O-N 3.29Å; E2694-S2772 WeakPolarHBondContact O-CA 3.1Å; E2694-S2772 PolarHBondContact O-N 2.7Å
2695	E	48.1	Very low	56.3	Low	93 Å²	93	84.5 Å²	84.5	44%	0.435	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-84.4	53.5	173.8	-70.3	-171.5	154.8	0	0	112.5	R2692 P2693 S2772	R2692-E2695 HydrophobicContact CB-CG 4.15Å; R2692-E2695 WeakPolarHBondContact CD-OE1 3.35Å; R2692-E2695 IonicContact CZ-OE1 2.72Å; R2692-E2695 IonicContact NE-OE1 3.87Å; R2692-E2695 IonicContact NH1-OE1 3.72Å; R2692-E2695 PolarHBondContact NH1-OE1 2.67Å; P2693-E2695 VanDerWaalsContact C-N 3.26Å; P2693-E2695 PolarHBondContact O-N 2.68Å; E2695-S2772 PolarHBondContact OE1-OG 2.9Å
2696	L	55.6	Low	58.7	Low	41 Å²	41	74.4 Å²	74.4	22%	0.215	37%	0.374	C	S	.	.			trans	-99.9	122.8	179.9	-59.2	175.5	0	0	0	111	P2693 E2694 G2771	P2693-L2696 WeakPolarHBondContact O-CB 3.47Å; P2693-L2696 PolarHBondContact O-N 2.74Å; P2693-L2696 VanDerWaalsContact O-N 3.07Å; E2694-L2696 VanDerWaalsContact C-N 3.27Å; E2694-L2696 PolarHBondContact O-N 3.29Å; L2696-G2771 VanDerWaalsContact O-CA 3.28Å; L2696-G2771 WeakPolarHBondContact O-CA 3.32Å
2697	K	67.5	Low	60.8	Low	73.5 Å²	73.5	72.6 Å²	72.6	32%	0.32	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	133.3	168.7	-169	161.4	-176.4	164.1	0	110.1	S2769 I2770 E2776 L2814	K2697-S2769 WeakPolarHBondContact CE-OG 3.17Å; K2697-S2769 PolarHBondContact NZ-OG 2.58Å; K2697-I2770 CarbonylContact C-O 3.51Å; K2697-I2770 WeakPolarHBondContact CA-O 3.44Å; K2697-E2776 IonicContact NZ-OE2 3.2Å; K2697-E2776 PolarHBondContact NZ-OE2 3.2Å; K2697-L2814 CarbonylContact C-O 3.47Å; K2697-L2814 WeakPolarHBondContact CA-O 3.33Å; K2697-L2814 HydrophobicContact CB-CB 4.41Å; K2697-L2814 WeakPolarHBondContact CB-O 3.31Å; K2697-L2814 PolarHBondContact N-O 2.85Å; K2697-L2814 VanDerWaalsContact N-O 3.09Å; K2697-L2814 PolarHBondContact O-N 3.44Å
2698	W	76.2	Confident	62.4	Low	25 Å²	25	71.3 Å²	71.3	10%	0.095	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	149.8	178.8	-66.5	93.9	0	0	0	110.5	I2672 R2674 P2684 S2769 I2770 L2795 T2812 Q2813	I2672-W2698 HydrophobicContact CG2-CE3 3.98Å; I2672-W2698 HydrophobicContact CG2-CH2 3.62Å; I2672-W2698 HydrophobicContact CG2-CZ2 4.46Å; I2672-W2698 HydrophobicContact CG2-CZ3 3.34Å; R2674-W2698 HydrophobicContact CG-CH2 4.03Å; P2684-W2698 HydrophobicContact CB-CH2 3.71Å; P2684-W2698 HydrophobicContact CB-CZ3 3.79Å; W2698-S2769 CarbonylContact O-C 3.55Å; W2698-S2769 VanDerWaalsContact O-CA 3.28Å; W2698-S2769 WeakPolarHBondContact O-CA 3.38Å; W2698-S2769 PolarHBondContact O-OG 3.32Å; W2698-I2770 HydrophobicContact CB-CB 4.49Å; W2698-I2770 PolarHBondContact N-O 2.79Å; W2698-I2770 PolarHBondContact O-N 3.03Å; W2698-I2770 VanDerWaalsContact O-N 3.08Å; W2698-L2795 HydrophobicContact CB-CD1 3.59Å; W2698-L2795 VanDerWaalsContact CB-CD1 3.45Å; W2698-L2795 HydrophobicContact CD2-CD1 3.76Å; W2698-L2795 HydrophobicContact CD2-CG 4.48Å; W2698-L2795 HydrophobicContact CE3-CD1 4.46Å; W2698-L2795 HydrophobicContact CG-CD1 3.36Å; W2698-L2795 HydrophobicContact CG-CG 4.13Å; W2698-T2812 CarbonylContact C-O 3.57Å; W2698-Q2813 HydrophobicContact CD2-CB 4.35Å; W2698-Q2813 HydrophobicContact CD2-CG 4.06Å; W2698-Q2813 HydrophobicContact CE3-CB 3.85Å; W2698-Q2813 HydrophobicContact CE3-CG 4.05Å; W2698-Q2813 HydrophobicContact CH2-CB 4.32Å; W2698-Q2813 HydrophobicContact CH2-CG 4.18Å; W2698-Q2813 VanDerWaalsContact CH2-NE2 3.34Å; W2698-Q2813 HydrophobicContact CZ2-CG 4.19Å; W2698-Q2813 HydrophobicContact CZ3-CB 3.83Å; W2698-Q2813 HydrophobicContact CZ3-CG 4.1Å
2699	L	80.8	Confident	64.6	Low	42 Å²	42	70.6 Å²	70.6	22%	0.22	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	106.9	177.7	-155.3	81.1	0	0	0	109.5	N2701 T2767 M2778 T2812 L2814	L2699-N2701 PolarHBondContact O-ND2 2.83Å; L2699-T2767 HydrophobicContact CD1-CG2 3.87Å; L2699-T2767 VanDerWaalsContact CD1-CG2 3.49Å; L2699-T2767 HydrophobicContact CD2-CG2 4.14Å; L2699-T2767 HydrophobicContact CG-CG2 3.73Å; L2699-M2778 HydrophobicContact CD1-CE 4.19Å; L2699-T2812 PolarHBondContact N-O 2.84Å; L2699-T2812 PolarHBondContact O-N 3.25Å; L2699-L2814 HydrophobicContact CB-CD1 4.1Å; L2699-L2814 HydrophobicContact CD1-CD1 4.12Å; L2699-L2814 HydrophobicContact CD2-CD1 4.35Å; L2699-L2814 HydrophobicContact CG-CD1 4.42Å
2700	I	84	Confident	66.7	Low	2.5 Å²	2.5	64.1 Å²	64.1	1%	0.013	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	117.2	179	-59.5	163.1	0	0	0	108	I2672 I2702 I2717 T2767 I2768 I2770 L2795 V2798 I2809	I2672-I2700 HydrophobicContact CD1-CD1 4.09Å; I2672-I2700 HydrophobicContact CD1-CG1 4.28Å; I2700-I2702 HydrophobicContact CG2-CD1 4.22Å; I2700-I2702 HydrophobicContact CG2-CG1 4.06Å; I2700-I2717 HydrophobicContact CD1-CD1 3.71Å; I2700-I2717 HydrophobicContact CD1-CG1 4.35Å; I2700-T2767 CarbonylContact O-C 3.52Å; I2700-T2767 VanDerWaalsContact O-CA 3.27Å; I2700-T2767 WeakPolarHBondContact O-CA 3.46Å; I2700-I2768 HydrophobicContact CB-CB 4.4Å; I2700-I2768 PolarHBondContact N-O 3.09Å; I2700-I2768 PolarHBondContact O-N 2.8Å; I2700-I2770 HydrophobicContact CD1-CD1 3.94Å; I2700-L2795 HydrophobicContact CD1-CD1 4.19Å; I2700-V2798 HydrophobicContact CD1-CG2 3.95Å; I2700-V2798 HydrophobicContact CG1-CG2 4.48Å; I2700-V2798 HydrophobicContact CG2-CG1 4.43Å; I2700-V2798 HydrophobicContact CG2-CG2 4.15Å; I2700-I2809 HydrophobicContact CG2-CG2 3.88Å
2701	N	83.9	Confident	69.1	Low	25.5 Å²	25.5	63 Å²	63	14%	0.136	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	128.5	-179.1	-65.2	-93	0	0	0	110.2	L2699 T2767 I2809 R2810	L2699-N2701 PolarHBondContact O-ND2 2.83Å; N2701-T2767 VanDerWaalsContact OD1-CG2 3.26Å; N2701-T2767 WeakPolarHBondContact OD1-CG2 3.45Å; N2701-T2767 PolarHBondContact OD1-OG1 2.95Å; N2701-I2809 CarbonylContact O-C 3.58Å; N2701-I2809 WeakPolarHBondContact O-CA 3.16Å; N2701-R2810 HydrophobicContact CB-CB 4.48Å; N2701-R2810 PolarHBondContact N-O 3.29Å; N2701-R2810 PolarHBondContact O-N 3.21Å
2702	I	87.6	Confident	71.5	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	101.8	-176.7	-42.4	-176.9	0	0	0	109	I2700 M2704 V2715 L2766 V2798 V2800 A2806 E2808 I2809	I2700-I2702 HydrophobicContact CG2-CD1 4.22Å; I2700-I2702 HydrophobicContact CG2-CG1 4.06Å; I2702-M2704 HydrophobicContact CB-CG 4.27Å; I2702-M2704 HydrophobicContact CB-SD 4.1Å; I2702-M2704 HydrophobicContact CG2-CG 3.57Å; I2702-M2704 HydrophobicContact CG2-SD 3.73Å; I2702-M2704 PolarHBondContact O-N 3.5Å; I2702-V2715 HydrophobicContact CD1-CG1 3.97Å; I2702-V2715 HydrophobicContact CD1-CG2 4.45Å; I2702-L2766 HydrophobicContact CB-CB 4.43Å; I2702-L2766 PolarHBondContact N-O 3.17Å; I2702-L2766 PolarHBondContact O-N 2.89Å; I2702-V2798 HydrophobicContact CD1-CG1 4.09Å; I2702-V2800 HydrophobicContact CD1-CG2 3.92Å; I2702-V2800 HydrophobicContact CG2-CG2 4.15Å; I2702-A2806 HydrophobicContact CG2-CB 3.99Å; I2702-E2808 WeakPolarHBondContact CA-O 3.16Å; I2702-I2809 HydrophobicContact CD1-CG1 4.3Å; I2702-I2809 HydrophobicContact CD1-CG2 4.49Å; I2702-I2809 HydrophobicContact CG1-CG1 4.16Å; I2702-I2809 HydrophobicContact CG1-CG2 4.22Å; I2702-I2809 HydrophobicContact CG2-CG1 4.01Å
2703	P	83.6	Confident	73.9	Confident	12.5 Å²	12.5	47.7 Å²	47.7	8%	0.081	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	123	170.2	-13.4	31	0	0	0	110	L2763 F2764 A2806 Q2807 E2808	P2703-L2763 HydrophobicContact CB-CD1 4.06Å; P2703-L2763 HydrophobicContact CB-CD2 4.49Å; P2703-L2763 HydrophobicContact CB-CG 4.48Å; P2703-F2764 CarbonylContact C-O 3.56Å; P2703-F2764 WeakPolarHBondContact CA-O 3.27Å; P2703-A2806 CarbonylContact O-C 3.59Å; P2703-A2806 VanDerWaalsContact O-C 3.25Å; P2703-A2806 WeakPolarHBondContact O-CA 3.32Å; P2703-Q2807 HydrophobicContact CB-CB 4.41Å; P2703-Q2807 PolarHBondContact O-N 2.89Å; P2703-E2808 WeakPolarHBondContact CD-O 3.1Å; P2703-E2808 HydrophobicContact CG-CG 3.75Å
2704	M	85.9	Confident	76.3	Confident	0 Å²	0	44 Å²	44	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	154.6	-172.1	-54.8	-171	5.1	0	0	112.6	I2702 F2713 L2763 F2764 L2766 V2800 V2804 I2805 A2806	I2702-M2704 HydrophobicContact CB-CG 4.27Å; I2702-M2704 HydrophobicContact CB-SD 4.1Å; I2702-M2704 HydrophobicContact CG2-CG 3.57Å; I2702-M2704 HydrophobicContact CG2-SD 3.73Å; I2702-M2704 PolarHBondContact O-N 3.5Å; M2704-F2713 HydrophobicContact CE-CD2 3.87Å; M2704-F2713 HydrophobicContact CE-CE2 3.81Å; M2704-F2713 VanDerWaalsContact CE-CE2 3.49Å; M2704-F2713 HydrophobicContact CE-CG 4.49Å; M2704-F2713 HydrophobicContact CE-CZ 3.98Å; M2704-L2763 WeakPolarHBondContact O-CA 3.42Å; M2704-F2764 HydrophobicContact CB-CD2 4.37Å; M2704-F2764 HydrophobicContact CB-CE1 4.12Å; M2704-F2764 HydrophobicContact CB-CE2 3.83Å; M2704-F2764 HydrophobicContact CB-CZ 3.68Å; M2704-F2764 HydrophobicContact CE-CE2 3.65Å; M2704-F2764 HydrophobicContact CE-CZ 3.83Å; M2704-F2764 HydrophobicContact CG-CE2 4.49Å; M2704-F2764 PolarHBondContact N-O 3.24Å; M2704-F2764 WeakPolarHBondContact O-CD1 3.21Å; M2704-F2764 WeakPolarHBondContact O-CE1 3.39Å; M2704-F2764 PolarHBondContact O-N 3.01Å; M2704-F2764 HydrophobicContact SD-CE2 4.35Å; M2704-L2766 HydrophobicContact CE-CD2 4.32Å; M2704-L2766 HydrophobicContact SD-CB 4.21Å; M2704-L2766 HydrophobicContact SD-CD2 4.31Å; M2704-V2800 HydrophobicContact CE-CG1 3.74Å; M2704-V2800 HydrophobicContact SD-CG1 3.66Å; M2704-V2804 HydrophobicContact CE-CB 4.38Å; M2704-V2804 HydrophobicContact CE-CG1 3.98Å; M2704-V2804 HydrophobicContact CE-CG2 4.39Å; M2704-V2804 HydrophobicContact SD-CB 4.43Å; M2704-V2804 HydrophobicContact SD-CG2 4.22Å; M2704-I2805 CarbonylContact C-O 3.41Å; M2704-I2805 VanDerWaalsContact CA-O 3.24Å; M2704-I2805 WeakPolarHBondContact CA-O 3.44Å; M2704-A2806 HydrophobicContact CB-CB 4.47Å; M2704-A2806 HydrophobicContact CG-CB 3.76Å; M2704-A2806 HydrophobicContact SD-CB 3.7Å
2705	K	81.3	Confident	78.5	Confident	76 Å²	76	38.3 Å²	38.3	33%	0.33	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	143.7	166.9	-64	-177.9	166.9	-155.6	0	109.7	G2761 K2762 L2763 V2804 I2805	K2705-G2761 VanDerWaalsContact CD-O 3.28Å; K2705-G2761 WeakPolarHBondContact CD-O 3.41Å; K2705-G2761 VanDerWaalsContact CE-O 3.26Å; K2705-G2761 WeakPolarHBondContact CE-O 3.36Å; K2705-G2761 PolarHBondContact NZ-O 3.46Å; K2705-K2762 WeakPolarHBondContact CA-O 3.47Å; K2705-L2763 HydrophobicContact CG-CB 4.4Å; K2705-L2763 HydrophobicContact CG-CD1 3.96Å; K2705-V2804 CarbonylContact O-C 3.58Å; K2705-V2804 VanDerWaalsContact O-CA 3.24Å; K2705-V2804 WeakPolarHBondContact O-CA 3.43Å; K2705-I2805 HydrophobicContact CB-CB 4.41Å; K2705-I2805 PolarHBondContact N-O 2.81Å; K2705-I2805 PolarHBondContact O-N 2.84Å
2706	L	82.3	Confident	80.3	Confident	7 Å²	7	34.2 Å²	34.2	4%	0.037	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	141.1	166.7	-72.7	176.5	0	0	0	110.4	A2710 F2713 V2731 L2758 G2761 F2764 V2804	L2706-A2710 HydrophobicContact CB-CB 4.12Å; L2706-A2710 HydrophobicContact CD2-CB 3.85Å; L2706-A2710 HydrophobicContact CG-CB 4.4Å; L2706-F2713 HydrophobicContact CD2-CD1 4.03Å; L2706-F2713 HydrophobicContact CD2-CE1 4.16Å; L2706-V2731 HydrophobicContact CD1-CG1 3.87Å; L2706-V2731 HydrophobicContact CD2-CG1 4.29Å; L2706-V2731 HydrophobicContact CD2-CG2 3.84Å; L2706-L2758 HydrophobicContact CD1-CB 3.57Å; L2706-L2758 HydrophobicContact CD1-CD1 4.1Å; L2706-L2758 HydrophobicContact CD1-CG 4.47Å; L2706-L2758 HydrophobicContact CD2-CD1 4.49Å; L2706-L2758 HydrophobicContact CG-CB 4.41Å; L2706-L2758 HydrophobicContact CG-CD1 4.44Å; L2706-G2761 PolarHBondContact O-N 3.15Å; L2706-G2761 VanDerWaalsContact O-N 3.08Å; L2706-F2764 HydrophobicContact CD2-CZ 4.49Å; L2706-F2764 HydrophobicContact CG-CE1 4.02Å; L2706-F2764 HydrophobicContact CG-CZ 4.41Å; L2706-V2804 HydrophobicContact CD2-CG1 3.96Å
2707	L	75.2	Confident	81.6	Confident	20.5 Å²	20.5	32.2 Å²	32.2	11%	0.107	16%	0.157	C	C	.	.			trans	-71	162.7	168	-68.2	174.3	0	0	0	111.9	E2675 K2676 W2709 A2710 D2803 I2805	E2675-L2707 WeakPolarHBondContact O-CD1 3.43Å; E2675-L2707 WeakPolarHBondContact O-CD2 3.3Å; K2676-L2707 HydrophobicContact CG-CD1 4.08Å; L2707-W2709 VanDerWaalsContact C-N 3.26Å; L2707-W2709 HydrophobicContact CB-CZ2 4.16Å; L2707-W2709 HydrophobicContact CD1-CZ2 4.14Å; L2707-W2709 HydrophobicContact CD2-CZ2 4.08Å; L2707-W2709 HydrophobicContact CG-CZ2 4.38Å; L2707-W2709 PolarHBondContact O-N 2.85Å; L2707-W2709 VanDerWaalsContact O-N 3.16Å; L2707-A2710 HydrophobicContact CB-CB 4.42Å; L2707-A2710 WeakPolarHBondContact O-CB 3.12Å; L2707-A2710 PolarHBondContact O-N 2.81Å; L2707-D2803 HydrophobicContact CD1-CB 4.17Å; L2707-D2803 PolarHBondContact N-O 2.78Å; L2707-D2803 VanDerWaalsContact N-O 3.12Å; L2707-I2805 HydrophobicContact CD2-CD1 3.72Å; L2707-I2805 HydrophobicContact CD2-CG1 3.77Å; L2707-I2805 HydrophobicContact CG-CG1 4.41Å
2708	P	69.6	Low	82	Confident	88 Å²	88	31.1 Å²	31.1	57%	0.571	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-25.1	-178.2	-23.2	34.6	0	0	0	115.6	T2760	P2708-T2760 HydrophobicContact CB-CG2 4.28Å; P2708-T2760 HydrophobicContact CG-CG2 4.38Å
2709	W	75.5	Confident	82	Confident	133.5 Å²	133.5	30.3 Å²	30.3	51%	0.506	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-116.2	32.2	-177.2	47.6	73.8	0	0	0	111.4	E2675 L2707 D2711	E2675-W2709 HydrophobicContact CB-CH2 3.98Å; E2675-W2709 HydrophobicContact CB-CZ2 3.73Å; E2675-W2709 HydrophobicContact CG-CH2 3.86Å; E2675-W2709 HydrophobicContact CG-CZ2 4.15Å; E2675-W2709 WeakPolarHBondContact O-CZ2 3.45Å; E2675-W2709 WeakPolarHBondContact OE1-CH2 3.13Å; L2707-W2709 VanDerWaalsContact C-N 3.26Å; L2707-W2709 HydrophobicContact CB-CZ2 4.16Å; L2707-W2709 HydrophobicContact CD1-CZ2 4.14Å; L2707-W2709 HydrophobicContact CD2-CZ2 4.08Å; L2707-W2709 HydrophobicContact CG-CZ2 4.38Å; L2707-W2709 PolarHBondContact O-N 2.85Å; L2707-W2709 VanDerWaalsContact O-N 3.16Å; W2709-D2711 PolarHBondContact O-N 2.88Å; W2709-D2711 VanDerWaalsContact O-N 3.15Å
2710	A	76.2	Confident	81.5	Confident	13 Å²	13	29.5 Å²	29.5	11%	0.107	15%	0.146	C	C	.	.			trans	-72.1	114.7	-171.1	0	0	0	0	0	113.1	L2706 L2707 V2731 D2803	L2706-A2710 HydrophobicContact CB-CB 4.12Å; L2706-A2710 HydrophobicContact CD2-CB 3.85Å; L2706-A2710 HydrophobicContact CG-CB 4.4Å; L2707-A2710 HydrophobicContact CB-CB 4.42Å; L2707-A2710 WeakPolarHBondContact O-CB 3.12Å; L2707-A2710 PolarHBondContact O-N 2.81Å; A2710-V2731 HydrophobicContact CB-CG2 4.33Å; A2710-V2731 WeakPolarHBondContact O-CB 3.34Å; A2710-D2803 HydrophobicContact CB-CB 3.67Å; A2710-D2803 WeakPolarHBondContact CB-O 3.23Å
2711	D	82.3	Confident	80.2	Confident	65 Å²	65	34 Å²	34	35%	0.348	17%	0.169	S	C	.	.			trans	-99.7	-47.1	178	-84.6	28	0	0	0	110.7	W2709 N2730 V2731 K2732 D2803	W2709-D2711 PolarHBondContact O-N 2.88Å; W2709-D2711 VanDerWaalsContact O-N 3.15Å; D2711-N2730 PolarHBondContact O-OD1 3.3Å; D2711-V2731 PolarHBondContact O-N 2.94Å; D2711-K2732 HydrophobicContact CB-CD 4.5Å; D2711-K2732 WeakPolarHBondContact OD1-CE 3.29Å; D2711-K2732 IonicContact OD1-NZ 3.36Å; D2711-K2732 PolarHBondContact OD1-NZ 3.16Å; D2711-K2732 IonicContact OD2-NZ 2.77Å; D2711-K2732 PolarHBondContact OD2-NZ 2.98Å; D2711-D2803 PolarHBondContact N-OD2 2.98Å
2712	K	86.7	Confident	79.3	Confident	80.5 Å²	80.5	37.3 Å²	37.3	35%	0.35	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	147.3	-177.8	1.3	-175.4	-178.4	-178.2	0	112.6	A2578 A2729 D2803	A2578-K2712 PolarHBondContact O-NZ 2.93Å; K2712-A2729 VanDerWaalsContact CA-O 3.28Å; K2712-A2729 WeakPolarHBondContact CA-O 3.34Å; K2712-D2803 PolarHBondContact N-OD2 2.87Å; K2712-D2803 VanDerWaalsContact N-OD2 3.11Å; K2712-D2803 PolarHBondContact O-N 2.91Å
2713	F	88.4	Confident	78.5	Confident	4 Å²	4	38 Å²	38	2%	0.018	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	164.5	165.5	72	-94.4	0	0	0	111.4	M2704 L2706 A2729 V2731 W2736 L2758 F2764 T2801 V2804	M2704-F2713 HydrophobicContact CE-CD2 3.87Å; M2704-F2713 HydrophobicContact CE-CE2 3.81Å; M2704-F2713 VanDerWaalsContact CE-CE2 3.49Å; M2704-F2713 HydrophobicContact CE-CG 4.49Å; M2704-F2713 HydrophobicContact CE-CZ 3.98Å; L2706-F2713 HydrophobicContact CD2-CD1 4.03Å; L2706-F2713 HydrophobicContact CD2-CE1 4.16Å; F2713-A2729 HydrophobicContact CD1-CB 3.96Å; F2713-A2729 HydrophobicContact CD2-CB 4.17Å; F2713-A2729 HydrophobicContact CE1-CB 3.61Å; F2713-A2729 HydrophobicContact CE2-CB 3.82Å; F2713-A2729 HydrophobicContact CG-CB 4.23Å; F2713-A2729 HydrophobicContact CZ-CB 3.53Å; F2713-A2729 VanDerWaalsContact CZ-CB 3.49Å; F2713-A2729 PolarHBondContact N-O 3.13Å; F2713-A2729 PolarHBondContact O-N 3.1Å; F2713-V2731 HydrophobicContact CD1-CG2 3.98Å; F2713-V2731 HydrophobicContact CE1-CG2 4.29Å; F2713-W2736 HydrophobicContact CE1-CH2 4.37Å; F2713-W2736 HydrophobicContact CE1-CZ2 4.26Å; F2713-W2736 HydrophobicContact CE2-CH2 4.35Å; F2713-W2736 AromaticContact CZ-CH2 3.67Å; F2713-W2736 HydrophobicContact CZ-CH2 3.67Å; F2713-W2736 AromaticContact CZ-CZ2 3.88Å; F2713-W2736 HydrophobicContact CZ-CZ2 3.88Å; F2713-W2736 HydrophobicContact CZ-CZ3 4.36Å; F2713-L2758 HydrophobicContact CE1-CD1 4.11Å; F2713-L2758 HydrophobicContact CZ-CD1 4.44Å; F2713-F2764 HydrophobicContact CZ-CE2 4.46Å; F2713-F2764 HydrophobicContact CZ-CZ 4.5Å; F2713-T2801 CarbonylContact C-O 3.55Å; F2713-T2801 VanDerWaalsContact CA-O 3.23Å; F2713-T2801 WeakPolarHBondContact CA-O 3.13Å; F2713-T2801 VanDerWaalsContact CB-O 3.29Å; F2713-T2801 WeakPolarHBondContact CB-O 3.42Å; F2713-V2804 HydrophobicContact CB-CB 4.42Å; F2713-V2804 HydrophobicContact CB-CG1 3.7Å; F2713-V2804 HydrophobicContact CB-CG2 3.9Å; F2713-V2804 HydrophobicContact CD1-CG1 3.72Å; F2713-V2804 HydrophobicContact CD2-CG1 4.29Å; F2713-V2804 HydrophobicContact CE1-CG1 4.39Å; F2713-V2804 HydrophobicContact CG-CG1 3.66Å; F2713-V2804 HydrophobicContact CG-CG2 4.44Å
2714	G	88.2	Confident	78.4	Confident	1.5 Å²	1.5	38.5 Å²	38.5	2%	0.015	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145	150.5	178.4	0	0	0	0	0	112.7	L2727 V2800 T2801	G2714-L2727 CarbonylContact C-O 3.57Å; G2714-L2727 VanDerWaalsContact CA-O 3.23Å; G2714-L2727 WeakPolarHBondContact CA-O 3.48Å; G2714-V2800 WeakPolarHBondContact O-CA 3.26Å; G2714-T2801 PolarHBondContact N-O 2.95Å; G2714-T2801 PolarHBondContact O-N 2.81Å
2715	V	88.7	Confident	78.6	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	120.4	171.3	-175.5	0	0	0	0	108.2	I2702 Q2726 L2727 L2766 I2768 V2798 V2799 V2800	I2702-V2715 HydrophobicContact CD1-CG1 3.97Å; I2702-V2715 HydrophobicContact CD1-CG2 4.45Å; V2715-Q2726 WeakPolarHBondContact O-CA 3.27Å; V2715-L2727 HydrophobicContact CB-CB 4.49Å; V2715-L2727 PolarHBondContact N-O 3.2Å; V2715-L2727 PolarHBondContact O-N 3.3Å; V2715-L2766 HydrophobicContact CB-CD2 4.47Å; V2715-L2766 HydrophobicContact CG2-CD2 3.71Å; V2715-I2768 HydrophobicContact CB-CD1 4.37Å; V2715-I2768 HydrophobicContact CG1-CD1 3.8Å; V2715-V2798 HydrophobicContact CG1-CG1 4.01Å; V2715-V2799 CarbonylContact C-O 3.55Å; V2715-V2799 WeakPolarHBondContact CA-O 3.4Å; V2715-V2800 HydrophobicContact CG1-CG2 4.41Å; V2715-V2800 HydrophobicContact CG2-CG1 4.46Å; V2715-V2800 HydrophobicContact CG2-CG2 4.26Å
2716	S	86.5	Confident	79	Confident	6.5 Å²	6.5	35.4 Å²	35.4	5%	0.045	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	137.8	-179	-50.6	0	0	0	0	110	W2725 V2798 V2799	S2716-W2725 CarbonylContact C-O 3.54Å; S2716-W2725 WeakPolarHBondContact CA-O 3.38Å; S2716-V2798 CarbonylContact O-C 3.48Å; S2716-V2798 WeakPolarHBondContact O-CA 3.3Å; S2716-V2799 PolarHBondContact N-O 2.94Å; S2716-V2799 PolarHBondContact O-N 3.34Å
2717	I	84	Confident	79.5	Confident	0.5 Å²	0.5	35.1 Å²	35.1	0%	0.003	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	108.3	-176.9	-56.4	176.3	0	0	0	108	I2700 M2719 W2725 I2768 I2770 L2795 R2797 V2798	I2700-I2717 HydrophobicContact CD1-CD1 3.71Å; I2700-I2717 HydrophobicContact CD1-CG1 4.35Å; I2717-M2719 HydrophobicContact CG2-CG 4.36Å; I2717-M2719 WeakPolarHBondContact O-CG 3.27Å; I2717-M2719 PolarHBondContact O-N 3.42Å; I2717-W2725 HydrophobicContact CB-CB 4.38Å; I2717-W2725 HydrophobicContact CB-CE3 4.26Å; I2717-W2725 HydrophobicContact CD1-CD2 4.31Å; I2717-W2725 HydrophobicContact CD1-CE3 3.65Å; I2717-W2725 HydrophobicContact CD1-CZ3 3.81Å; I2717-W2725 HydrophobicContact CG1-CE3 3.85Å; I2717-W2725 HydrophobicContact CG1-CZ3 4.23Å; I2717-W2725 PolarHBondContact N-O 3.06Å; I2717-W2725 PolarHBondContact O-N 3.22Å; I2717-I2768 HydrophobicContact CD1-CD1 4.15Å; I2717-I2768 HydrophobicContact CD1-CG2 4.27Å; I2717-I2770 HydrophobicContact CD1-CD1 3.81Å; I2717-L2795 HydrophobicContact CG2-CD2 3.86Å; I2717-R2797 CarbonylContact C-O 3.56Å; I2717-R2797 WeakPolarHBondContact CA-O 3.4Å; I2717-V2798 HydrophobicContact CD1-CG2 4.46Å; I2717-V2798 HydrophobicContact CG1-CG1 4.39Å; I2717-V2798 HydrophobicContact CG1-CG2 4.31Å; I2717-V2798 HydrophobicContact CG2-CG2 4.49Å
2718	K	75.8	Confident	80.3	Confident	50.5 Å²	50.5	35.9 Å²	35.9	22%	0.22	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	123.6	169.2	-175.7	175.2	-176.7	164.9	0	107.4	E2307 D2548 E2648 D2649 L2724 G2796 R2797	E2307-K2718 IonicContact OE1-NZ 2.61Å; D2548-K2718 IonicContact OD2-NZ 3.62Å; D2548-K2718 PolarHBondContact OD2-NZ 3.02Å; E2648-K2718 PolarHBondContact O-NZ 3.43Å; E2648-K2718 VanDerWaalsContact O-NZ 3.1Å; D2649-K2718 HydrophobicContact CB-CD 4.03Å; D2649-K2718 VanDerWaalsContact CG-CD 3.5Å; D2649-K2718 VanDerWaalsContact CG-NZ 3.32Å; D2649-K2718 WeakPolarHBondContact OD1-CE 3.39Å; D2649-K2718 IonicContact OD1-NZ 2.81Å; D2649-K2718 PolarHBondContact OD1-NZ 3.02Å; D2649-K2718 VanDerWaalsContact OD2-CD 3.32Å; D2649-K2718 WeakPolarHBondContact OD2-CD 3.3Å; D2649-K2718 IonicContact OD2-NZ 2.72Å; K2718-L2724 HydrophobicContact CB-CD1 4.26Å; K2718-G2796 CarbonylContact O-C 3.54Å; K2718-G2796 WeakPolarHBondContact O-CA 3.47Å; K2718-G2796 PolarHBondContact O-N 3.12Å; K2718-R2797 HydrophobicContact CB-CB 4.17Å; K2718-R2797 PolarHBondContact N-O 2.66Å; K2718-R2797 PolarHBondContact O-N 3.26Å
2719	M	76.2	Confident	81.3	Confident	6.5 Å²	6.5	31.7 Å²	31.7	3%	0.032	15%	0.153	C	C	.	.			trans	-102.6	-123.5	-177	-59	-159.5	77.7	0	0	109.6	I2717 V2723 W2725 I2770 V2790 P2791 G2792 S2794 L2795	I2717-M2719 HydrophobicContact CG2-CG 4.36Å; I2717-M2719 WeakPolarHBondContact O-CG 3.27Å; I2717-M2719 PolarHBondContact O-N 3.42Å; M2719-V2723 HydrophobicContact CB-CB 4.17Å; M2719-V2723 HydrophobicContact CB-CG1 3.97Å; M2719-V2723 HydrophobicContact CG-CG1 4.4Å; M2719-V2723 PolarHBondContact N-O 3.02Å; M2719-V2723 HydrophobicContact SD-CG1 4.39Å; M2719-W2725 HydrophobicContact CG-CB 4.32Å; M2719-W2725 HydrophobicContact SD-CB 3.91Å; M2719-I2770 HydrophobicContact CE-CG2 4.19Å; M2719-V2790 HydrophobicContact CE-CG1 3.4Å; M2719-V2790 VanDerWaalsContact CE-CG1 3.44Å; M2719-V2790 HydrophobicContact SD-CG1 3.53Å; M2719-V2790 WeakPolarHBondContact SD-CG1 3.2Å; M2719-P2791 HydrophobicContact SD-CG 3.84Å; M2719-G2792 VanDerWaalsContact CE-C 3.5Å; M2719-G2792 VanDerWaalsContact CE-O 3.29Å; M2719-G2792 WeakPolarHBondContact CE-O 3.07Å; M2719-S2794 CarbonylContact C-O 3.31Å; M2719-S2794 VanDerWaalsContact C-O 3.25Å; M2719-S2794 WeakPolarHBondContact CA-O 3.47Å; M2719-S2794 WeakPolarHBondContact CB-O 3.24Å; M2719-L2795 HydrophobicContact CE-CD2 3.54Å; M2719-L2795 VanDerWaalsContact CE-CD2 3.46Å; M2719-L2795 HydrophobicContact CE-CG 4.35Å; M2719-L2795 HydrophobicContact CG-CD2 4.37Å
2720	D	69.3	Low	82.1	Confident	26 Å²	26	27.4 Å²	27.4	14%	0.139	14%	0.14	C	C	.	.	S	Bend	trans	-65.1	167.9	166.8	-54.7	-42.9	0	0	0	111.5	H2722 V2723 G2792 R2793 S2794	D2720-H2722 PolarHBondContact O-N 2.97Å; D2720-V2723 HydrophobicContact CB-CB 4.4Å; D2720-V2723 HydrophobicContact CB-CG2 4.31Å; D2720-V2723 WeakPolarHBondContact O-CA 3.48Å; D2720-V2723 WeakPolarHBondContact O-CB 3.49Å; D2720-V2723 PolarHBondContact O-N 3.22Å; D2720-G2792 WeakPolarHBondContact OD2-CA 3.36Å; D2720-R2793 PolarHBondContact OD1-N 2.98Å; D2720-R2793 PolarHBondContact OD2-N 3.22Å; D2720-S2794 WeakPolarHBondContact OD1-CA 3.34Å; D2720-S2794 VanDerWaalsContact OD1-CB 3.26Å; D2720-S2794 WeakPolarHBondContact OD1-CB 3.32Å; D2720-S2794 PolarHBondContact OD1-N 3.34Å; D2720-S2794 PolarHBondContact OD1-OG 3.02Å
2721	L	57.5	Low	82.6	Confident	97.5 Å²	97.5	28.8 Å²	28.8	51%	0.51	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-39.5	124.8	163.4	-93.5	158.4	0	0	0	111.4	E2307 V2723	E2307-L2721 HydrophobicContact CG-CD1 4.4Å; E2307-L2721 WeakPolarHBondContact OE2-CA 3.39Å; E2307-L2721 WeakPolarHBondContact OE2-CG 3.41Å; E2307-L2721 PolarHBondContact OE2-N 3.31Å; L2721-V2723 PolarHBondContact O-N 3.32Å
2722	H	63.9	Low	82.7	Confident	95 Å²	95	32.8 Å²	32.8	44%	0.44	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	66.5	10.3	176.9	-46	-55	0	0	0	116.5	N2570 D2720 I2742 N2743	N2570-H2722 VanDerWaalsContact CG-ND1 3.33Å; N2570-H2722 WeakPolarHBondContact ND2-CA 3.36Å; N2570-H2722 VanDerWaalsContact ND2-CB 3.31Å; N2570-H2722 WeakPolarHBondContact ND2-CB 3.39Å; N2570-H2722 PolarHBondContact ND2-O 3.11Å; N2570-H2722 PolarHBondContact OD1-ND1 3.26Å; D2720-H2722 PolarHBondContact O-N 2.97Å; H2722-I2742 WeakPolarHBondContact O-CA 3.48Å; H2722-N2743 VanDerWaalsContact CB-OD1 3.3Å; H2722-N2743 WeakPolarHBondContact CB-OD1 3.3Å; H2722-N2743 PolarHBondContact O-N 3.42Å; H2722-N2743 VanDerWaalsContact O-N 3.09Å
2723	V	72.5	Confident	82.8	Confident	14 Å²	14	32.5 Å²	32.5	9%	0.085	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	126.8	177.6	-177.5	0	0	0	0	112	M2719 D2720 L2721 Y2741 I2742 P2791	M2719-V2723 HydrophobicContact CB-CB 4.17Å; M2719-V2723 HydrophobicContact CB-CG1 3.97Å; M2719-V2723 HydrophobicContact CG-CG1 4.4Å; M2719-V2723 PolarHBondContact N-O 3.02Å; M2719-V2723 HydrophobicContact SD-CG1 4.39Å; D2720-V2723 HydrophobicContact CB-CB 4.4Å; D2720-V2723 HydrophobicContact CB-CG2 4.31Å; D2720-V2723 WeakPolarHBondContact O-CA 3.48Å; D2720-V2723 WeakPolarHBondContact O-CB 3.49Å; D2720-V2723 PolarHBondContact O-N 3.22Å; L2721-V2723 PolarHBondContact O-N 3.32Å; V2723-Y2741 WeakPolarHBondContact CA-O 3.37Å; V2723-I2742 HydrophobicContact CG2-CG2 4.5Å; V2723-P2791 HydrophobicContact CG1-CB 4.03Å; V2723-P2791 HydrophobicContact CG1-CG 3.64Å; V2723-P2791 VanDerWaalsContact CG1-CG 3.49Å
2724	L	80.8	Confident	82.9	Confident	24 Å²	24	35.2 Å²	35.2	13%	0.126	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	125.9	173.8	-174.6	78.3	0	0	0	110.1	L2651 A2653 K2718 S2740 Y2741	L2651-L2724 HydrophobicContact CD2-CD1 3.33Å; L2651-L2724 HydrophobicContact CD2-CD2 3.66Å; L2651-L2724 HydrophobicContact CD2-CG 4.14Å; A2653-L2724 HydrophobicContact CB-CD2 3.96Å; K2718-L2724 HydrophobicContact CB-CD1 4.26Å; L2724-S2740 CarbonylContact O-C 3.53Å; L2724-S2740 VanDerWaalsContact O-CA 3.25Å; L2724-S2740 WeakPolarHBondContact O-CA 3.33Å; L2724-Y2741 HydrophobicContact CD2-CD2 4.31Å; L2724-Y2741 PolarHBondContact N-O 3.1Å; L2724-Y2741 PolarHBondContact O-N 3.13Å
2725	W	89.1	Confident	83.1	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	137.1	164	178.3	106.7	0	0	0	108.6	S2716 I2717 M2719 L2727 L2738 I2768 S2775 V2777 Y2788 P2791	S2716-W2725 CarbonylContact C-O 3.54Å; S2716-W2725 WeakPolarHBondContact CA-O 3.38Å; I2717-W2725 HydrophobicContact CB-CB 4.38Å; I2717-W2725 HydrophobicContact CB-CE3 4.26Å; I2717-W2725 HydrophobicContact CD1-CD2 4.31Å; I2717-W2725 HydrophobicContact CD1-CE3 3.65Å; I2717-W2725 HydrophobicContact CD1-CZ3 3.81Å; I2717-W2725 HydrophobicContact CG1-CE3 3.85Å; I2717-W2725 HydrophobicContact CG1-CZ3 4.23Å; I2717-W2725 PolarHBondContact N-O 3.06Å; I2717-W2725 PolarHBondContact O-N 3.22Å; M2719-W2725 HydrophobicContact CG-CB 4.32Å; M2719-W2725 HydrophobicContact SD-CB 3.91Å; W2725-L2727 HydrophobicContact CH2-CB 3.82Å; W2725-L2727 HydrophobicContact CZ3-CB 3.8Å; W2725-L2738 HydrophobicContact CD2-CD2 4.48Å; W2725-L2738 HydrophobicContact CH2-CD2 3.63Å; W2725-L2738 HydrophobicContact CZ2-CD2 3.22Å; W2725-L2738 HydrophobicContact CZ3-CD2 4.42Å; W2725-I2768 HydrophobicContact CH2-CD1 3.74Å; W2725-I2768 HydrophobicContact CH2-CG1 4.12Å; W2725-I2768 HydrophobicContact CH2-CG2 3.66Å; W2725-I2768 HydrophobicContact CZ2-CG2 3.78Å; W2725-I2768 HydrophobicContact CZ3-CD1 3.83Å; W2725-I2768 HydrophobicContact CZ3-CG2 4.35Å; W2725-S2775 PolarHBondContact NE1-OG 3.09Å; W2725-S2775 VanDerWaalsContact NE1-OG 3.07Å; W2725-V2777 HydrophobicContact CH2-CG2 4.06Å; W2725-V2777 HydrophobicContact CZ2-CG2 4.06Å; W2725-Y2788 AromaticContact CD1-CD1 3.91Å; W2725-Y2788 AromaticContact CD1-CE1 3.85Å; W2725-Y2788 AromaticContact NE1-CD1 3.66Å; W2725-Y2788 AromaticContact NE1-CE1 3.87Å; W2725-P2791 HydrophobicContact CB-CG 4.39Å
2726	Q	90	Very high	83.3	Confident	10.5 Å²	10.5	39.2 Å²	39.2	5%	0.049	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	132.8	-179.3	-174.8	-180	36.9	0	0	112.2	A2653 V2715 V2728 L2738 S2739 Y2741	A2653-Q2726 PolarHBondContact O-NE2 2.94Å; A2653-Q2726 PolarHBondContact O-OE1 2.81Å; V2715-Q2726 WeakPolarHBondContact O-CA 3.27Å; Q2726-V2728 HydrophobicContact CG-CG2 3.92Å; Q2726-L2738 CarbonylContact O-C 3.53Å; Q2726-L2738 WeakPolarHBondContact O-CA 3.36Å; Q2726-S2739 PolarHBondContact N-O 3.35Å; Q2726-S2739 PolarHBondContact O-N 3.25Å; Q2726-S2739 PolarHBondContact O-OG 2.86Å; Q2726-Y2741 HydrophobicContact CB-CE2 4.49Å; Q2726-Y2741 VanDerWaalsContact OE1-CE2 3.23Å
2727	L	92.7	Very high	83.6	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	130.8	163.1	175.6	66.9	0	0	0	109	G2714 V2715 W2725 W2736 I2737 L2738 F2752 L2766 V2777	G2714-L2727 CarbonylContact C-O 3.57Å; G2714-L2727 VanDerWaalsContact CA-O 3.23Å; G2714-L2727 WeakPolarHBondContact CA-O 3.48Å; V2715-L2727 HydrophobicContact CB-CB 4.49Å; V2715-L2727 PolarHBondContact N-O 3.2Å; V2715-L2727 PolarHBondContact O-N 3.3Å; W2725-L2727 HydrophobicContact CH2-CB 3.82Å; W2725-L2727 HydrophobicContact CZ3-CB 3.8Å; L2727-W2736 HydrophobicContact CD1-CB 4.46Å; L2727-W2736 HydrophobicContact CD1-CE3 4.05Å; L2727-W2736 HydrophobicContact CD2-CE3 4.16Å; L2727-W2736 HydrophobicContact CD2-CZ3 4.12Å; L2727-I2737 CarbonylContact C-O 3.56Å; L2727-I2737 WeakPolarHBondContact CA-O 3.24Å; L2727-L2738 HydrophobicContact CB-CD2 3.89Å; L2727-L2738 HydrophobicContact CD1-CD2 3.82Å; L2727-L2738 HydrophobicContact CD1-CG 3.98Å; L2727-L2738 HydrophobicContact CG-CD2 4.43Å; L2727-F2752 HydrophobicContact CD1-CE1 4.24Å; L2727-F2752 HydrophobicContact CD1-CZ 4.12Å; L2727-L2766 HydrophobicContact CD2-CD1 4.43Å; L2727-L2766 HydrophobicContact CD2-CD2 4.24Å; L2727-V2777 HydrophobicContact CD2-CG1 4.16Å; L2727-V2777 HydrophobicContact CD2-CG2 4.41Å
2728	V	91.7	Very high	84.1	Confident	37.5 Å²	37.5	40.8 Å²	40.8	23%	0.227	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	123.8	168.7	-175.9	0	0	0	0	108.7	F2654 Q2726 W2736 I2737	F2654-V2728 HydrophobicContact CE1-CG1 3.87Å; F2654-V2728 HydrophobicContact CE1-CG2 4.07Å; F2654-V2728 HydrophobicContact CZ-CG1 4.07Å; F2654-V2728 HydrophobicContact CZ-CG2 3.81Å; Q2726-V2728 HydrophobicContact CG-CG2 3.92Å; V2728-W2736 CarbonylContact O-C 3.58Å; V2728-W2736 WeakPolarHBondContact O-CA 3.45Å; V2728-I2737 PolarHBondContact N-O 3.06Å; V2728-I2737 PolarHBondContact O-N 3.2Å
2729	A	91.5	Very high	84.8	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	117.3	-178.5	0	0	0	0	0	110.3	K2712 F2713 W2736	K2712-A2729 VanDerWaalsContact CA-O 3.28Å; K2712-A2729 WeakPolarHBondContact CA-O 3.34Å; F2713-A2729 HydrophobicContact CD1-CB 3.96Å; F2713-A2729 HydrophobicContact CD2-CB 4.17Å; F2713-A2729 HydrophobicContact CE1-CB 3.61Å; F2713-A2729 HydrophobicContact CE2-CB 3.82Å; F2713-A2729 HydrophobicContact CG-CB 4.23Å; F2713-A2729 HydrophobicContact CZ-CB 3.53Å; F2713-A2729 VanDerWaalsContact CZ-CB 3.49Å; F2713-A2729 PolarHBondContact N-O 3.13Å; F2713-A2729 PolarHBondContact O-N 3.1Å; A2729-W2736 HydrophobicContact CB-CD2 3.6Å; A2729-W2736 VanDerWaalsContact CB-CE2 3.47Å; A2729-W2736 HydrophobicContact CB-CE3 4.07Å; A2729-W2736 HydrophobicContact CB-CG 3.94Å; A2729-W2736 HydrophobicContact CB-CH2 4.36Å; A2729-W2736 HydrophobicContact CB-CZ2 3.94Å; A2729-W2736 HydrophobicContact CB-CZ3 4.33Å
2730	N	91.4	Very high	85.3	Confident	43 Å²	43	38.2 Å²	38.2	23%	0.23	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	116.9	168.6	-172.9	-28.6	0	0	0	108.8	D2711 K2732 T2733 N2734 E2735	D2711-N2730 PolarHBondContact O-OD1 3.3Å; N2730-K2732 PolarHBondContact OD1-N 3.1Å; N2730-K2732 VanDerWaalsContact OD1-N 3.1Å; N2730-T2733 WeakPolarHBondContact CB-OG1 3.22Å; N2730-T2733 PolarHBondContact ND2-OG1 3.41Å; N2730-T2733 VanDerWaalsContact ND2-OG1 3.09Å; N2730-T2733 PolarHBondContact OD1-N 3.18Å; N2730-T2733 VanDerWaalsContact OD1-N 3.15Å; N2730-T2733 PolarHBondContact OD1-OG1 2.88Å; N2730-N2734 VanDerWaalsContact O-CA 3.29Å; N2730-N2734 WeakPolarHBondContact O-CA 3.41Å; N2730-N2734 PolarHBondContact O-N 3.29Å; N2730-N2734 VanDerWaalsContact O-N 3.13Å; N2730-E2735 VanDerWaalsContact CB-O 3.3Å; N2730-E2735 WeakPolarHBondContact CB-O 3.31Å; N2730-E2735 PolarHBondContact N-O 2.88Å; N2730-E2735 PolarHBondContact O-N 2.9Å
2731	V	87.2	Confident	85.9	Confident	42 Å²	42	38.5 Å²	38.5	26%	0.255	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-34.5	-175.8	-175.9	0	0	0	0	110.7	L2706 A2710 D2711 F2713	L2706-V2731 HydrophobicContact CD1-CG1 3.87Å; L2706-V2731 HydrophobicContact CD2-CG1 4.29Å; L2706-V2731 HydrophobicContact CD2-CG2 3.84Å; A2710-V2731 HydrophobicContact CB-CG2 4.33Å; A2710-V2731 WeakPolarHBondContact O-CB 3.34Å; D2711-V2731 PolarHBondContact O-N 2.94Å; F2713-V2731 HydrophobicContact CD1-CG2 3.98Å; F2713-V2731 HydrophobicContact CE1-CG2 4.29Å
2732	K	84.9	Confident	86.8	Confident	148.5 Å²	148.5	35.9 Å²	35.9	65%	0.646	18%	0.181	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-44	-178.6	-78.9	176.7	167.2	164.6	0	113.4	D2711 N2730 N2734	D2711-K2732 HydrophobicContact CB-CD 4.5Å; D2711-K2732 WeakPolarHBondContact OD1-CE 3.29Å; D2711-K2732 IonicContact OD1-NZ 3.36Å; D2711-K2732 PolarHBondContact OD1-NZ 3.16Å; D2711-K2732 IonicContact OD2-NZ 2.77Å; D2711-K2732 PolarHBondContact OD2-NZ 2.98Å; N2730-K2732 PolarHBondContact OD1-N 3.1Å; N2730-K2732 VanDerWaalsContact OD1-N 3.1Å; K2732-N2734 VanDerWaalsContact C-N 3.33Å
2733	T	89.3	Confident	87	Confident	76 Å²	76	35.6 Å²	35.6	47%	0.466	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-8.7	178.8	65.2	0	0	0	0	113.3	N2730 E2735	N2730-T2733 WeakPolarHBondContact CB-OG1 3.22Å; N2730-T2733 PolarHBondContact ND2-OG1 3.41Å; N2730-T2733 VanDerWaalsContact ND2-OG1 3.09Å; N2730-T2733 PolarHBondContact OD1-N 3.18Å; N2730-T2733 VanDerWaalsContact OD1-N 3.15Å; N2730-T2733 PolarHBondContact OD1-OG1 2.88Å; T2733-E2735 PolarHBondContact O-N 3.12Å; T2733-E2735 VanDerWaalsContact OG1-CB 3.28Å; T2733-E2735 WeakPolarHBondContact OG1-CB 3.36Å; T2733-E2735 PolarHBondContact OG1-N 3.14Å
2734	N	90.2	Very high	86.6	Confident	60 Å²	60	36.5 Å²	36.5	32%	0.321	20%	0.196	S	C	.	.			trans	53.9	24.4	-168.6	-164.8	35.5	0	0	0	113.8	N2730 K2732 K2753 N2754	N2730-N2734 VanDerWaalsContact O-CA 3.29Å; N2730-N2734 WeakPolarHBondContact O-CA 3.41Å; N2730-N2734 PolarHBondContact O-N 3.29Å; N2730-N2734 VanDerWaalsContact O-N 3.13Å; K2732-N2734 VanDerWaalsContact C-N 3.33Å; N2734-K2753 WeakPolarHBondContact O-CA 3.42Å; N2734-N2754 PolarHBondContact ND2-O 3.3Å; N2734-N2754 WeakPolarHBondContact OD1-CB 3.32Å; N2734-N2754 PolarHBondContact OD1-ND2 3.19Å; N2734-N2754 PolarHBondContact OD1-O 3.15Å
2735	E	91.6	Very high	86.2	Confident	83.5 Å²	83.5	38.3 Å²	38.3	39%	0.39	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	125.7	176.8	-169.1	-177.7	-175.2	0	0	110.7	N2730 T2733 S2751	N2730-E2735 VanDerWaalsContact CB-O 3.3Å; N2730-E2735 WeakPolarHBondContact CB-O 3.31Å; N2730-E2735 PolarHBondContact N-O 2.88Å; N2730-E2735 PolarHBondContact O-N 2.9Å; T2733-E2735 PolarHBondContact O-N 3.12Å; T2733-E2735 VanDerWaalsContact OG1-CB 3.28Å; T2733-E2735 WeakPolarHBondContact OG1-CB 3.36Å; T2733-E2735 PolarHBondContact OG1-N 3.14Å; E2735-S2751 WeakPolarHBondContact CG-OG 3.33Å; E2735-S2751 PolarHBondContact OE1-OG 3.41Å
2736	W	94.1	Very high	85.8	Confident	2 Å²	2	41.5 Å²	41.5	1%	0.008	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	128	-175.5	-71.1	43	0	0	0	108.7	F2713 L2727 V2728 A2729 S2751 F2752 N2754 L2758 L2766 L2779	F2713-W2736 HydrophobicContact CE1-CH2 4.37Å; F2713-W2736 HydrophobicContact CE1-CZ2 4.26Å; F2713-W2736 HydrophobicContact CE2-CH2 4.35Å; F2713-W2736 AromaticContact CZ-CH2 3.67Å; F2713-W2736 HydrophobicContact CZ-CH2 3.67Å; F2713-W2736 AromaticContact CZ-CZ2 3.88Å; F2713-W2736 HydrophobicContact CZ-CZ2 3.88Å; F2713-W2736 HydrophobicContact CZ-CZ3 4.36Å; L2727-W2736 HydrophobicContact CD1-CB 4.46Å; L2727-W2736 HydrophobicContact CD1-CE3 4.05Å; L2727-W2736 HydrophobicContact CD2-CE3 4.16Å; L2727-W2736 HydrophobicContact CD2-CZ3 4.12Å; V2728-W2736 CarbonylContact O-C 3.58Å; V2728-W2736 WeakPolarHBondContact O-CA 3.45Å; A2729-W2736 HydrophobicContact CB-CD2 3.6Å; A2729-W2736 VanDerWaalsContact CB-CE2 3.47Å; A2729-W2736 HydrophobicContact CB-CE3 4.07Å; A2729-W2736 HydrophobicContact CB-CG 3.94Å; A2729-W2736 HydrophobicContact CB-CH2 4.36Å; A2729-W2736 HydrophobicContact CB-CZ2 3.94Å; A2729-W2736 HydrophobicContact CB-CZ3 4.33Å; W2736-S2751 CarbonylContact O-C 3.47Å; W2736-S2751 WeakPolarHBondContact O-CA 3.37Å; W2736-F2752 HydrophobicContact CB-CD1 4.15Å; W2736-F2752 HydrophobicContact CB-CD2 4.17Å; W2736-F2752 HydrophobicContact CB-CE1 3.7Å; W2736-F2752 HydrophobicContact CB-CE2 3.74Å; W2736-F2752 HydrophobicContact CB-CG 4.36Å; W2736-F2752 HydrophobicContact CB-CZ 3.49Å; W2736-F2752 VanDerWaalsContact CB-CZ 3.49Å; W2736-F2752 HydrophobicContact CD2-CE2 4.45Å; W2736-F2752 HydrophobicContact CD2-CZ 4.43Å; W2736-F2752 HydrophobicContact CE3-CE2 4.2Å; W2736-F2752 AromaticContact CE3-CZ 3.98Å; W2736-F2752 HydrophobicContact CE3-CZ 3.99Å; W2736-F2752 HydrophobicContact CG-CE2 4.3Å; W2736-F2752 HydrophobicContact CG-CZ 4.3Å; W2736-F2752 PolarHBondContact N-O 3.18Å; W2736-F2752 WeakPolarHBondContact O-CD1 3.37Å; W2736-F2752 WeakPolarHBondContact O-CE1 3.21Å; W2736-F2752 PolarHBondContact O-N 2.9Å; W2736-N2754 HydrophobicContact CD2-CB 3.89Å; W2736-N2754 VanDerWaalsContact CE2-CB 3.49Å; W2736-N2754 HydrophobicContact CG-CB 4.14Å; W2736-N2754 HydrophobicContact CZ2-CB 3.98Å; W2736-L2758 HydrophobicContact CH2-CD1 4.43Å; W2736-L2758 HydrophobicContact CZ2-CD1 3.96Å; W2736-L2766 HydrophobicContact CH2-CD1 4.26Å; W2736-L2766 HydrophobicContact CZ3-CD1 4.02Å; W2736-L2779 HydrophobicContact CH2-CD1 3.67Å; W2736-L2779 HydrophobicContact CH2-CD2 4.39Å; W2736-L2779 HydrophobicContact CH2-CG 4.27Å; W2736-L2779 HydrophobicContact CZ2-CD1 4.17Å; W2736-L2779 HydrophobicContact CZ3-CD1 4.38Å
2737	I	93.1	Very high	85.3	Confident	40.5 Å²	40.5	45.8 Å²	45.8	21%	0.208	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	124.4	-174.6	-59.3	174.5	0	0	0	108.9	L2727 V2728 K2749 V2750	L2727-I2737 CarbonylContact C-O 3.56Å; L2727-I2737 WeakPolarHBondContact CA-O 3.24Å; V2728-I2737 PolarHBondContact N-O 3.06Å; V2728-I2737 PolarHBondContact O-N 3.2Å; I2737-K2749 HydrophobicContact CG2-CG 3.8Å; I2737-V2750 WeakPolarHBondContact CA-O 3.29Å
2738	L	93.3	Very high	84.8	Confident	0 Å²	0	50 Å²	50	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	139.2	163.5	-75.4	164.3	0	0	0	109.6	W2725 Q2726 L2727 K2749 V2750 F2752 V2777 Y2788	W2725-L2738 HydrophobicContact CD2-CD2 4.48Å; W2725-L2738 HydrophobicContact CH2-CD2 3.63Å; W2725-L2738 HydrophobicContact CZ2-CD2 3.22Å; W2725-L2738 HydrophobicContact CZ3-CD2 4.42Å; Q2726-L2738 CarbonylContact O-C 3.53Å; Q2726-L2738 WeakPolarHBondContact O-CA 3.36Å; L2727-L2738 HydrophobicContact CB-CD2 3.89Å; L2727-L2738 HydrophobicContact CD1-CD2 3.82Å; L2727-L2738 HydrophobicContact CD1-CG 3.98Å; L2727-L2738 HydrophobicContact CG-CD2 4.43Å; L2738-K2749 CarbonylContact O-C 3.56Å; L2738-K2749 WeakPolarHBondContact O-CA 3.39Å; L2738-V2750 PolarHBondContact N-O 2.93Å; L2738-V2750 PolarHBondContact O-N 2.95Å; L2738-F2752 HydrophobicContact CD1-CE1 3.86Å; L2738-F2752 HydrophobicContact CD1-CZ 4.47Å; L2738-F2752 HydrophobicContact CG-CE1 3.94Å; L2738-V2777 HydrophobicContact CD1-CG2 4.32Å; L2738-V2777 HydrophobicContact CD2-CG2 4.25Å; L2738-Y2788 HydrophobicContact CB-CD2 3.41Å; L2738-Y2788 VanDerWaalsContact CB-CD2 3.41Å; L2738-Y2788 HydrophobicContact CB-CE2 3.46Å; L2738-Y2788 VanDerWaalsContact CB-CE2 3.46Å; L2738-Y2788 HydrophobicContact CB-CG 4.09Å; L2738-Y2788 HydrophobicContact CD1-CD2 3.99Å; L2738-Y2788 HydrophobicContact CD1-CG 4.07Å; L2738-Y2788 HydrophobicContact CG-CD2 4.27Å
2739	S	90.8	Very high	84.7	Confident	1.5 Å²	1.5	53.9 Å²	53.9	1%	0.01	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	154.5	-177.6	57.3	0	0	0	0	111.6	Q2726 E2746 Y2788	Q2726-S2739 PolarHBondContact N-O 3.35Å; Q2726-S2739 PolarHBondContact O-N 3.25Å; Q2726-S2739 PolarHBondContact O-OG 2.86Å; S2739-E2746 VanDerWaalsContact CB-OE1 3.3Å; S2739-E2746 WeakPolarHBondContact CB-OE1 3.49Å; S2739-Y2788 VanDerWaalsContact CA-OH 3.26Å; S2739-Y2788 WeakPolarHBondContact CA-OH 3.38Å
2740	S	86.5	Confident	84.6	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	115	178.3	-68.7	0	0	0	0	109.7	L2724 K2747 Y2788 P2791	L2724-S2740 CarbonylContact O-C 3.53Å; L2724-S2740 VanDerWaalsContact O-CA 3.25Å; L2724-S2740 WeakPolarHBondContact O-CA 3.33Å; S2740-K2747 PolarHBondContact N-O 3.45Å; S2740-K2747 WeakPolarHBondContact O-CA 3.46Å; S2740-K2747 PolarHBondContact O-N 3.06Å; S2740-Y2788 WeakPolarHBondContact CB-OH 3.38Å; S2740-Y2788 PolarHBondContact N-OH 3.32Å; S2740-Y2788 WeakPolarHBondContact OG-CE1 3.18Å; S2740-Y2788 PolarHBondContact OG-OH 2.81Å; S2740-P2791 WeakPolarHBondContact OG-CD 3.32Å; S2740-P2791 WeakPolarHBondContact OG-CG 3.28Å
2741	Y	81.6	Confident	84.6	Confident	32 Å²	32	57.3 Å²	57.3	13%	0.125	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	116.7	171.8	-64.1	-104.4	0	0	0	108.8	I2574 A2653 V2723 L2724 Q2726 T2745 E2746	I2574-Y2741 HydrophobicContact CB-CD1 4.49Å; I2574-Y2741 HydrophobicContact CB-CE1 4.48Å; I2574-Y2741 HydrophobicContact CD1-CD1 3.54Å; I2574-Y2741 HydrophobicContact CD1-CE1 4.33Å; I2574-Y2741 HydrophobicContact CD1-CG 3.93Å; I2574-Y2741 HydrophobicContact CG1-CD1 3.82Å; I2574-Y2741 HydrophobicContact CG1-CE1 4.22Å; I2574-Y2741 HydrophobicContact CG2-CD1 3.82Å; I2574-Y2741 HydrophobicContact CG2-CE1 3.48Å; I2574-Y2741 VanDerWaalsContact CG2-CE1 3.48Å; A2653-Y2741 HydrophobicContact CB-CD1 4.45Å; A2653-Y2741 HydrophobicContact CB-CD2 4.03Å; A2653-Y2741 HydrophobicContact CB-CE1 4.03Å; A2653-Y2741 HydrophobicContact CB-CE2 3.6Å; A2653-Y2741 HydrophobicContact CB-CG 4.45Å; A2653-Y2741 PolarHBondContact O-OH 2.83Å; V2723-Y2741 WeakPolarHBondContact CA-O 3.37Å; L2724-Y2741 HydrophobicContact CD2-CD2 4.31Å; L2724-Y2741 PolarHBondContact N-O 3.1Å; L2724-Y2741 PolarHBondContact O-N 3.13Å; Q2726-Y2741 HydrophobicContact CB-CE2 4.49Å; Q2726-Y2741 VanDerWaalsContact OE1-CE2 3.23Å; Y2741-T2745 WeakPolarHBondContact CA-O 3.46Å; Y2741-E2746 HydrophobicContact CD1-CB 4.05Å; Y2741-E2746 HydrophobicContact CE1-CB 3.65Å; Y2741-E2746 HydrophobicContact CE1-CG 4.15Å; Y2741-E2746 HydrophobicContact CE2-CG 4.2Å
2742	I	76.2	Confident	84.9	Confident	44 Å²	44	56.4 Å²	56.4	23%	0.226	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	123.7	175.8	-56.4	177.6	0	0	0	106.9	H2722 V2723 G2744 T2745 K2747 P2791	H2722-I2742 WeakPolarHBondContact O-CA 3.48Å; V2723-I2742 HydrophobicContact CG2-CG2 4.5Å; I2742-G2744 VanDerWaalsContact C-N 3.27Å; I2742-G2744 PolarHBondContact O-N 3.22Å; I2742-T2745 PolarHBondContact N-O 2.92Å; I2742-T2745 WeakPolarHBondContact O-CB 3.24Å; I2742-T2745 PolarHBondContact O-N 2.71Å; I2742-K2747 HydrophobicContact CB-CD 4.46Å; I2742-K2747 HydrophobicContact CD1-CD 4.08Å; I2742-P2791 HydrophobicContact CD1-CB 3.74Å; I2742-P2791 HydrophobicContact CD1-CG 3.74Å; I2742-P2791 HydrophobicContact CG1-CB 4.19Å; I2742-P2791 HydrophobicContact CG1-CG 4.05Å
2743	N	68.2	Low	85.2	Confident	88.5 Å²	88.5	57.1 Å²	57.1	47%	0.473	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.2	45.3	-175.5	-63.5	-1.5	0	0	0	112.1	N2570 H2722 T2745	N2570-N2743 WeakPolarHBondContact ND2-CA 3.38Å; H2722-N2743 VanDerWaalsContact CB-OD1 3.3Å; H2722-N2743 WeakPolarHBondContact CB-OD1 3.3Å; H2722-N2743 PolarHBondContact O-N 3.42Å; H2722-N2743 VanDerWaalsContact O-N 3.09Å; N2743-T2745 PolarHBondContact O-N 3.06Å; N2743-T2745 PolarHBondContact O-OG1 3.35Å
2744	G	64.8	Low	85.1	Confident	34 Å²	34	53.8 Å²	53.8	35%	0.351	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.1	0.4	179.6	0	0	0	0	0	115.7	V2569 I2574 I2742	V2569-G2744 WeakPolarHBondContact O-CA 3.26Å; I2574-G2744 WeakPolarHBondContact CG1-O 3.18Å; I2742-G2744 VanDerWaalsContact C-N 3.27Å; I2742-G2744 PolarHBondContact O-N 3.22Å
2745	T	71.1	Confident	84.9	Confident	61.5 Å²	61.5	54.8 Å²	54.8	38%	0.377	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	125.6	-173.9	-51.7	0	0	0	0	110.7	R2572 Y2741 I2742 N2743 K2747	R2572-T2745 PolarHBondContact NH1-OG1 2.85Å; Y2741-T2745 WeakPolarHBondContact CA-O 3.46Å; I2742-T2745 PolarHBondContact N-O 2.92Å; I2742-T2745 WeakPolarHBondContact O-CB 3.24Å; I2742-T2745 PolarHBondContact O-N 2.71Å; N2743-T2745 PolarHBondContact O-N 3.06Å; N2743-T2745 PolarHBondContact O-OG1 3.35Å; T2745-K2747 PolarHBondContact O-N 2.96Å
2746	E	81.6	Confident	84.5	Confident	67 Å²	67	51.8 Å²	51.8	31%	0.313	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	130.8	174.7	-166.3	-179.2	-153.2	0	0	110.6	S2739 Y2741 K2749	S2739-E2746 VanDerWaalsContact CB-OE1 3.3Å; S2739-E2746 WeakPolarHBondContact CB-OE1 3.49Å; Y2741-E2746 HydrophobicContact CD1-CB 4.05Å; Y2741-E2746 HydrophobicContact CE1-CB 3.65Å; Y2741-E2746 HydrophobicContact CE1-CG 4.15Å; Y2741-E2746 HydrophobicContact CE2-CG 4.2Å; E2746-K2749 IonicContact OE1-NZ 3.03Å; E2746-K2749 PolarHBondContact OE1-NZ 2.87Å; E2746-K2749 IonicContact OE2-NZ 3.12Å; E2746-K2749 PolarHBondContact OE2-NZ 3.2Å
2747	K	79.5	Confident	83.9	Confident	100.5 Å²	100.5	57.4 Å²	57.4	44%	0.437	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	163.1	176.3	-69.4	-168.7	174	-171.2	0	110.5	S2740 I2742 T2745 K2749	S2740-K2747 PolarHBondContact N-O 3.45Å; S2740-K2747 WeakPolarHBondContact O-CA 3.46Å; S2740-K2747 PolarHBondContact O-N 3.06Å; I2742-K2747 HydrophobicContact CB-CD 4.46Å; I2742-K2747 HydrophobicContact CD1-CD 4.08Å; T2745-K2747 PolarHBondContact O-N 2.96Å; K2747-K2749 PolarHBondContact O-N 3.18Å; K2747-K2749 VanDerWaalsContact O-N 3.11Å
2748	N	81.8	Confident	83.5	Confident	88 Å²	88	57.4 Å²	57.4	47%	0.471	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	55.5	28.7	174.5	-57.5	5.8	0	0	0	114.3	V2750 Y2788	N2748-V2750 PolarHBondContact O-N 3.11Å; N2748-Y2788 HydrophobicContact CB-CE2 4.42Å; N2748-Y2788 WeakPolarHBondContact CB-OH 3.35Å; N2748-Y2788 WeakPolarHBondContact O-CE2 3.37Å; N2748-Y2788 PolarHBondContact O-OH 2.92Å
2749	K	89.4	Confident	82.8	Confident	118.5 Å²	118.5	60.8 Å²	60.8	52%	0.515	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	120.8	-176.7	-165.2	-169.2	-163.1	87.7	0	111.5	I2737 L2738 E2746 K2747	I2737-K2749 HydrophobicContact CG2-CG 3.8Å; L2738-K2749 CarbonylContact O-C 3.56Å; L2738-K2749 WeakPolarHBondContact O-CA 3.39Å; E2746-K2749 IonicContact OE1-NZ 3.03Å; E2746-K2749 PolarHBondContact OE1-NZ 2.87Å; E2746-K2749 IonicContact OE2-NZ 3.12Å; E2746-K2749 PolarHBondContact OE2-NZ 3.2Å; K2747-K2749 PolarHBondContact O-N 3.18Å; K2747-K2749 VanDerWaalsContact O-N 3.11Å
2750	V	90.6	Very high	82.3	Confident	54 Å²	54	64.5 Å²	64.5	33%	0.327	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	118.9	178.8	174.6	0	0	0	0	109.6	I2737 L2738 N2748 P2786 Y2788	I2737-V2750 WeakPolarHBondContact CA-O 3.29Å; L2738-V2750 PolarHBondContact N-O 2.93Å; L2738-V2750 PolarHBondContact O-N 2.95Å; N2748-V2750 PolarHBondContact O-N 3.11Å; V2750-P2786 HydrophobicContact CG1-CG 3.7Å; V2750-Y2788 HydrophobicContact CB-CD2 4.21Å; V2750-Y2788 HydrophobicContact CB-CE2 4.3Å; V2750-Y2788 HydrophobicContact CG2-CD2 4.16Å; V2750-Y2788 HydrophobicContact CG2-CE2 4.2Å
2751	S	91.6	Very high	81.5	Confident	61.5 Å²	61.5	66.3 Å²	66.3	43%	0.43	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	143.1	171.9	-173.4	0	0	0	0	111.1	E2735 W2736	E2735-S2751 WeakPolarHBondContact CG-OG 3.33Å; E2735-S2751 PolarHBondContact OE1-OG 3.41Å; W2736-S2751 CarbonylContact O-C 3.47Å; W2736-S2751 WeakPolarHBondContact O-CA 3.37Å
2752	F	93.6	Very high	81.5	Confident	23.5 Å²	23.5	71.3 Å²	71.3	10%	0.103	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.5	161.9	175.9	65.8	-78.8	0	0	0	111	L2727 W2736 L2738 V2784	L2727-F2752 HydrophobicContact CD1-CE1 4.24Å; L2727-F2752 HydrophobicContact CD1-CZ 4.12Å; W2736-F2752 HydrophobicContact CB-CD1 4.15Å; W2736-F2752 HydrophobicContact CB-CD2 4.17Å; W2736-F2752 HydrophobicContact CB-CE1 3.7Å; W2736-F2752 HydrophobicContact CB-CE2 3.74Å; W2736-F2752 HydrophobicContact CB-CG 4.36Å; W2736-F2752 HydrophobicContact CB-CZ 3.49Å; W2736-F2752 VanDerWaalsContact CB-CZ 3.49Å; W2736-F2752 HydrophobicContact CD2-CE2 4.45Å; W2736-F2752 HydrophobicContact CD2-CZ 4.43Å; W2736-F2752 HydrophobicContact CE3-CE2 4.2Å; W2736-F2752 AromaticContact CE3-CZ 3.98Å; W2736-F2752 HydrophobicContact CE3-CZ 3.99Å; W2736-F2752 HydrophobicContact CG-CE2 4.3Å; W2736-F2752 HydrophobicContact CG-CZ 4.3Å; W2736-F2752 PolarHBondContact N-O 3.18Å; W2736-F2752 WeakPolarHBondContact O-CD1 3.37Å; W2736-F2752 WeakPolarHBondContact O-CE1 3.21Å; W2736-F2752 PolarHBondContact O-N 2.9Å; L2738-F2752 HydrophobicContact CD1-CE1 3.86Å; L2738-F2752 HydrophobicContact CD1-CZ 4.47Å; L2738-F2752 HydrophobicContact CG-CE1 3.94Å; F2752-V2784 WeakPolarHBondContact CD2-O 3.33Å; F2752-V2784 HydrophobicContact CE2-CG2 4.48Å; F2752-V2784 VanDerWaalsContact CE2-O 3.24Å; F2752-V2784 WeakPolarHBondContact CE2-O 3.44Å
2753	K	90.7	Very high	81.8	Confident	163.5 Å²	163.5	73.2 Å²	73.2	71%	0.711	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101	133.8	172.9	-68.3	-176.4	178.7	179.5	0	110.3	N2734 P2755	N2734-K2753 WeakPolarHBondContact O-CA 3.42Å; K2753-P2755 WeakPolarHBondContact O-CD 3.16Å
2754	N	87.7	Confident	82.8	Confident	5 Å²	5	69.4 Å²	69.4	3%	0.027	39%	0.385	C	S	.	.			trans	-78.6	122.3	178.9	155.1	48	0	0	0	111.3	N2734 W2736 V2756 L2779 V2784	N2734-N2754 PolarHBondContact ND2-O 3.3Å; N2734-N2754 WeakPolarHBondContact OD1-CB 3.32Å; N2734-N2754 PolarHBondContact OD1-ND2 3.19Å; N2734-N2754 PolarHBondContact OD1-O 3.15Å; W2736-N2754 HydrophobicContact CD2-CB 3.89Å; W2736-N2754 VanDerWaalsContact CE2-CB 3.49Å; W2736-N2754 HydrophobicContact CG-CB 4.14Å; W2736-N2754 HydrophobicContact CZ2-CB 3.98Å; N2754-V2756 VanDerWaalsContact C-N 3.34Å; N2754-V2756 PolarHBondContact ND2-O 2.88Å; N2754-V2756 PolarHBondContact O-N 2.89Å; N2754-V2756 PolarHBondContact OD1-N 2.9Å; N2754-V2756 PolarHBondContact OD1-O 3.11Å; N2754-L2779 VanDerWaalsContact OD1-CD1 3.29Å; N2754-L2779 WeakPolarHBondContact OD1-CD1 3.31Å; N2754-V2784 WeakPolarHBondContact OD1-CG1 3.4Å
2755	P	84.6	Confident	84	Confident	81.5 Å²	81.5	73.1 Å²	73.1	53%	0.529	39%	0.389	S	S	.	.	S	Bend	trans	-86.9	8.3	-178.1	36.4	-37.6	0	0	0	114.2	K2753 P2757 K2782 V2784	K2753-P2755 WeakPolarHBondContact O-CD 3.16Å; P2755-P2757 WeakPolarHBondContact O-CD 3.27Å; P2755-K2782 PolarHBondContact O-NZ 2.81Å; P2755-V2784 HydrophobicContact CG-CG1 4.24Å
2756	V	84.8	Confident	85	Confident	21.5 Å²	21.5	70.2 Å²	70.2	13%	0.13	37%	0.371	C	S	.	.	S	Bend	trans	-114.6	109.1	178.9	-178.1	0	0	0	0	109.4	N2754 L2758 L2779 K2782 V2784	N2754-V2756 VanDerWaalsContact C-N 3.34Å; N2754-V2756 PolarHBondContact ND2-O 2.88Å; N2754-V2756 PolarHBondContact O-N 2.89Å; N2754-V2756 PolarHBondContact OD1-N 2.9Å; N2754-V2756 PolarHBondContact OD1-O 3.11Å; V2756-L2758 PolarHBondContact O-N 2.89Å; V2756-L2779 HydrophobicContact CB-CB 4.13Å; V2756-L2779 HydrophobicContact CB-CD1 4.13Å; V2756-L2779 HydrophobicContact CB-CD2 4Å; V2756-L2779 HydrophobicContact CG1-CB 4.19Å; V2756-L2779 HydrophobicContact CG1-CD2 3.58Å; V2756-L2779 HydrophobicContact CG2-CB 4.27Å; V2756-K2782 HydrophobicContact CG2-CB 4.35Å; V2756-K2782 HydrophobicContact CG2-CD 4.09Å; V2756-K2782 HydrophobicContact CG2-CG 4.36Å; V2756-V2784 HydrophobicContact CB-CG1 4.29Å; V2756-V2784 HydrophobicContact CG2-CG1 3.77Å
2757	P	79.8	Confident	85.5	Confident	118 Å²	118	67.1 Å²	67.1	77%	0.766	36%	0.357	S	S	*	.			trans	-62.9	129.1	-177.2	25.2	-33.7	0	0	0	111	P2755	P2755-P2757 WeakPolarHBondContact O-CD 3.27Å
2758	L	85.3	Confident	86	Confident	41 Å²	41	62.3 Å²	62.3	22%	0.215	34%	0.336	C	S	.	.			trans	-91	146.8	172.1	-59	-174.3	0	0	0	109.9	L2706 F2713 W2736 V2756 F2764 L2779	L2706-L2758 HydrophobicContact CD1-CB 3.57Å; L2706-L2758 HydrophobicContact CD1-CD1 4.1Å; L2706-L2758 HydrophobicContact CD1-CG 4.47Å; L2706-L2758 HydrophobicContact CD2-CD1 4.49Å; L2706-L2758 HydrophobicContact CG-CB 4.41Å; L2706-L2758 HydrophobicContact CG-CD1 4.44Å; F2713-L2758 HydrophobicContact CE1-CD1 4.11Å; F2713-L2758 HydrophobicContact CZ-CD1 4.44Å; W2736-L2758 HydrophobicContact CH2-CD1 4.43Å; W2736-L2758 HydrophobicContact CZ2-CD1 3.96Å; V2756-L2758 PolarHBondContact O-N 2.89Å; L2758-F2764 HydrophobicContact CD1-CE1 4.37Å; L2758-F2764 HydrophobicContact CD1-CE2 4.21Å; L2758-F2764 HydrophobicContact CD1-CZ 4.1Å; L2758-F2764 HydrophobicContact CD2-CB 4.29Å; L2758-F2764 HydrophobicContact CD2-CD1 4.06Å; L2758-F2764 HydrophobicContact CD2-CD2 4.05Å; L2758-F2764 HydrophobicContact CD2-CE1 4.39Å; L2758-F2764 HydrophobicContact CD2-CE2 4.35Å; L2758-F2764 HydrophobicContact CD2-CG 3.88Å; L2758-F2764 HydrophobicContact CD2-CZ 4.41Å; L2758-L2779 HydrophobicContact CD2-CD1 3.9Å; L2758-L2779 HydrophobicContact CD2-CD2 3.93Å; L2758-L2779 HydrophobicContact CD2-CG 4.35Å
2759	T	79.5	Confident	86.3	Confident	72 Å²	72	58.3 Å²	58.3	44%	0.442	32%	0.315	S	S	.	.			trans	-125.6	133	175.7	-40.8	0	0	0	0	109.4	G2761 K2762	T2759-G2761 PolarHBondContact O-N 3.04Å; T2759-K2762 HydrophobicContact CG2-CD 4.18Å; T2759-K2762 HydrophobicContact CG2-CG 4.33Å; T2759-K2762 WeakPolarHBondContact O-CB 3.47Å; T2759-K2762 PolarHBondContact O-N 3.19Å
2760	T	78.7	Confident	86	Confident	79 Å²	79	53 Å²	53	49%	0.485	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-41.4	133.5	168.4	-63.6	0	0	0	0	112.3	P2708 K2762	P2708-T2760 HydrophobicContact CB-CG2 4.28Å; P2708-T2760 HydrophobicContact CG-CG2 4.38Å; T2760-K2762 PolarHBondContact O-N 2.83Å
2761	G	70.7	Confident	85.1	Confident	38 Å²	38	51 Å²	51	39%	0.392	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	-18.2	176.5	0	0	0	0	0	116.7	K2705 L2706 T2759	K2705-G2761 VanDerWaalsContact CD-O 3.28Å; K2705-G2761 WeakPolarHBondContact CD-O 3.41Å; K2705-G2761 VanDerWaalsContact CE-O 3.26Å; K2705-G2761 WeakPolarHBondContact CE-O 3.36Å; K2705-G2761 PolarHBondContact NZ-O 3.46Å; L2706-G2761 PolarHBondContact O-N 3.15Å; L2706-G2761 VanDerWaalsContact O-N 3.08Å; T2759-G2761 PolarHBondContact O-N 3.04Å
2762	K	81.9	Confident	84	Confident	136.5 Å²	136.5	51.1 Å²	51.1	59%	0.593	28%	0.283	S	S	*	.			trans	-74.8	141.5	175	-116.8	-178.5	-174	169.5	0	110.3	K2705 T2759 T2760	K2705-K2762 WeakPolarHBondContact CA-O 3.47Å; T2759-K2762 HydrophobicContact CG2-CD 4.18Å; T2759-K2762 HydrophobicContact CG2-CG 4.33Å; T2759-K2762 WeakPolarHBondContact O-CB 3.47Å; T2759-K2762 PolarHBondContact O-N 3.19Å; T2760-K2762 PolarHBondContact O-N 2.83Å
2763	L	82.6	Confident	83	Confident	84 Å²	84	52 Å²	52	44%	0.44	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	129.6	176.5	-170.6	73.1	0	0	0	110.1	P2703 M2704 K2705 Q2807	P2703-L2763 HydrophobicContact CB-CD1 4.06Å; P2703-L2763 HydrophobicContact CB-CD2 4.49Å; P2703-L2763 HydrophobicContact CB-CG 4.48Å; M2704-L2763 WeakPolarHBondContact O-CA 3.42Å; K2705-L2763 HydrophobicContact CG-CB 4.4Å; K2705-L2763 HydrophobicContact CG-CD1 3.96Å; L2763-Q2807 VanDerWaalsContact CD1-CD 3.44Å; L2763-Q2807 HydrophobicContact CD1-CG 3.94Å; L2763-Q2807 VanDerWaalsContact CD1-OE1 3.31Å
2764	F	88.4	Confident	82.6	Confident	8.5 Å²	8.5	49.1 Å²	49.1	4%	0.037	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	154.2	169.1	60.9	-86.3	0	0	0	109.8	P2703 M2704 L2706 F2713 L2758 L2779 N2780 V2804	P2703-F2764 CarbonylContact C-O 3.56Å; P2703-F2764 WeakPolarHBondContact CA-O 3.27Å; M2704-F2764 HydrophobicContact CB-CD2 4.37Å; M2704-F2764 HydrophobicContact CB-CE1 4.12Å; M2704-F2764 HydrophobicContact CB-CE2 3.83Å; M2704-F2764 HydrophobicContact CB-CZ 3.68Å; M2704-F2764 HydrophobicContact CE-CE2 3.65Å; M2704-F2764 HydrophobicContact CE-CZ 3.83Å; M2704-F2764 HydrophobicContact CG-CE2 4.49Å; M2704-F2764 PolarHBondContact N-O 3.24Å; M2704-F2764 WeakPolarHBondContact O-CD1 3.21Å; M2704-F2764 WeakPolarHBondContact O-CE1 3.39Å; M2704-F2764 PolarHBondContact O-N 3.01Å; M2704-F2764 HydrophobicContact SD-CE2 4.35Å; L2706-F2764 HydrophobicContact CD2-CZ 4.49Å; L2706-F2764 HydrophobicContact CG-CE1 4.02Å; L2706-F2764 HydrophobicContact CG-CZ 4.41Å; F2713-F2764 HydrophobicContact CZ-CE2 4.46Å; F2713-F2764 HydrophobicContact CZ-CZ 4.5Å; L2758-F2764 HydrophobicContact CD1-CE1 4.37Å; L2758-F2764 HydrophobicContact CD1-CE2 4.21Å; L2758-F2764 HydrophobicContact CD1-CZ 4.1Å; L2758-F2764 HydrophobicContact CD2-CB 4.29Å; L2758-F2764 HydrophobicContact CD2-CD1 4.06Å; L2758-F2764 HydrophobicContact CD2-CD2 4.05Å; L2758-F2764 HydrophobicContact CD2-CE1 4.39Å; L2758-F2764 HydrophobicContact CD2-CE2 4.35Å; L2758-F2764 HydrophobicContact CD2-CG 3.88Å; L2758-F2764 HydrophobicContact CD2-CZ 4.41Å; F2764-L2779 HydrophobicContact CB-CD2 4.19Å; F2764-L2779 HydrophobicContact CD2-CD1 3.72Å; F2764-L2779 HydrophobicContact CD2-CD2 3.94Å; F2764-L2779 VanDerWaalsContact CD2-CD2 3.43Å; F2764-L2779 HydrophobicContact CD2-CG 4.17Å; F2764-L2779 HydrophobicContact CE2-CD1 4.13Å; F2764-L2779 HydrophobicContact CE2-CD2 3.94Å; F2764-L2779 HydrophobicContact CG-CD2 4.38Å; F2764-N2780 VanDerWaalsContact CA-OD1 3.3Å; F2764-N2780 WeakPolarHBondContact CA-OD1 3.48Å; F2764-V2804 HydrophobicContact CZ-CG1 4.5Å
2765	R	89.5	Confident	82.6	Confident	112 Å²	112	48.9 Å²	48.9	42%	0.423	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	112	175.3	-174.3	179.4	-65.5	161.8	1.7	109.7	L2779 N2780	R2765-L2779 CarbonylContact O-C 3.58Å; R2765-L2779 WeakPolarHBondContact O-CA 3.25Å; R2765-N2780 PolarHBondContact N-OD1 3.14Å; R2765-N2780 PolarHBondContact O-N 2.83Å
2766	L	93.3	Very high	82.9	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	127.1	165.1	-170.4	75.4	0	0	0	108	I2702 M2704 V2715 L2727 W2736 I2768 V2777 M2778 L2779	I2702-L2766 HydrophobicContact CB-CB 4.43Å; I2702-L2766 PolarHBondContact N-O 3.17Å; I2702-L2766 PolarHBondContact O-N 2.89Å; M2704-L2766 HydrophobicContact CE-CD2 4.32Å; M2704-L2766 HydrophobicContact SD-CB 4.21Å; M2704-L2766 HydrophobicContact SD-CD2 4.31Å; V2715-L2766 HydrophobicContact CB-CD2 4.47Å; V2715-L2766 HydrophobicContact CG2-CD2 3.71Å; L2727-L2766 HydrophobicContact CD2-CD1 4.43Å; L2727-L2766 HydrophobicContact CD2-CD2 4.24Å; W2736-L2766 HydrophobicContact CH2-CD1 4.26Å; W2736-L2766 HydrophobicContact CZ3-CD1 4.02Å; L2766-I2768 HydrophobicContact CD2-CD1 4.24Å; L2766-I2768 HydrophobicContact CD2-CG1 4.34Å; L2766-I2768 HydrophobicContact CG-CG1 4.33Å; L2766-V2777 HydrophobicContact CD1-CG1 3.51Å; L2766-V2777 VanDerWaalsContact CD1-CG1 3.47Å; L2766-V2777 HydrophobicContact CG-CG1 4.3Å; L2766-M2778 CarbonylContact C-O 3.46Å; L2766-M2778 WeakPolarHBondContact CA-O 3.21Å; L2766-L2779 HydrophobicContact CB-CD2 4.28Å; L2766-L2779 HydrophobicContact CD1-CD1 4.22Å; L2766-L2779 HydrophobicContact CD1-CD2 3.74Å; L2766-L2779 HydrophobicContact CD1-CG 4.13Å
2767	T	91.3	Very high	83.3	Confident	2.5 Å²	2.5	46.1 Å²	46.1	2%	0.015	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	117.7	175.9	-60.4	0	0	0	0	109.5	L2699 I2700 N2701 M2778	L2699-T2767 HydrophobicContact CD1-CG2 3.87Å; L2699-T2767 VanDerWaalsContact CD1-CG2 3.49Å; L2699-T2767 HydrophobicContact CD2-CG2 4.14Å; L2699-T2767 HydrophobicContact CG-CG2 3.73Å; I2700-T2767 CarbonylContact O-C 3.52Å; I2700-T2767 VanDerWaalsContact O-CA 3.27Å; I2700-T2767 WeakPolarHBondContact O-CA 3.46Å; N2701-T2767 VanDerWaalsContact OD1-CG2 3.26Å; N2701-T2767 WeakPolarHBondContact OD1-CG2 3.45Å; N2701-T2767 PolarHBondContact OD1-OG1 2.95Å; T2767-M2778 HydrophobicContact CG2-CE 3.79Å; T2767-M2778 PolarHBondContact N-O 2.91Å; T2767-M2778 PolarHBondContact O-N 3Å
2768	I	91	Very high	83.8	Confident	0.5 Å²	0.5	42.5 Å²	42.5	0%	0.003	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	119.1	-180	-53.7	165.2	0	0	0	107.4	I2700 V2715 I2717 W2725 L2766 I2770 V2777	I2700-I2768 HydrophobicContact CB-CB 4.4Å; I2700-I2768 PolarHBondContact N-O 3.09Å; I2700-I2768 PolarHBondContact O-N 2.8Å; V2715-I2768 HydrophobicContact CB-CD1 4.37Å; V2715-I2768 HydrophobicContact CG1-CD1 3.8Å; I2717-I2768 HydrophobicContact CD1-CD1 4.15Å; I2717-I2768 HydrophobicContact CD1-CG2 4.27Å; W2725-I2768 HydrophobicContact CH2-CD1 3.74Å; W2725-I2768 HydrophobicContact CH2-CG1 4.12Å; W2725-I2768 HydrophobicContact CH2-CG2 3.66Å; W2725-I2768 HydrophobicContact CZ2-CG2 3.78Å; W2725-I2768 HydrophobicContact CZ3-CD1 3.83Å; W2725-I2768 HydrophobicContact CZ3-CG2 4.35Å; L2766-I2768 HydrophobicContact CD2-CD1 4.24Å; L2766-I2768 HydrophobicContact CD2-CG1 4.34Å; L2766-I2768 HydrophobicContact CG-CG1 4.33Å; I2768-I2770 HydrophobicContact CG2-CD1 4.15Å; I2768-I2770 HydrophobicContact CG2-CG1 3.97Å; I2768-V2777 HydrophobicContact CG1-CG1 4.48Å
2769	S	87.3	Confident	84.1	Confident	4 Å²	4	40.5 Å²	40.5	3%	0.028	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	135.8	172.8	-179	0	0	0	0	109.3	K2697 W2698 S2775 E2776	K2697-S2769 WeakPolarHBondContact CE-OG 3.17Å; K2697-S2769 PolarHBondContact NZ-OG 2.58Å; W2698-S2769 CarbonylContact O-C 3.55Å; W2698-S2769 VanDerWaalsContact O-CA 3.28Å; W2698-S2769 WeakPolarHBondContact O-CA 3.38Å; W2698-S2769 PolarHBondContact O-OG 3.32Å; S2769-S2775 CarbonylContact O-C 3.56Å; S2769-S2775 WeakPolarHBondContact O-CA 3.18Å; S2769-S2775 VanDerWaalsContact O-CB 3.24Å; S2769-S2775 WeakPolarHBondContact O-CB 3.33Å; S2769-E2776 PolarHBondContact N-O 3.24Å; S2769-E2776 PolarHBondContact O-N 3.07Å; S2769-E2776 PolarHBondContact OG-OE2 2.74Å
2770	I	82.7	Confident	84.4	Confident	7 Å²	7	41.1 Å²	41.1	4%	0.036	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	122.4	-179.4	-53.4	-177.8	0	0	0	108.8	K2697 W2698 I2700 I2717 M2719 I2768 E2774 V2790 L2795	K2697-I2770 CarbonylContact C-O 3.51Å; K2697-I2770 WeakPolarHBondContact CA-O 3.44Å; W2698-I2770 HydrophobicContact CB-CB 4.49Å; W2698-I2770 PolarHBondContact N-O 2.79Å; W2698-I2770 PolarHBondContact O-N 3.03Å; W2698-I2770 VanDerWaalsContact O-N 3.08Å; I2700-I2770 HydrophobicContact CD1-CD1 3.94Å; I2717-I2770 HydrophobicContact CD1-CD1 3.81Å; M2719-I2770 HydrophobicContact CE-CG2 4.19Å; I2768-I2770 HydrophobicContact CG2-CD1 4.15Å; I2768-I2770 HydrophobicContact CG2-CG1 3.97Å; I2770-E2774 CarbonylContact C-O 3.57Å; I2770-E2774 WeakPolarHBondContact CA-O 3.33Å; I2770-V2790 HydrophobicContact CG2-CG1 4.1Å; I2770-V2790 HydrophobicContact CG2-CG2 4.1Å; I2770-L2795 HydrophobicContact CD1-CD2 3.82Å; I2770-L2795 HydrophobicContact CG2-CD2 4.33Å
2771	G	72.9	Confident	84.5	Confident	11 Å²	11	42.9 Å²	42.9	11%	0.113	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.2	158.2	177.9	0	0	0	0	0	113	L2696 G2773 E2774	L2696-G2771 VanDerWaalsContact O-CA 3.28Å; L2696-G2771 WeakPolarHBondContact O-CA 3.32Å; G2771-G2773 PolarHBondContact O-N 3.28Å; G2771-G2773 VanDerWaalsContact O-N 3.16Å; G2771-E2774 PolarHBondContact N-O 3.17Å; G2771-E2774 PolarHBondContact O-N 3.04Å; G2771-E2774 VanDerWaalsContact O-O 3.07Å
2772	S	68.1	Low	85.2	Confident	64 Å²	64	47.4 Å²	47.4	45%	0.448	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	53	25.8	-178.1	-53.2	0	0	0	0	115.2	E2694 E2695 E2774 R2816	E2694-S2772 WeakPolarHBondContact O-CA 3.1Å; E2694-S2772 PolarHBondContact O-N 2.7Å; E2695-S2772 PolarHBondContact OE1-OG 2.9Å; S2772-E2774 VanDerWaalsContact C-N 3.33Å; S2772-R2816 PolarHBondContact OG-NH2 2.87Å
2773	G	71.9	Confident	85.5	Confident	41.5 Å²	41.5	45.3 Å²	45.3	43%	0.428	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.8	4.8	-176	0	0	0	0	0	115	G2771 V2790	G2771-G2773 PolarHBondContact O-N 3.28Å; G2771-G2773 VanDerWaalsContact O-N 3.16Å; G2773-V2790 WeakPolarHBondContact O-CB 3.3Å; G2773-V2790 PolarHBondContact O-N 3.08Å
2774	E	83.4	Confident	85.9	Confident	104.5 Å²	104.5	41.8 Å²	41.8	49%	0.488	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	155.9	-176.7	-63.9	-173.9	151.9	0	0	112.7	I2770 G2771 S2772 V2787 Y2788 V2790	I2770-E2774 CarbonylContact C-O 3.57Å; I2770-E2774 WeakPolarHBondContact CA-O 3.33Å; G2771-E2774 PolarHBondContact N-O 3.17Å; G2771-E2774 PolarHBondContact O-N 3.04Å; G2771-E2774 VanDerWaalsContact O-O 3.07Å; S2772-E2774 VanDerWaalsContact C-N 3.33Å; E2774-V2787 HydrophobicContact CB-CG1 3.89Å; E2774-V2787 VanDerWaalsContact CD-CG1 3.47Å; E2774-V2787 HydrophobicContact CG-CG1 3.89Å; E2774-Y2788 CarbonylContact C-O 3.54Å; E2774-V2790 VanDerWaalsContact C-CG2 3.5Å; E2774-V2790 WeakPolarHBondContact O-CG2 3.41Å
2775	S	87.8	Confident	86.1	Confident	0.5 Å²	0.5	41.8 Å²	41.8	0%	0.003	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	150.1	172.5	55.3	0	0	0	0	112.9	W2725 S2769 Y2788 V2790	W2725-S2775 PolarHBondContact NE1-OG 3.09Å; W2725-S2775 VanDerWaalsContact NE1-OG 3.07Å; S2769-S2775 CarbonylContact O-C 3.56Å; S2769-S2775 WeakPolarHBondContact O-CA 3.18Å; S2769-S2775 VanDerWaalsContact O-CB 3.24Å; S2769-S2775 WeakPolarHBondContact O-CB 3.33Å; S2775-Y2788 PolarHBondContact N-O 3.26Å; S2775-Y2788 PolarHBondContact O-N 3.11Å; S2775-Y2788 WeakPolarHBondContact OG-CB 3.3Å; S2775-Y2788 WeakPolarHBondContact OG-CD1 3.41Å; S2775-Y2788 PolarHBondContact OG-O 3.25Å; S2775-Y2788 VanDerWaalsContact OG-O 3.12Å; S2775-V2790 WeakPolarHBondContact OG-CG2 3.37Å
2776	E	89.5	Confident	86	Confident	44 Å²	44	39 Å²	39	21%	0.206	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	134.1	-179.4	-52.9	176.4	97.5	0	0	109.5	K2697 S2769 K2783	K2697-E2776 IonicContact NZ-OE2 3.2Å; K2697-E2776 PolarHBondContact NZ-OE2 3.2Å; S2769-E2776 PolarHBondContact N-O 3.24Å; S2769-E2776 PolarHBondContact O-N 3.07Å; S2769-E2776 PolarHBondContact OG-OE2 2.74Å; E2776-K2783 WeakPolarHBondContact OE1-CE 3.31Å; E2776-K2783 IonicContact OE1-NZ 3.38Å; E2776-K2783 PolarHBondContact OE1-NZ 3.19Å
2777	V	93	Very high	85.6	Confident	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	130.7	174.1	-171.9	0	0	0	0	109.4	W2725 L2727 L2738 L2766 I2768 V2784 S2785	W2725-V2777 HydrophobicContact CH2-CG2 4.06Å; W2725-V2777 HydrophobicContact CZ2-CG2 4.06Å; L2727-V2777 HydrophobicContact CD2-CG1 4.16Å; L2727-V2777 HydrophobicContact CD2-CG2 4.41Å; L2738-V2777 HydrophobicContact CD1-CG2 4.32Å; L2738-V2777 HydrophobicContact CD2-CG2 4.25Å; L2766-V2777 HydrophobicContact CD1-CG1 3.51Å; L2766-V2777 VanDerWaalsContact CD1-CG1 3.47Å; L2766-V2777 HydrophobicContact CG-CG1 4.3Å; I2768-V2777 HydrophobicContact CG1-CG1 4.48Å; V2777-V2784 HydrophobicContact CB-CG2 4.21Å; V2777-V2784 HydrophobicContact CG1-CG2 3.95Å; V2777-V2784 WeakPolarHBondContact O-CG2 3.29Å; V2777-V2784 PolarHBondContact O-N 3.03Å; V2777-S2785 PolarHBondContact N-OG 2.93Å; V2777-S2785 PolarHBondContact O-N 2.98Å
2778	M	91.6	Very high	85.4	Confident	41 Å²	41	42.4 Å²	42.4	20%	0.202	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	147.8	173.6	-66.1	171.7	-82	0	0	110.6	L2699 L2766 T2767 K2782 K2783	L2699-M2778 HydrophobicContact CD1-CE 4.19Å; L2766-M2778 CarbonylContact C-O 3.46Å; L2766-M2778 WeakPolarHBondContact CA-O 3.21Å; T2767-M2778 HydrophobicContact CG2-CE 3.79Å; T2767-M2778 PolarHBondContact N-O 2.91Å; T2767-M2778 PolarHBondContact O-N 3Å; M2778-K2782 CarbonylContact C-O 3.58Å; M2778-K2782 WeakPolarHBondContact CA-O 3.29Å; M2778-K2782 WeakPolarHBondContact CB-O 3.3Å; M2778-K2783 HydrophobicContact CG-CB 4.34Å
2779	L	90	Very high	85	Confident	0.5 Å²	0.5	45.2 Å²	45.2	0%	0.003	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	125.4	168.2	-119.4	149.1	0	0	0	109.3	W2736 N2754 V2756 L2758 F2764 R2765 L2766 N2781 K2782 V2784	W2736-L2779 HydrophobicContact CH2-CD1 3.67Å; W2736-L2779 HydrophobicContact CH2-CD2 4.39Å; W2736-L2779 HydrophobicContact CH2-CG 4.27Å; W2736-L2779 HydrophobicContact CZ2-CD1 4.17Å; W2736-L2779 HydrophobicContact CZ3-CD1 4.38Å; N2754-L2779 VanDerWaalsContact OD1-CD1 3.29Å; N2754-L2779 WeakPolarHBondContact OD1-CD1 3.31Å; V2756-L2779 HydrophobicContact CB-CB 4.13Å; V2756-L2779 HydrophobicContact CB-CD1 4.13Å; V2756-L2779 HydrophobicContact CB-CD2 4Å; V2756-L2779 HydrophobicContact CG1-CB 4.19Å; V2756-L2779 HydrophobicContact CG1-CD2 3.58Å; V2756-L2779 HydrophobicContact CG2-CB 4.27Å; L2758-L2779 HydrophobicContact CD2-CD1 3.9Å; L2758-L2779 HydrophobicContact CD2-CD2 3.93Å; L2758-L2779 HydrophobicContact CD2-CG 4.35Å; F2764-L2779 HydrophobicContact CB-CD2 4.19Å; F2764-L2779 HydrophobicContact CD2-CD1 3.72Å; F2764-L2779 HydrophobicContact CD2-CD2 3.94Å; F2764-L2779 VanDerWaalsContact CD2-CD2 3.43Å; F2764-L2779 HydrophobicContact CD2-CG 4.17Å; F2764-L2779 HydrophobicContact CE2-CD1 4.13Å; F2764-L2779 HydrophobicContact CE2-CD2 3.94Å; F2764-L2779 HydrophobicContact CG-CD2 4.38Å; R2765-L2779 CarbonylContact O-C 3.58Å; R2765-L2779 WeakPolarHBondContact O-CA 3.25Å; L2766-L2779 HydrophobicContact CB-CD2 4.28Å; L2766-L2779 HydrophobicContact CD1-CD1 4.22Å; L2766-L2779 HydrophobicContact CD1-CD2 3.74Å; L2766-L2779 HydrophobicContact CD1-CG 4.13Å; L2779-N2781 PolarHBondContact O-N 3.19Å; L2779-K2782 PolarHBondContact N-O 3.24Å; L2779-K2782 PolarHBondContact O-N 3.16Å; L2779-V2784 HydrophobicContact CB-CG1 3.88Å; L2779-V2784 HydrophobicContact CB-CG2 4.44Å; L2779-V2784 HydrophobicContact CD1-CG1 4.18Å; L2779-V2784 HydrophobicContact CD1-CG2 4.27Å; L2779-V2784 HydrophobicContact CG-CG1 4.32Å; L2779-V2784 HydrophobicContact CG-CG2 4.14Å
2780	N	87	Confident	84.5	Confident	83.5 Å²	83.5	45.8 Å²	45.8	45%	0.447	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.9	43.1	-176.4	-61.8	-28.3	0	0	0	112.8	F2764 R2765 K2782	F2764-N2780 VanDerWaalsContact CA-OD1 3.3Å; F2764-N2780 WeakPolarHBondContact CA-OD1 3.48Å; R2765-N2780 PolarHBondContact N-OD1 3.14Å; R2765-N2780 PolarHBondContact O-N 2.83Å; N2780-K2782 PolarHBondContact O-N 2.9Å
2781	N	79.9	Confident	83.9	Confident	118 Å²	118	47.3 Å²	47.3	63%	0.631	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.3	5.7	-175.3	-50.5	-20.3	0	0	0	116.4	L2779	L2779-N2781 PolarHBondContact O-N 3.19Å
2782	K	85.3	Confident	83.5	Confident	131 Å²	131	47.2 Å²	47.2	57%	0.57	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.2	132.1	168.6	-121.4	-175.8	172.5	-168.5	0	109.7	P2755 V2756 M2778 L2779 N2780	P2755-K2782 PolarHBondContact O-NZ 2.81Å; V2756-K2782 HydrophobicContact CG2-CB 4.35Å; V2756-K2782 HydrophobicContact CG2-CD 4.09Å; V2756-K2782 HydrophobicContact CG2-CG 4.36Å; M2778-K2782 CarbonylContact C-O 3.58Å; M2778-K2782 WeakPolarHBondContact CA-O 3.29Å; M2778-K2782 WeakPolarHBondContact CB-O 3.3Å; L2779-K2782 PolarHBondContact N-O 3.24Å; L2779-K2782 PolarHBondContact O-N 3.16Å; N2780-K2782 PolarHBondContact O-N 2.9Å
2783	K	89.6	Confident	83.2	Confident	93.5 Å²	93.5	52.7 Å²	52.7	41%	0.407	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	135.5	173.5	-176.9	170.4	177.3	168.6	0	110.3	E2776 M2778 S2785 V2787	E2776-K2783 WeakPolarHBondContact OE1-CE 3.31Å; E2776-K2783 IonicContact OE1-NZ 3.38Å; E2776-K2783 PolarHBondContact OE1-NZ 3.19Å; M2778-K2783 HydrophobicContact CG-CB 4.34Å; K2783-S2785 WeakPolarHBondContact CE-O 3.12Å; K2783-V2787 VanDerWaalsContact NZ-CG2 3.28Å
2784	V	91.2	Very high	82.7	Confident	11 Å²	11	52.5 Å²	52.5	7%	0.067	27%	0.273	C	S	.	.			trans	-126	-25.6	-178.9	-62.9	0	0	0	0	113.9	F2752 N2754 P2755 V2756 V2777 L2779	F2752-V2784 WeakPolarHBondContact CD2-O 3.33Å; F2752-V2784 HydrophobicContact CE2-CG2 4.48Å; F2752-V2784 VanDerWaalsContact CE2-O 3.24Å; F2752-V2784 WeakPolarHBondContact CE2-O 3.44Å; N2754-V2784 WeakPolarHBondContact OD1-CG1 3.4Å; P2755-V2784 HydrophobicContact CG-CG1 4.24Å; V2756-V2784 HydrophobicContact CB-CG1 4.29Å; V2756-V2784 HydrophobicContact CG2-CG1 3.77Å; V2777-V2784 HydrophobicContact CB-CG2 4.21Å; V2777-V2784 HydrophobicContact CG1-CG2 3.95Å; V2777-V2784 WeakPolarHBondContact O-CG2 3.29Å; V2777-V2784 PolarHBondContact O-N 3.03Å; L2779-V2784 HydrophobicContact CB-CG1 3.88Å; L2779-V2784 HydrophobicContact CB-CG2 4.44Å; L2779-V2784 HydrophobicContact CD1-CG1 4.18Å; L2779-V2784 HydrophobicContact CD1-CG2 4.27Å; L2779-V2784 HydrophobicContact CG-CG1 4.32Å; L2779-V2784 HydrophobicContact CG-CG2 4.14Å
2785	S	91	Very high	81.7	Confident	7 Å²	7	47.9 Å²	47.9	5%	0.049	25%	0.251	C	S	.	.	S	Bend	trans	-94.4	160.4	174	74.3	0	0	0	0	112.8	V2777 K2783	V2777-S2785 PolarHBondContact N-OG 2.93Å; V2777-S2785 PolarHBondContact O-N 2.98Å; K2783-S2785 WeakPolarHBondContact CE-O 3.12Å
2786	P	87.7	Confident	80.6	Confident	53.5 Å²	53.5	48.9 Å²	48.9	35%	0.347	26%	0.262	S	S	.	.	P	Polyproline II helix	trans	-58.1	169.7	153.9	27.8	-35.1	0	0	0	111.5	V2750	V2750-P2786 HydrophobicContact CG1-CG 3.7Å
2787	V	85	Confident	79.4	Confident	68.5 Å²	68.5	49.2 Å²	49.2	42%	0.415	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-70.2	133.1	164.7	-176.5	0	0	0	0	107.9	E2774 K2783	E2774-V2787 HydrophobicContact CB-CG1 3.89Å; E2774-V2787 VanDerWaalsContact CD-CG1 3.47Å; E2774-V2787 HydrophobicContact CG-CG1 3.89Å; K2783-V2787 VanDerWaalsContact NZ-CG2 3.28Å
2788	Y	87.9	Confident	78.3	Confident	5.5 Å²	5.5	49.8 Å²	49.8	2%	0.022	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	123.9	-173.2	-179.3	-81.4	0	0	0	111.1	W2725 L2738 S2739 S2740 N2748 V2750 E2774 S2775 V2790	W2725-Y2788 AromaticContact CD1-CD1 3.91Å; W2725-Y2788 AromaticContact CD1-CE1 3.85Å; W2725-Y2788 AromaticContact NE1-CD1 3.66Å; W2725-Y2788 AromaticContact NE1-CE1 3.87Å; L2738-Y2788 HydrophobicContact CB-CD2 3.41Å; L2738-Y2788 VanDerWaalsContact CB-CD2 3.41Å; L2738-Y2788 HydrophobicContact CB-CE2 3.46Å; L2738-Y2788 VanDerWaalsContact CB-CE2 3.46Å; L2738-Y2788 HydrophobicContact CB-CG 4.09Å; L2738-Y2788 HydrophobicContact CD1-CD2 3.99Å; L2738-Y2788 HydrophobicContact CD1-CG 4.07Å; L2738-Y2788 HydrophobicContact CG-CD2 4.27Å; S2739-Y2788 VanDerWaalsContact CA-OH 3.26Å; S2739-Y2788 WeakPolarHBondContact CA-OH 3.38Å; S2740-Y2788 WeakPolarHBondContact CB-OH 3.38Å; S2740-Y2788 PolarHBondContact N-OH 3.32Å; S2740-Y2788 WeakPolarHBondContact OG-CE1 3.18Å; S2740-Y2788 PolarHBondContact OG-OH 2.81Å; N2748-Y2788 HydrophobicContact CB-CE2 4.42Å; N2748-Y2788 WeakPolarHBondContact CB-OH 3.35Å; N2748-Y2788 WeakPolarHBondContact O-CE2 3.37Å; N2748-Y2788 PolarHBondContact O-OH 2.92Å; V2750-Y2788 HydrophobicContact CB-CD2 4.21Å; V2750-Y2788 HydrophobicContact CB-CE2 4.3Å; V2750-Y2788 HydrophobicContact CG2-CD2 4.16Å; V2750-Y2788 HydrophobicContact CG2-CE2 4.2Å; E2774-Y2788 CarbonylContact C-O 3.54Å; S2775-Y2788 PolarHBondContact N-O 3.26Å; S2775-Y2788 PolarHBondContact O-N 3.11Å; S2775-Y2788 WeakPolarHBondContact OG-CB 3.3Å; S2775-Y2788 WeakPolarHBondContact OG-CD1 3.41Å; S2775-Y2788 PolarHBondContact OG-O 3.25Å; S2775-Y2788 VanDerWaalsContact OG-O 3.12Å; Y2788-V2790 HydrophobicContact CD1-CG2 4.15Å; Y2788-V2790 WeakPolarHBondContact O-CG2 3.13Å; Y2788-V2790 PolarHBondContact O-N 3.43Å
2789	A	81.3	Confident	77.3	Confident	60 Å²	60	48.4 Å²	48.4	50%	0.496	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	121.5	-177.5	0	0	0	0	0	112
2790	V	78.3	Confident	76.6	Confident	17 Å²	17	48.5 Å²	48.5	10%	0.103	26%	0.259	C	S	.	.			trans	-93.3	121.5	-172.1	-176.7	0	0	0	0	110.1	M2719 I2770 G2773 E2774 S2775 Y2788 G2792	M2719-V2790 HydrophobicContact CE-CG1 3.4Å; M2719-V2790 VanDerWaalsContact CE-CG1 3.44Å; M2719-V2790 HydrophobicContact SD-CG1 3.53Å; M2719-V2790 WeakPolarHBondContact SD-CG1 3.2Å; I2770-V2790 HydrophobicContact CG2-CG1 4.1Å; I2770-V2790 HydrophobicContact CG2-CG2 4.1Å; G2773-V2790 WeakPolarHBondContact O-CB 3.3Å; G2773-V2790 PolarHBondContact O-N 3.08Å; E2774-V2790 VanDerWaalsContact C-CG2 3.5Å; E2774-V2790 WeakPolarHBondContact O-CG2 3.41Å; S2775-V2790 WeakPolarHBondContact OG-CG2 3.37Å; Y2788-V2790 HydrophobicContact CD1-CG2 4.15Å; Y2788-V2790 WeakPolarHBondContact O-CG2 3.13Å; Y2788-V2790 PolarHBondContact O-N 3.43Å; V2790-G2792 VanDerWaalsContact C-N 3.31Å; V2790-G2792 VanDerWaalsContact CG1-O 3.31Å; V2790-G2792 WeakPolarHBondContact CG1-O 3.47Å; V2790-G2792 PolarHBondContact O-N 2.98Å
2791	P	68.3	Low	75.7	Confident	38.5 Å²	38.5	45.3 Å²	45.3	25%	0.25	24%	0.243	C	C	.	.			trans	-78.4	-10.6	-174.7	31	-36.2	0	0	0	114.5	M2719 V2723 W2725 S2740 I2742	M2719-P2791 HydrophobicContact SD-CG 3.84Å; V2723-P2791 HydrophobicContact CG1-CB 4.03Å; V2723-P2791 HydrophobicContact CG1-CG 3.64Å; V2723-P2791 VanDerWaalsContact CG1-CG 3.49Å; W2725-P2791 HydrophobicContact CB-CG 4.39Å; S2740-P2791 WeakPolarHBondContact OG-CD 3.32Å; S2740-P2791 WeakPolarHBondContact OG-CG 3.28Å; I2742-P2791 HydrophobicContact CD1-CB 3.74Å; I2742-P2791 HydrophobicContact CD1-CG 3.74Å; I2742-P2791 HydrophobicContact CG1-CB 4.19Å; I2742-P2791 HydrophobicContact CG1-CG 4.05Å
2792	G	66.2	Low	75.2	Confident	8 Å²	8	40.2 Å²	40.2	8%	0.082	22%	0.218	C	C	.	.			trans	-123.3	157.5	-176.6	0	0	0	0	0	114.1	M2719 D2720 V2790	M2719-G2792 VanDerWaalsContact CE-C 3.5Å; M2719-G2792 VanDerWaalsContact CE-O 3.29Å; M2719-G2792 WeakPolarHBondContact CE-O 3.07Å; D2720-G2792 WeakPolarHBondContact OD2-CA 3.36Å; V2790-G2792 VanDerWaalsContact C-N 3.31Å; V2790-G2792 VanDerWaalsContact CG1-O 3.31Å; V2790-G2792 WeakPolarHBondContact CG1-O 3.47Å; V2790-G2792 PolarHBondContact O-N 2.98Å
2793	R	61	Low	74.9	Confident	179 Å²	179	34.6 Å²	34.6	68%	0.675	19%	0.194	S	C	*	.	S	Bend	trans	-104.5	-36.6	-173.7	-58.1	-177.5	-175.4	-155.7	0.8	113	P2693 D2720	P2693-R2793 HydrophobicContact CB-CB 4.03Å; P2693-R2793 WeakPolarHBondContact CB-O 3.32Å; P2693-R2793 HydrophobicContact CG-CB 3.9Å; P2693-R2793 HydrophobicContact CG-CG 4.38Å; D2720-R2793 PolarHBondContact OD1-N 2.98Å; D2720-R2793 PolarHBondContact OD2-N 3.22Å
2794	S	60.7	Low	74.2	Confident	39 Å²	39	30.1 Å²	30.1	27%	0.273	18%	0.175	S	C	.	.	S	Bend	trans	-95.2	154.2	176.6	13.1	0	0	0	0	111.3	M2719 D2720	M2719-S2794 CarbonylContact C-O 3.31Å; M2719-S2794 VanDerWaalsContact C-O 3.25Å; M2719-S2794 WeakPolarHBondContact CA-O 3.47Å; M2719-S2794 WeakPolarHBondContact CB-O 3.24Å; D2720-S2794 WeakPolarHBondContact OD1-CA 3.34Å; D2720-S2794 VanDerWaalsContact OD1-CB 3.26Å; D2720-S2794 WeakPolarHBondContact OD1-CB 3.32Å; D2720-S2794 PolarHBondContact OD1-N 3.34Å; D2720-S2794 PolarHBondContact OD1-OG 3.02Å
2795	L	64	Low	72.7	Confident	6.5 Å²	6.5	31.4 Å²	31.4	3%	0.034	18%	0.181	C	C	.	.			trans	-115.7	119.4	171.5	-64.3	177.1	0	0	0	109.5	I2672 R2674 P2684 I2687 W2698 I2700 I2717 M2719 I2770	I2672-L2795 HydrophobicContact CD1-CB 3.54Å; I2672-L2795 HydrophobicContact CD1-CD1 3.9Å; I2672-L2795 HydrophobicContact CD1-CG 4.38Å; R2674-L2795 PolarHBondContact NE-O 2.75Å; P2684-L2795 WeakPolarHBondContact CD-O 3.47Å; P2684-L2795 HydrophobicContact CG-CB 4.14Å; I2687-L2795 WeakPolarHBondContact CD1-O 3.39Å; W2698-L2795 HydrophobicContact CB-CD1 3.59Å; W2698-L2795 VanDerWaalsContact CB-CD1 3.45Å; W2698-L2795 HydrophobicContact CD2-CD1 3.76Å; W2698-L2795 HydrophobicContact CD2-CG 4.48Å; W2698-L2795 HydrophobicContact CE3-CD1 4.46Å; W2698-L2795 HydrophobicContact CG-CD1 3.36Å; W2698-L2795 HydrophobicContact CG-CG 4.13Å; I2700-L2795 HydrophobicContact CD1-CD1 4.19Å; I2717-L2795 HydrophobicContact CG2-CD2 3.86Å; M2719-L2795 HydrophobicContact CE-CD2 3.54Å; M2719-L2795 VanDerWaalsContact CE-CD2 3.46Å; M2719-L2795 HydrophobicContact CE-CG 4.35Å; M2719-L2795 HydrophobicContact CG-CD2 4.37Å; I2770-L2795 HydrophobicContact CD1-CD2 3.82Å; I2770-L2795 HydrophobicContact CG2-CD2 4.33Å
2796	G	64.3	Low	71.1	Confident	21.5 Å²	21.5	31.1 Å²	31.1	22%	0.222	18%	0.179	C	C	.	.			trans	-94.8	-92	174.4	0	0	0	0	0	112.1	P2684 K2718	P2684-G2796 WeakPolarHBondContact CD-O 3.3Å; K2718-G2796 CarbonylContact O-C 3.54Å; K2718-G2796 WeakPolarHBondContact O-CA 3.47Å; K2718-G2796 PolarHBondContact O-N 3.12Å
2797	R	63.2	Low	69.6	Low	51.5 Å²	51.5	33.2 Å²	33.2	19%	0.194	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	132.7	-168.8	-169.1	-175.2	-112.6	145.9	4.1	112	Y2600 L2618 Y2669 I2717 K2718 V2799	Y2600-R2797 VanDerWaalsContact CD1-CZ 3.47Å; Y2600-R2797 VanDerWaalsContact CD1-NH1 3.3Å; Y2600-R2797 VanDerWaalsContact CE1-NH1 3.28Å; Y2600-R2797 VanDerWaalsContact CZ-NE 3.25Å; Y2600-R2797 PolarHBondContact OH-NH2 3.4Å; L2618-R2797 PolarHBondContact O-NH1 2.94Å; Y2669-R2797 VanDerWaalsContact CE1-NH2 3.3Å; I2717-R2797 CarbonylContact C-O 3.56Å; I2717-R2797 WeakPolarHBondContact CA-O 3.4Å; K2718-R2797 HydrophobicContact CB-CB 4.17Å; K2718-R2797 PolarHBondContact N-O 2.66Å; K2718-R2797 PolarHBondContact O-N 3.26Å; R2797-V2799 HydrophobicContact CG-CG2 4.19Å
2798	V	71.9	Confident	68.4	Low	11 Å²	11	33.1 Å²	33.1	7%	0.067	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	133.3	168.4	-173.7	0	0	0	0	109.2	G2670 I2672 I2700 I2702 V2715 S2716 I2717 I2809	G2670-V2798 PolarHBondContact N-O 2.75Å; G2670-V2798 PolarHBondContact O-N 2.88Å; I2672-V2798 HydrophobicContact CD1-CG2 3.9Å; I2672-V2798 HydrophobicContact CG1-CG2 4.04Å; I2700-V2798 HydrophobicContact CD1-CG2 3.95Å; I2700-V2798 HydrophobicContact CG1-CG2 4.48Å; I2700-V2798 HydrophobicContact CG2-CG1 4.43Å; I2700-V2798 HydrophobicContact CG2-CG2 4.15Å; I2702-V2798 HydrophobicContact CD1-CG1 4.09Å; V2715-V2798 HydrophobicContact CG1-CG1 4.01Å; S2716-V2798 CarbonylContact O-C 3.48Å; S2716-V2798 WeakPolarHBondContact O-CA 3.3Å; I2717-V2798 HydrophobicContact CD1-CG2 4.46Å; I2717-V2798 HydrophobicContact CG1-CG1 4.39Å; I2717-V2798 HydrophobicContact CG1-CG2 4.31Å; I2717-V2798 HydrophobicContact CG2-CG2 4.49Å; V2798-I2809 HydrophobicContact CB-CG2 4.48Å; V2798-I2809 HydrophobicContact CG1-CD1 4.28Å; V2798-I2809 HydrophobicContact CG1-CG2 4.44Å
2799	V	70.5	Confident	67	Low	12.5 Å²	12.5	33.1 Å²	33.1	8%	0.076	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	130.3	176.1	-171.6	0	0	0	0	108.9	L2651 Y2669 V2715 S2716 R2797 T2801	L2651-V2799 HydrophobicContact CD1-CB 3.79Å; L2651-V2799 HydrophobicContact CD1-CG1 3.81Å; L2651-V2799 HydrophobicContact CD1-CG2 4.1Å; Y2669-V2799 HydrophobicContact CD1-CG1 4.19Å; Y2669-V2799 HydrophobicContact CD1-CG2 4.2Å; Y2669-V2799 HydrophobicContact CE1-CG1 4.08Å; Y2669-V2799 HydrophobicContact CE1-CG2 4.41Å; V2715-V2799 CarbonylContact C-O 3.55Å; V2715-V2799 WeakPolarHBondContact CA-O 3.4Å; S2716-V2799 PolarHBondContact N-O 2.94Å; S2716-V2799 PolarHBondContact O-N 3.34Å; R2797-V2799 HydrophobicContact CG-CG2 4.19Å; V2799-T2801 HydrophobicContact CG1-CG2 4.02Å
2800	V	74.4	Confident	66	Low	2 Å²	2	37 Å²	37	1%	0.012	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	136.5	174.2	-177.8	0	0	0	0	108.8	V2668 E2678 I2702 M2704 G2714 V2715 V2804 A2806 I2809	V2668-V2800 HydrophobicContact CB-CB 4.33Å; V2668-V2800 PolarHBondContact N-O 2.63Å; V2668-V2800 PolarHBondContact O-N 2.75Å; E2678-V2800 WeakPolarHBondContact CB-O 3.21Å; E2678-V2800 WeakPolarHBondContact CG-O 3.37Å; I2702-V2800 HydrophobicContact CD1-CG2 3.92Å; I2702-V2800 HydrophobicContact CG2-CG2 4.15Å; M2704-V2800 HydrophobicContact CE-CG1 3.74Å; M2704-V2800 HydrophobicContact SD-CG1 3.66Å; G2714-V2800 WeakPolarHBondContact O-CA 3.26Å; V2715-V2800 HydrophobicContact CG1-CG2 4.41Å; V2715-V2800 HydrophobicContact CG2-CG1 4.46Å; V2715-V2800 HydrophobicContact CG2-CG2 4.26Å; V2800-V2804 HydrophobicContact CG1-CG2 3.76Å; V2800-A2806 HydrophobicContact CB-CB 4.36Å; V2800-A2806 HydrophobicContact CG1-CB 3.99Å; V2800-A2806 HydrophobicContact CG2-CB 4.43Å; V2800-I2809 HydrophobicContact CG2-CD1 3.96Å; V2800-I2809 HydrophobicContact CG2-CG1 4.5Å
2801	T	68	Low	65.2	Low	17 Å²	17	38.2 Å²	38.2	10%	0.104	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	157.6	-175.6	56.7	0	0	0	0	113.6	P2616 E2678 F2713 G2714 V2799	P2616-T2801 HydrophobicContact CB-CG2 4.2Å; P2616-T2801 HydrophobicContact CG-CG2 4.3Å; E2678-T2801 VanDerWaalsContact OE1-CA 3.24Å; E2678-T2801 WeakPolarHBondContact OE1-CA 3.46Å; F2713-T2801 CarbonylContact C-O 3.55Å; F2713-T2801 VanDerWaalsContact CA-O 3.23Å; F2713-T2801 WeakPolarHBondContact CA-O 3.13Å; F2713-T2801 VanDerWaalsContact CB-O 3.29Å; F2713-T2801 WeakPolarHBondContact CB-O 3.42Å; G2714-T2801 PolarHBondContact N-O 2.95Å; G2714-T2801 PolarHBondContact O-N 2.81Å; V2799-T2801 HydrophobicContact CG1-CG2 4.02Å
2802	G	69.9	Low	64.9	Low	11 Å²	11	39.3 Å²	39.3	11%	0.113	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	90.5	-148	170.4	0	0	0	0	0	114.6	E2678 V2804	E2678-G2802 PolarHBondContact OE1-N 2.81Å; G2802-V2804 PolarHBondContact O-N 2.9Å
2803	D	79	Confident	64.6	Low	13 Å²	13	41.9 Å²	41.9	7%	0.07	21%	0.206	C	C	.	.	S	Bend	trans	-85.2	47.5	-159.7	-56.8	-43.8	0	0	0	115	K2676 L2707 A2710 D2711 K2712	K2676-D2803 IonicContact NZ-OD1 3.33Å; K2676-D2803 PolarHBondContact NZ-OD1 3.03Å; L2707-D2803 HydrophobicContact CD1-CB 4.17Å; L2707-D2803 PolarHBondContact N-O 2.78Å; L2707-D2803 VanDerWaalsContact N-O 3.12Å; A2710-D2803 HydrophobicContact CB-CB 3.67Å; A2710-D2803 WeakPolarHBondContact CB-O 3.23Å; D2711-D2803 PolarHBondContact N-OD2 2.98Å; K2712-D2803 PolarHBondContact N-OD2 2.87Å; K2712-D2803 VanDerWaalsContact N-OD2 3.11Å; K2712-D2803 PolarHBondContact O-N 2.91Å
2804	V	73.5	Confident	63.9	Low	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	164	-174.8	-74.4	0	0	0	0	113.3	M2704 K2705 L2706 F2713 F2764 V2800 G2802	M2704-V2804 HydrophobicContact CE-CB 4.38Å; M2704-V2804 HydrophobicContact CE-CG1 3.98Å; M2704-V2804 HydrophobicContact CE-CG2 4.39Å; M2704-V2804 HydrophobicContact SD-CB 4.43Å; M2704-V2804 HydrophobicContact SD-CG2 4.22Å; K2705-V2804 CarbonylContact O-C 3.58Å; K2705-V2804 VanDerWaalsContact O-CA 3.24Å; K2705-V2804 WeakPolarHBondContact O-CA 3.43Å; L2706-V2804 HydrophobicContact CD2-CG1 3.96Å; F2713-V2804 HydrophobicContact CB-CB 4.42Å; F2713-V2804 HydrophobicContact CB-CG1 3.7Å; F2713-V2804 HydrophobicContact CB-CG2 3.9Å; F2713-V2804 HydrophobicContact CD1-CG1 3.72Å; F2713-V2804 HydrophobicContact CD2-CG1 4.29Å; F2713-V2804 HydrophobicContact CE1-CG1 4.39Å; F2713-V2804 HydrophobicContact CG-CG1 3.66Å; F2713-V2804 HydrophobicContact CG-CG2 4.44Å; F2764-V2804 HydrophobicContact CZ-CG1 4.5Å; V2800-V2804 HydrophobicContact CG1-CG2 3.76Å; G2802-V2804 PolarHBondContact O-N 2.9Å
2805	I	60.9	Low	62.9	Low	38 Å²	38	41.8 Å²	41.8	20%	0.195	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	102.2	169.9	-57.4	176.7	0	0	0	107.8	Q2677 Y2679 M2704 K2705 L2707 Q2807	Q2677-I2805 HydrophobicContact CB-CG1 4.36Å; Q2677-I2805 HydrophobicContact CB-CG2 4.23Å; Y2679-I2805 HydrophobicContact CE2-CG2 3.77Å; Y2679-I2805 WeakPolarHBondContact OH-CG2 3.34Å; M2704-I2805 CarbonylContact C-O 3.41Å; M2704-I2805 VanDerWaalsContact CA-O 3.24Å; M2704-I2805 WeakPolarHBondContact CA-O 3.44Å; K2705-I2805 HydrophobicContact CB-CB 4.41Å; K2705-I2805 PolarHBondContact N-O 2.81Å; K2705-I2805 PolarHBondContact O-N 2.84Å; L2707-I2805 HydrophobicContact CD2-CD1 3.72Å; L2707-I2805 HydrophobicContact CD2-CG1 3.77Å; L2707-I2805 HydrophobicContact CG-CG1 4.41Å; I2805-Q2807 PolarHBondContact O-N 2.75Å
2806	A	57.5	Low	61.2	Low	0 Å²	0	50.6 Å²	50.6	0%	0	24%	0.237	C	C	.	.			trans	-99.9	69.5	-167.6	0	0	0	0	0	114.8	Y2679 I2702 P2703 M2704 V2800 E2808	Y2679-A2806 VanDerWaalsContact CB-O 3.24Å; Y2679-A2806 WeakPolarHBondContact CB-O 3.21Å; Y2679-A2806 WeakPolarHBondContact CD1-O 3.39Å; Y2679-A2806 VanDerWaalsContact CD2-C 3.44Å; Y2679-A2806 HydrophobicContact CD2-CB 3.86Å; Y2679-A2806 VanDerWaalsContact CD2-N 3.27Å; Y2679-A2806 VanDerWaalsContact CD2-O 3.26Å; Y2679-A2806 WeakPolarHBondContact CD2-O 3.4Å; Y2679-A2806 HydrophobicContact CG-CB 4.3Å; I2702-A2806 HydrophobicContact CG2-CB 3.99Å; P2703-A2806 CarbonylContact O-C 3.59Å; P2703-A2806 VanDerWaalsContact O-C 3.25Å; P2703-A2806 WeakPolarHBondContact O-CA 3.32Å; M2704-A2806 HydrophobicContact CB-CB 4.47Å; M2704-A2806 HydrophobicContact CG-CB 3.76Å; M2704-A2806 HydrophobicContact SD-CB 3.7Å; V2800-A2806 HydrophobicContact CB-CB 4.36Å; V2800-A2806 HydrophobicContact CG1-CB 3.99Å; V2800-A2806 HydrophobicContact CG2-CB 4.43Å; A2806-E2808 PolarHBondContact O-N 3.15Å
2807	Q	56.3	Low	59.7	Low	98 Å²	98	58.4 Å²	58.4	46%	0.458	27%	0.268	S	S	.	.			trans	-27.7	-43.7	-172.1	-61	-166.4	-37.9	0	0	118.5	Y2679 P2703 L2763 I2805	Y2679-Q2807 WeakPolarHBondContact CE1-O 3.42Å; P2703-Q2807 HydrophobicContact CB-CB 4.41Å; P2703-Q2807 PolarHBondContact O-N 2.89Å; L2763-Q2807 VanDerWaalsContact CD1-CD 3.44Å; L2763-Q2807 HydrophobicContact CD1-CG 3.94Å; L2763-Q2807 VanDerWaalsContact CD1-OE1 3.31Å; I2805-Q2807 PolarHBondContact O-N 2.75Å
2808	E	59	Low	58.3	Low	66 Å²	66	60.9 Å²	60.9	31%	0.308	29%	0.291	S	S	.	.			trans	-155.4	163.7	174	59.2	176.6	-171.8	0	0	111.2	I2702 P2703 A2806 R2810	I2702-E2808 WeakPolarHBondContact CA-O 3.16Å; P2703-E2808 WeakPolarHBondContact CD-O 3.1Å; P2703-E2808 HydrophobicContact CG-CG 3.75Å; A2806-E2808 PolarHBondContact O-N 3.15Å; E2808-R2810 VanDerWaalsContact CD-NH2 3.35Å; E2808-R2810 HydrophobicContact CG-CG 4.5Å; E2808-R2810 IonicContact OE1-CZ 2.76Å; E2808-R2810 VanDerWaalsContact OE1-CZ 3.26Å; E2808-R2810 IonicContact OE1-NE 3.3Å; E2808-R2810 PolarHBondContact OE1-NE 3.02Å; E2808-R2810 IonicContact OE1-NH2 2.77Å; E2808-R2810 PolarHBondContact OE1-NH2 3.11Å; E2808-R2810 VanDerWaalsContact OE1-NH2 3.15Å; E2808-R2810 IonicContact OE2-CZ 2.62Å; E2808-R2810 IonicContact OE2-NE 2.74Å; E2808-R2810 PolarHBondContact OE2-NE 2.68Å; E2808-R2810 IonicContact OE2-NH2 3.52Å; E2808-R2810 PolarHBondContact OE2-NH2 3.22Å
2809	I	59.1	Low	56.1	Low	6 Å²	6	68.8 Å²	68.8	3%	0.031	33%	0.332	C	S	.	.			trans	-124.7	125.6	166.6	-58.6	169.9	0	0	0	107.4	Y2681 I2700 N2701 I2702 V2798 V2800	Y2681-I2809 WeakPolarHBondContact CD2-O 3.36Å; Y2681-I2809 HydrophobicContact CG-CB 4.29Å; Y2681-I2809 VanDerWaalsContact CG-O 3.29Å; I2700-I2809 HydrophobicContact CG2-CG2 3.88Å; N2701-I2809 CarbonylContact O-C 3.58Å; N2701-I2809 WeakPolarHBondContact O-CA 3.16Å; I2702-I2809 HydrophobicContact CD1-CG1 4.3Å; I2702-I2809 HydrophobicContact CD1-CG2 4.49Å; I2702-I2809 HydrophobicContact CG1-CG1 4.16Å; I2702-I2809 HydrophobicContact CG1-CG2 4.22Å; I2702-I2809 HydrophobicContact CG2-CG1 4.01Å; V2798-I2809 HydrophobicContact CB-CG2 4.48Å; V2798-I2809 HydrophobicContact CG1-CD1 4.28Å; V2798-I2809 HydrophobicContact CG1-CG2 4.44Å; V2800-I2809 HydrophobicContact CG2-CD1 3.96Å; V2800-I2809 HydrophobicContact CG2-CG1 4.5Å
2810	R	60.6	Low	53.8	Low	142 Å²	142	73.3 Å²	73.3	54%	0.536	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	110.4	178.8	-65.2	-168.2	-173.7	179	14.3	112.1	N2701 E2808	N2701-R2810 HydrophobicContact CB-CB 4.48Å; N2701-R2810 PolarHBondContact N-O 3.29Å; N2701-R2810 PolarHBondContact O-N 3.21Å; E2808-R2810 VanDerWaalsContact CD-NH2 3.35Å; E2808-R2810 HydrophobicContact CG-CG 4.5Å; E2808-R2810 IonicContact OE1-CZ 2.76Å; E2808-R2810 VanDerWaalsContact OE1-CZ 3.26Å; E2808-R2810 IonicContact OE1-NE 3.3Å; E2808-R2810 PolarHBondContact OE1-NE 3.02Å; E2808-R2810 IonicContact OE1-NH2 2.77Å; E2808-R2810 PolarHBondContact OE1-NH2 3.11Å; E2808-R2810 VanDerWaalsContact OE1-NH2 3.15Å; E2808-R2810 IonicContact OE2-CZ 2.62Å; E2808-R2810 IonicContact OE2-NE 2.74Å; E2808-R2810 PolarHBondContact OE2-NE 2.68Å; E2808-R2810 IonicContact OE2-NH2 3.52Å; E2808-R2810 PolarHBondContact OE2-NH2 3.22Å
2811	S	60.9	Low	51.5	Low	42 Å²	42	77 Å²	77	29%	0.294	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	118.9	170.7	58.4	0	0	0	0	111.8
2812	T	61.4	Low	49.6	Very low	61 Å²	61	79.4 Å²	79.4	37%	0.374	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	125.7	171.2	-59.6	0	0	0	0	109.6	W2698 L2699 L2814	W2698-T2812 CarbonylContact C-O 3.57Å; L2699-T2812 PolarHBondContact N-O 2.84Å; L2699-T2812 PolarHBondContact O-N 3.25Å; T2812-L2814 HydrophobicContact CG2-CD2 3.99Å; T2812-L2814 HydrophobicContact CG2-CG 4.47Å
2813	Q	60.3	Low	47.6	Very low	63 Å²	63	84.3 Å²	84.3	29%	0.294	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	130.7	171.8	-163	-172.7	60.3	0	0	110.2	W2698 K2823	W2698-Q2813 HydrophobicContact CD2-CB 4.35Å; W2698-Q2813 HydrophobicContact CD2-CG 4.06Å; W2698-Q2813 HydrophobicContact CE3-CB 3.85Å; W2698-Q2813 HydrophobicContact CE3-CG 4.05Å; W2698-Q2813 HydrophobicContact CH2-CB 4.32Å; W2698-Q2813 HydrophobicContact CH2-CG 4.18Å; W2698-Q2813 VanDerWaalsContact CH2-NE2 3.34Å; W2698-Q2813 HydrophobicContact CZ2-CG 4.19Å; W2698-Q2813 HydrophobicContact CZ3-CB 3.83Å; W2698-Q2813 HydrophobicContact CZ3-CG 4.1Å; Q2813-K2823 PolarHBondContact O-NZ 3.25Å
2814	L	45.9	Very low	45	Very low	66 Å²	66	86.6 Å²	86.6	35%	0.346	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	123.7	179.1	-59.2	175.7	0	0	0	108.7	K2697 L2699 T2812	K2697-L2814 CarbonylContact C-O 3.47Å; K2697-L2814 WeakPolarHBondContact CA-O 3.33Å; K2697-L2814 HydrophobicContact CB-CB 4.41Å; K2697-L2814 WeakPolarHBondContact CB-O 3.31Å; K2697-L2814 PolarHBondContact N-O 2.85Å; K2697-L2814 VanDerWaalsContact N-O 3.09Å; K2697-L2814 PolarHBondContact O-N 3.44Å; L2699-L2814 HydrophobicContact CB-CD1 4.1Å; L2699-L2814 HydrophobicContact CD1-CD1 4.12Å; L2699-L2814 HydrophobicContact CD2-CD1 4.35Å; L2699-L2814 HydrophobicContact CG-CD1 4.42Å; T2812-L2814 HydrophobicContact CG2-CD2 3.99Å; T2812-L2814 HydrophobicContact CG2-CG 4.47Å
2815	R	40.1	Very low	42.8	Very low	150 Å²	150	92.7 Å²	92.7	57%	0.566	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-86.6	149.4	159.5	-72.7	-175.6	173.2	-179.5	-4.6	107.3	E2859	R2815-E2859 IonicContact NH2-OE2 3Å
2816	R	29.2	Very low	41.1	Very low	192 Å²	192	98.3 Å²	98.3	73%	0.725	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-61.9	152.1	174.4	-65.9	-171.5	-173.5	-160.6	3	110.5	S2772	S2772-R2816 PolarHBondContact OG-NH2 2.87Å
2817	E	31.2	Very low	39.5	Very low	184 Å²	184	102.7 Å²	102.7	86%	0.86	51%	0.511	S	S	*	.	S	Bend	trans	-91.6	164.7	178.1	-70.6	-175.4	162	0	0	111.4
2818	P	35.4	Very low	38	Very low	105 Å²	105	107 Å²	107	68%	0.682	53%	0.525	S	S	*	.			cis	-135.5	126.2	-28	30.3	-11.2	0	0	0	113.7
2819	L	24	Very low	36.3	Very low	176 Å²	176	105.7 Å²	105.7	92%	0.921	53%	0.53	S	S	*	.	S	Bend	trans	-126.4	75.5	151.3	-79.4	179.6	0	0	0	110.5
2820	I	24	Very low	34.7	Very low	108 Å²	108	112.2 Å²	112.2	55%	0.554	56%	0.555	S	S	*	*	S	Bend	trans	48.6	76.3	156.8	-47.6	-177.7	0	0	0	115.8
2821	T	25.3	Very low	33.2	Very low	78 Å²	78	109.4 Å²	109.4	48%	0.479	55%	0.553	S	S	.	*			trans	52.9	127.5	136	61.5	0	0	0	0	121.4
2822	T	28.4	Very low	31.4	Very low	68 Å²	68	112 Å²	112	42%	0.417	56%	0.564	S	S	.	*			cis	-164	156.1	-20.6	-17.2	0	0	0	0	109.2	Y2830	T2822-Y2830 WeakPolarHBondContact O-CD2 3.37Å; T2822-Y2830 WeakPolarHBondContact OG1-CD1 3.34Å; T2822-Y2830 WeakPolarHBondContact OG1-CD2 3.17Å; T2822-Y2830 WeakPolarHBondContact OG1-CE1 3.26Å; T2822-Y2830 WeakPolarHBondContact OG1-CE2 3.49Å; T2822-Y2830 VanDerWaalsContact OG1-CZ 3.31Å
2823	K	27.5	Very low	29.8	Very low	115 Å²	115	115.7 Å²	115.7	50%	0.5	57%	0.574	S	S	.	*			trans	20.7	100.6	156	-75.2	177.4	172.5	176.4	0	117.9	Q2813	Q2813-K2823 PolarHBondContact O-NZ 3.25Å
2824	G	24.4	Very low	28.4	Very low	60 Å²	60	118.9 Å²	118.9	62%	0.619	58%	0.584	S	S	*	*			trans	-98.1	89.9	153.7	0	0	0	0	0	111
2825	D	26.7	Very low	27.9	Very low	128 Å²	128	121.3 Å²	121.3	68%	0.684	59%	0.593	S	S	*	*	S	Bend	trans	-146.5	112	151.1	-152	5.2	0	0	0	107.1
2826	Y	24.8	Very low	27.7	Very low	156 Å²	156	117.4 Å²	117.4	61%	0.612	59%	0.586	S	S	*	*	S	Bend	trans	56.4	107.6	-142	-44.3	-75.1	0	0	0	112.8	R2685 Y2828	R2685-Y2826 PolarHBondContact NH1-OH 2.84Å; Y2826-Y2828 VanDerWaalsContact C-N 3.29Å; Y2826-Y2828 PolarHBondContact O-N 2.84Å
2827	L	25.7	Very low	27.8	Very low	92 Å²	92	111.8 Å²	111.8	48%	0.482	57%	0.57	S	S	.	*			trans	-74.4	68.7	-174.7	-81.9	164.9	0	0	0	114.3	G2829 L2995 M2998	L2827-G2829 PolarHBondContact O-N 2.81Å; L2827-L2995 HydrophobicContact CB-CD2 3.96Å; L2827-L2995 HydrophobicContact CD1-CD2 3.8Å; L2827-M2998 HydrophobicContact CD1-SD 4.38Å
2828	Y	22.9	Very low	28	Very low	188 Å²	188	108.4 Å²	108.4	74%	0.737	55%	0.553	S	S	*	*			trans	-73.4	97.6	151.1	-84.8	-88.3	0	0	0	108	Y2826 Y2830	Y2826-Y2828 VanDerWaalsContact C-N 3.29Å; Y2826-Y2828 PolarHBondContact O-N 2.84Å; Y2828-Y2830 WeakPolarHBondContact O-CD2 3.19Å
2829	G	24.6	Very low	28.1	Very low	40 Å²	40	110.9 Å²	110.9	41%	0.412	55%	0.553	S	S	.	*			trans	-67.4	146.8	-160.9	0	0	0	0	0	116.2	L2827	L2827-G2829 PolarHBondContact O-N 2.81Å
2830	Y	24.5	Very low	28.6	Very low	142 Å²	142	108.2 Å²	108.2	56%	0.557	54%	0.538	S	S	*	.			trans	-115.5	155.7	170.3	-75.3	-86	0	0	0	110.9	T2822 Y2828	T2822-Y2830 WeakPolarHBondContact O-CD2 3.37Å; T2822-Y2830 WeakPolarHBondContact OG1-CD1 3.34Å; T2822-Y2830 WeakPolarHBondContact OG1-CD2 3.17Å; T2822-Y2830 WeakPolarHBondContact OG1-CE1 3.26Å; T2822-Y2830 WeakPolarHBondContact OG1-CE2 3.49Å; T2822-Y2830 VanDerWaalsContact OG1-CZ 3.31Å; Y2828-Y2830 WeakPolarHBondContact O-CD2 3.19Å
2831	V	29.1	Very low	29.1	Very low	83 Å²	83	110.6 Å²	110.6	50%	0.503	54%	0.541	S	S	.	.			trans	-111.6	120.6	-167.6	178	0	0	0	0	110
2832	L	24.3	Very low	29.6	Very low	98 Å²	98	111.6 Å²	111.6	51%	0.513	54%	0.543	S	S	.	.			trans	-97.5	124.4	167.6	-72.5	171.7	0	0	0	109.2
2833	K	26.9	Very low	29.7	Very low	137 Å²	137	112.7 Å²	112.7	60%	0.596	55%	0.55	S	S	*	*			trans	-73.3	140.1	178.1	-72.5	-178.2	177.8	179.2	0	111.1	E2835 T2836	K2833-E2835 WeakPolarHBondContact CD-OE2 3.45Å; K2833-E2835 PolarHBondContact O-N 2.72Å; K2833-T2836 WeakPolarHBondContact O-CB 3.41Å; K2833-T2836 PolarHBondContact O-N 2.76Å; K2833-T2836 VanDerWaalsContact O-N 3.17Å
2834	W	31.6	Very low	29.9	Very low	130 Å²	130	113.2 Å²	113.2	49%	0.492	57%	0.566	S	S	.	*	H	α-helix	trans	-62.7	-32.1	-178.2	177.4	-104.5	0	0	0	112.4	T2836 L2837 K2838	W2834-T2836 VanDerWaalsContact C-N 3.29Å; W2834-T2836 PolarHBondContact O-N 3.2Å; W2834-L2837 PolarHBondContact O-N 2.97Å; W2834-K2838 PolarHBondContact O-N 2.75Å
2835	E	35.4	Very low	30.3	Very low	118 Å²	118	115.5 Å²	115.5	55%	0.551	57%	0.567	S	S	*	*	H	α-helix	trans	-56.5	-40.3	175.1	-50.5	87.9	-90.6	0	0	112.6	K2833 K2838 K2839	K2833-E2835 WeakPolarHBondContact CD-OE2 3.45Å; K2833-E2835 PolarHBondContact O-N 2.72Å; E2835-K2838 PolarHBondContact O-N 2.96Å; E2835-K2839 PolarHBondContact O-N 2.81Å
2836	T	35.5	Very low	30.6	Very low	67 Å²	67	114.4 Å²	114.4	41%	0.411	56%	0.562	S	S	.	*	H	α-helix	trans	-67.7	-45.4	-179.8	-50.8	0	0	0	0	111.1	K2833 W2834 K2838 K2839 I2840	K2833-T2836 WeakPolarHBondContact O-CB 3.41Å; K2833-T2836 PolarHBondContact O-N 2.76Å; K2833-T2836 VanDerWaalsContact O-N 3.17Å; W2834-T2836 VanDerWaalsContact C-N 3.29Å; W2834-T2836 PolarHBondContact O-N 3.2Å; T2836-K2838 VanDerWaalsContact C-N 3.31Å; T2836-K2838 PolarHBondContact O-N 3.07Å; T2836-K2839 PolarHBondContact O-N 3.23Å; T2836-I2840 HydrophobicContact CG2-CD1 4.27Å; T2836-I2840 WeakPolarHBondContact O-CG1 3.2Å; T2836-I2840 PolarHBondContact O-N 2.89Å
2837	L	30.8	Very low	31	Very low	74 Å²	74	112 Å²	112	39%	0.387	56%	0.559	S	S	.	*	H	α-helix	trans	-61.3	-39.8	174.2	-83.5	165.1	0	0	0	111.8	W2834 I2840 Y2841	W2834-L2837 PolarHBondContact O-N 2.97Å; L2837-I2840 PolarHBondContact O-N 3.16Å; L2837-Y2841 HydrophobicContact CD2-CE2 4.47Å; L2837-Y2841 WeakPolarHBondContact O-CD2 3.44Å; L2837-Y2841 PolarHBondContact O-N 2.73Å
2838	K	36.4	Very low	31.3	Very low	114 Å²	114	116.5 Å²	116.5	50%	0.496	58%	0.575	S	S	.	*	H	α-helix	trans	-65.1	-46.8	178.3	-168.3	-177.3	174.6	-171.2	0	112.1	W2834 E2835 T2836 I2840 Y2841 D2842	W2834-K2838 PolarHBondContact O-N 2.75Å; E2835-K2838 PolarHBondContact O-N 2.96Å; T2836-K2838 VanDerWaalsContact C-N 3.31Å; T2836-K2838 PolarHBondContact O-N 3.07Å; K2838-I2840 VanDerWaalsContact C-N 3.28Å; K2838-I2840 PolarHBondContact O-N 3.35Å; K2838-Y2841 PolarHBondContact O-N 3.4Å; K2838-D2842 WeakPolarHBondContact CE-OD2 3.16Å; K2838-D2842 VanDerWaalsContact CG-OD2 3.32Å; K2838-D2842 WeakPolarHBondContact CG-OD2 3.5Å; K2838-D2842 IonicContact NZ-OD2 3.78Å; K2838-D2842 WeakPolarHBondContact O-CB 3.38Å; K2838-D2842 PolarHBondContact O-N 2.58Å
2839	K	36.6	Very low	31.6	Very low	157 Å²	157	114.1 Å²	114.1	68%	0.683	57%	0.568	S	S	*	*	H	α-helix	trans	-57.3	-40.4	177.2	-98.7	-163.4	172.2	-167.9	0	112.5	E2835 T2836 T2843	E2835-K2839 PolarHBondContact O-N 2.81Å; T2836-K2839 PolarHBondContact O-N 3.23Å; K2839-T2843 PolarHBondContact O-OG1 2.67Å
2840	I	35.9	Very low	31.8	Very low	120 Å²	120	119.6 Å²	119.6	62%	0.615	58%	0.577	S	S	*	*	H	α-helix	trans	-67.9	-39	180	-65.7	166	0	0	0	111.7	T2836 L2837 K2838	T2836-I2840 HydrophobicContact CG2-CD1 4.27Å; T2836-I2840 WeakPolarHBondContact O-CG1 3.2Å; T2836-I2840 PolarHBondContact O-N 2.89Å; L2837-I2840 PolarHBondContact O-N 3.16Å; K2838-I2840 VanDerWaalsContact C-N 3.28Å; K2838-I2840 PolarHBondContact O-N 3.35Å
2841	Y	34.3	Very low	32.1	Very low	157 Å²	157	122.8 Å²	122.8	62%	0.616	59%	0.593	S	S	*	*	H	α-helix	trans	-85.4	-31.3	-175.8	-92.3	-76	0	0	0	115.1	L2837 K2838 T2843	L2837-Y2841 HydrophobicContact CD2-CE2 4.47Å; L2837-Y2841 WeakPolarHBondContact O-CD2 3.44Å; L2837-Y2841 PolarHBondContact O-N 2.73Å; K2838-Y2841 PolarHBondContact O-N 3.4Å; Y2841-T2843 VanDerWaalsContact C-N 3.32Å
2842	D	35.8	Very low	31.9	Very low	99 Å²	99	124.6 Å²	124.6	53%	0.529	59%	0.591	S	S	.	*	S	Bend	trans	-89.9	5.3	-174.4	-68.8	11.7	0	0	0	112.9	K2838 P2844	K2838-D2842 WeakPolarHBondContact CE-OD2 3.16Å; K2838-D2842 VanDerWaalsContact CG-OD2 3.32Å; K2838-D2842 WeakPolarHBondContact CG-OD2 3.5Å; K2838-D2842 IonicContact NZ-OD2 3.78Å; K2838-D2842 WeakPolarHBondContact O-CB 3.38Å; K2838-D2842 PolarHBondContact O-N 2.58Å; D2842-P2844 VanDerWaalsContact O-CD 3.25Å; D2842-P2844 WeakPolarHBondContact O-CD 3.41Å
2843	T	29.4	Very low	31.8	Very low	91 Å²	91	125.4 Å²	125.4	56%	0.558	61%	0.605	S	S	*	*			trans	-80.6	110.1	174.8	-61.3	0	0	0	0	109.8	K2839 Y2841 V2845	K2839-T2843 PolarHBondContact O-OG1 2.67Å; Y2841-T2843 VanDerWaalsContact C-N 3.32Å; T2843-V2845 HydrophobicContact CG2-CG2 4.18Å
2844	P	31.3	Very low	31.6	Very low	127 Å²	127	126.5 Å²	126.5	83%	0.825	62%	0.616	S	S	*	*			trans	-81.1	126.9	-176	-6.8	26.1	0	0	0	110.4	D2842	D2842-P2844 VanDerWaalsContact O-CD 3.25Å; D2842-P2844 WeakPolarHBondContact O-CD 3.41Å
2845	V	32.7	Very low	31.2	Very low	108 Å²	108	128.4 Å²	128.4	66%	0.655	63%	0.628	S	S	*	*			trans	-133.7	129.7	179.1	-175.1	0	0	0	0	110.2	T2843 D2847	T2843-V2845 HydrophobicContact CG2-CG2 4.18Å; V2845-D2847 PolarHBondContact O-N 2.79Å
2846	D	33.7	Very low	30.7	Very low	105 Å²	105	128.1 Å²	128.1	56%	0.561	63%	0.634	S	S	*	*			trans	-56.2	127.7	178.3	177.8	-4.6	0	0	0	112.3	K2848 K2849	D2846-K2848 PolarHBondContact O-N 2.87Å; D2846-K2848 WeakPolarHBondContact OD1-CB 3.49Å; D2846-K2848 PolarHBondContact OD1-N 3.25Å; D2846-K2849 PolarHBondContact O-N 3.13Å
2847	D	33.8	Very low	30.2	Very low	105 Å²	105	129.6 Å²	129.6	56%	0.561	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-54.1	-24.5	177.7	-89.4	-53.2	0	0	0	113.5	V2845 K2849 R2850	V2845-D2847 PolarHBondContact O-N 2.79Å; D2847-K2849 VanDerWaalsContact C-N 3.26Å; D2847-K2849 PolarHBondContact O-N 2.63Å; D2847-R2850 WeakPolarHBondContact O-CB 3.39Å; D2847-R2850 PolarHBondContact O-N 2.96Å; D2847-R2850 WeakPolarHBondContact OD1-CD 3.38Å; D2847-R2850 IonicContact OD1-CZ 2.67Å; D2847-R2850 IonicContact OD1-NE 2.74Å; D2847-R2850 IonicContact OD1-NH1 3.86Å; D2847-R2850 PolarHBondContact OD1-NH1 2.75Å
2848	K	31.7	Very low	30	Very low	187 Å²	187	128.2 Å²	128.2	81%	0.813	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-61.7	-28.6	175.6	-73.6	-175.5	176.1	179.7	0	113.8	D2846 R2850	D2846-K2848 PolarHBondContact O-N 2.87Å; D2846-K2848 WeakPolarHBondContact OD1-CB 3.49Å; D2846-K2848 PolarHBondContact OD1-N 3.25Å; K2848-R2850 VanDerWaalsContact C-N 3.31Å
2849	K	29.3	Very low	29.5	Very low	137 Å²	137	129.7 Å²	129.7	60%	0.596	65%	0.649	S	S	*	*	G	3₁₀ helix	trans	-79.2	-11.9	173.4	-75.7	-169.4	176.5	-174.8	0	113.1	D2846 D2847 K2851	D2846-K2849 PolarHBondContact O-N 3.13Å; D2847-K2849 VanDerWaalsContact C-N 3.26Å; D2847-K2849 PolarHBondContact O-N 2.63Å; K2849-K2851 VanDerWaalsContact C-N 3.35Å; K2849-K2851 PolarHBondContact O-N 3.37Å
2850	R	29.8	Very low	29.2	Very low	156 Å²	156	130.1 Å²	130.1	59%	0.589	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	-14.1	-165	-153.7	169.8	-176.1	-171.4	-0.9	115.4	D2847 K2848 N2938	D2847-R2850 WeakPolarHBondContact O-CB 3.39Å; D2847-R2850 PolarHBondContact O-N 2.96Å; D2847-R2850 WeakPolarHBondContact OD1-CD 3.38Å; D2847-R2850 IonicContact OD1-CZ 2.67Å; D2847-R2850 IonicContact OD1-NE 2.74Å; D2847-R2850 IonicContact OD1-NH1 3.86Å; D2847-R2850 PolarHBondContact OD1-NH1 2.75Å; K2848-R2850 VanDerWaalsContact C-N 3.31Å; R2850-N2938 PolarHBondContact NH2-OD1 3.38Å
2851	K	30.2	Very low	28.8	Very low	208 Å²	208	130.1 Å²	130.1	90%	0.904	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-17.8	178.4	-88.1	-167.2	174.1	-172.5	0	114.9	K2849	K2849-K2851 VanDerWaalsContact C-N 3.35Å; K2849-K2851 PolarHBondContact O-N 3.37Å
2852	R	24.3	Very low	28.4	Very low	121 Å²	121	128.3 Å²	128.3	46%	0.457	65%	0.654	S	S	.	*	S	Bend	trans	-128.1	126.4	178	-64	-172.7	-179.7	-150.6	12.7	110.2
2853	S	23	Very low	28.4	Very low	116 Å²	116	126 Å²	126	81%	0.811	64%	0.641	S	S	*	*	S	Bend	trans	48.7	88.6	174.9	59.8	0	0	0	0	118.3
2854	L	22.8	Very low	28.4	Very low	159 Å²	159	125.4 Å²	125.4	83%	0.832	64%	0.637	S	S	*	*				-160.1	74.8	123.5	-149	77.2	0	0	0	112.8	V2856	L2854-V2856 HydrophobicContact CD2-CG2 4.03Å; L2854-V2856 HydrophobicContact CG-CG2 4.03Å; L2854-V2856 PolarHBondContact O-N 2.9Å
2855	K	23.2	Very low	28.4	Very low	170 Å²	170	128.2 Å²	128.2	74%	0.739	64%	0.639	S	S	*	*			trans	-87.5	83.2	-179.8	-154.7	-170.6	-174.9	-154.1	0	110.6	E2857	K2855-E2857 HydrophobicContact CD-CG 4.2Å; K2855-E2857 WeakPolarHBondContact CD-OE1 3.32Å; K2855-E2857 WeakPolarHBondContact CE-OE1 3.41Å; K2855-E2857 HydrophobicContact CG-CG 4.02Å; K2855-E2857 IonicContact NZ-OE1 2.67Å; K2855-E2857 PolarHBondContact NZ-OE1 3.12Å; K2855-E2857 PolarHBondContact O-N 3.38Å
2856	V	25.1	Very low	28.3	Very low	112 Å²	112	125 Å²	125	68%	0.679	62%	0.622	S	S	*	*			trans	-75.7	86	-178.3	-174.9	0	0	0	0	110.7	L2854 G2858	L2854-V2856 HydrophobicContact CD2-CG2 4.03Å; L2854-V2856 HydrophobicContact CG-CG2 4.03Å; L2854-V2856 PolarHBondContact O-N 2.9Å; V2856-G2858 PolarHBondContact O-N 3.35Å
2857	E	23.7	Very low	28.7	Very low	99 Å²	99	127 Å²	127	46%	0.463	63%	0.625	S	S	.	*			trans	-86.8	92.2	-177.9	-67.1	178.2	144	0	0	112	R2692 K2855	R2692-E2857 IonicContact CZ-OE2 2.71Å; R2692-E2857 IonicContact NH2-OE2 2.77Å; R2692-E2857 PolarHBondContact NH2-OE2 3.28Å; K2855-E2857 HydrophobicContact CD-CG 4.2Å; K2855-E2857 WeakPolarHBondContact CD-OE1 3.32Å; K2855-E2857 WeakPolarHBondContact CE-OE1 3.41Å; K2855-E2857 HydrophobicContact CG-CG 4.02Å; K2855-E2857 IonicContact NZ-OE1 2.67Å; K2855-E2857 PolarHBondContact NZ-OE1 3.12Å; K2855-E2857 PolarHBondContact O-N 3.38Å
2858	G	27.5	Very low	29.2	Very low	45 Å²	45	123 Å²	123	46%	0.464	60%	0.603	S	S	.	*			trans	-97.4	138.2	161.6	0	0	0	0	0	110.7	V2856 Y2860	V2856-G2858 PolarHBondContact O-N 3.35Å; G2858-Y2860 VanDerWaalsContact O-CD2 3.29Å; G2858-Y2860 WeakPolarHBondContact O-CD2 3.06Å; G2858-Y2860 WeakPolarHBondContact O-CE2 3.12Å; G2858-Y2860 PolarHBondContact O-N 3.46Å
2859	E	26.3	Very low	29.6	Very low	145 Å²	145	114.7 Å²	114.7	68%	0.678	57%	0.568	S	S	*	*			trans	-62.1	107.4	-175.4	-68.5	177.8	117	0	0	112.3	R2815	R2815-E2859 IonicContact NH2-OE2 3Å
2860	Y	28.9	Very low	30.2	Very low	166 Å²	166	108.8 Å²	108.8	65%	0.651	54%	0.543	S	S	*	.			trans	-81.2	132.3	171.2	-55.3	-79.9	0	0	0	110.2	G2858 D2862	G2858-Y2860 VanDerWaalsContact O-CD2 3.29Å; G2858-Y2860 WeakPolarHBondContact O-CD2 3.06Å; G2858-Y2860 WeakPolarHBondContact O-CE2 3.12Å; G2858-Y2860 PolarHBondContact O-N 3.46Å; Y2860-D2862 PolarHBondContact O-N 2.67Å
2861	V	28.4	Very low	30.5	Very low	119 Å²	119	103.5 Å²	103.5	72%	0.721	52%	0.524	S	S	*	.			trans	-79.1	104.5	151.5	-173.9	0	0	0	0	106	I2863	V2861-I2863 HydrophobicContact CB-CG1 4.47Å; V2861-I2863 HydrophobicContact CG1-CG1 4.14Å; V2861-I2863 HydrophobicContact CG1-CG2 4.49Å; V2861-I2863 WeakPolarHBondContact O-CG1 3.41Å; V2861-I2863 PolarHBondContact O-N 2.88Å
2862	D	26.5	Very low	31.1	Very low	120 Å²	120	93.8 Å²	93.8	64%	0.642	48%	0.482	S	S	*	.			trans	-69.8	122.6	164.8	-167.7	-30	0	0	0	107.8	Y2860 T2864	Y2860-D2862 PolarHBondContact O-N 2.67Å; D2862-T2864 VanDerWaalsContact OD1-CB 3.28Å; D2862-T2864 WeakPolarHBondContact OD1-CB 3.29Å; D2862-T2864 WeakPolarHBondContact OD1-CG2 3.41Å; D2862-T2864 PolarHBondContact OD1-N 2.94Å; D2862-T2864 PolarHBondContact OD1-OG1 3.31Å
2863	I	33.9	Very low	31.7	Very low	51 Å²	51	93.5 Å²	93.5	26%	0.262	48%	0.481	S	S	.	.			trans	-120.9	14.1	-175.2	-3.6	174	0	0	0	112.2	V2861 E2865 S2866 I2868 D2985	V2861-I2863 HydrophobicContact CB-CG1 4.47Å; V2861-I2863 HydrophobicContact CG1-CG1 4.14Å; V2861-I2863 HydrophobicContact CG1-CG2 4.49Å; V2861-I2863 WeakPolarHBondContact O-CG1 3.41Å; V2861-I2863 PolarHBondContact O-N 2.88Å; I2863-E2865 VanDerWaalsContact C-N 3.28Å; I2863-E2865 PolarHBondContact O-N 3.1Å; I2863-E2865 VanDerWaalsContact O-N 3.14Å; I2863-S2866 PolarHBondContact O-N 3.39Å; I2863-I2868 HydrophobicContact CB-CD1 3.67Å; I2863-I2868 HydrophobicContact CD1-CD1 3.83Å; I2863-I2868 HydrophobicContact CG1-CD1 4.31Å; I2863-I2868 HydrophobicContact CG2-CD1 3.64Å; I2863-I2868 HydrophobicContact CG2-CG1 4.16Å; I2863-D2985 WeakPolarHBondContact CD1-O 3.2Å
2864	T	30.7	Very low	32.8	Very low	77 Å²	77	88.4 Å²	88.4	47%	0.472	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-36.9	-172.3	41	0	0	0	0	115.1	D2862	D2862-T2864 VanDerWaalsContact OD1-CB 3.28Å; D2862-T2864 WeakPolarHBondContact OD1-CB 3.29Å; D2862-T2864 WeakPolarHBondContact OD1-CG2 3.41Å; D2862-T2864 PolarHBondContact OD1-N 2.94Å; D2862-T2864 PolarHBondContact OD1-OG1 3.31Å
2865	E	30.7	Very low	33.5	Very low	186 Å²	186	84.7 Å²	84.7	87%	0.869	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-17.1	179.6	-60.1	-154.3	129.5	0	0	114.5	I2863	I2863-E2865 VanDerWaalsContact C-N 3.28Å; I2863-E2865 PolarHBondContact O-N 3.1Å; I2863-E2865 VanDerWaalsContact O-N 3.14Å
2866	S	31.1	Very low	34.4	Very low	42 Å²	42	79.1 Å²	79.1	29%	0.294	40%	0.404	S	S	.	.			trans	-85.6	130.3	-169.3	-77.1	0	0	0	0	113.5	I2863 I2868	I2863-S2866 PolarHBondContact O-N 3.39Å; S2866-I2868 PolarHBondContact O-N 3.48Å
2867	K	41.4	Very low	35.1	Very low	147 Å²	147	77.7 Å²	77.7	64%	0.639	39%	0.388	S	S	*	.			trans	-78.4	67.8	166.9	-67.8	170.4	-175.7	164.8	0	109.6	L2869	K2867-L2869 PolarHBondContact O-N 3.06Å
2868	I	44.6	Very low	35.8	Very low	19 Å²	19	80.7 Å²	80.7	10%	0.097	40%	0.4	C	S	.	.			trans	-60	136.1	-166	-61.8	163.7	0	0	0	111.8	I2863 S2866 S2962 V2984 A3000	I2863-I2868 HydrophobicContact CB-CD1 3.67Å; I2863-I2868 HydrophobicContact CD1-CD1 3.83Å; I2863-I2868 HydrophobicContact CG1-CD1 4.31Å; I2863-I2868 HydrophobicContact CG2-CD1 3.64Å; I2863-I2868 HydrophobicContact CG2-CG1 4.16Å; S2866-I2868 PolarHBondContact O-N 3.48Å; I2868-S2962 PolarHBondContact O-N 3.08Å; I2868-S2962 VanDerWaalsContact O-N 3.14Å; I2868-V2984 WeakPolarHBondContact CD1-O 3.4Å; I2868-A3000 HydrophobicContact CG2-CB 4.09Å
2869	L	39.8	Very low	36.6	Very low	14 Å²	14	82.4 Å²	82.4	7%	0.073	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	90.5	-177.7	-163.3	-179.6	0	0	0	106.2	K2867 F2871 L2960 F2961 E3003 I3006	K2867-L2869 PolarHBondContact O-N 3.06Å; L2869-F2871 PolarHBondContact O-N 2.93Å; L2869-L2960 CarbonylContact C-O 3.54Å; L2869-L2960 VanDerWaalsContact CA-O 3.26Å; L2869-L2960 WeakPolarHBondContact CA-O 3.42Å; L2869-F2961 HydrophobicContact CD1-CD1 3.67Å; L2869-F2961 HydrophobicContact CD1-CE1 3.61Å; L2869-F2961 HydrophobicContact CD2-CD1 3.91Å; L2869-F2961 HydrophobicContact CD2-CD2 4.35Å; L2869-F2961 HydrophobicContact CD2-CE1 3.7Å; L2869-F2961 HydrophobicContact CD2-CE2 4.14Å; L2869-F2961 HydrophobicContact CD2-CG 4.22Å; L2869-F2961 HydrophobicContact CD2-CZ 3.82Å; L2869-F2961 HydrophobicContact CG-CD1 3.48Å; L2869-F2961 VanDerWaalsContact CG-CD1 3.48Å; L2869-F2961 HydrophobicContact CG-CE1 3.68Å; L2869-F2961 HydrophobicContact CG-CG 3.95Å; L2869-F2961 HydrophobicContact CG-CZ 4.3Å; L2869-E3003 HydrophobicContact CD1-CB 4.3Å; L2869-E3003 HydrophobicContact CD1-CG 4.43Å; L2869-I3006 HydrophobicContact CB-CD1 3.78Å; L2869-I3006 HydrophobicContact CD1-CD1 4.35Å; L2869-I3006 HydrophobicContact CD2-CD1 4.36Å; L2869-I3006 HydrophobicContact CG-CD1 4.38Å; L2869-I3006 WeakPolarHBondContact O-CD1 2.85Å
2870	L	42.5	Very low	37.4	Very low	13 Å²	13	82 Å²	82	7%	0.068	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	111.4	-170	-167.1	78	0	0	0	110.7	T2872 F2887 K2959 L2960 A2987 M2998 V2999 A3000	L2870-T2872 HydrophobicContact CD2-CG2 3.8Å; L2870-T2872 HydrophobicContact CG-CG2 4.05Å; L2870-F2887 HydrophobicContact CD2-CE1 3.8Å; L2870-F2887 HydrophobicContact CD2-CZ 4.35Å; L2870-K2959 VanDerWaalsContact O-CA 3.29Å; L2870-K2959 WeakPolarHBondContact O-CA 3.19Å; L2870-L2960 PolarHBondContact N-O 2.67Å; L2870-L2960 PolarHBondContact O-N 2.88Å; L2870-L2960 VanDerWaalsContact O-N 3.13Å; L2870-A2987 HydrophobicContact CD2-CB 3.9Å; L2870-M2998 HydrophobicContact CD1-CE 3.65Å; L2870-M2998 HydrophobicContact CD1-CG 3.89Å; L2870-M2998 HydrophobicContact CD2-CE 4.22Å; L2870-V2999 WeakPolarHBondContact CA-O 3.5Å; L2870-A3000 HydrophobicContact CD1-CB 4.26Å
2871	F	35.6	Very low	38.5	Very low	45 Å²	45	81.7 Å²	81.7	20%	0.197	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	119.9	167.2	-179.4	-76.1	0	0	0	108.8	L2869 R2873 K2959 K2997 M2998 V2999	L2869-F2871 PolarHBondContact O-N 2.93Å; F2871-R2873 HydrophobicContact CE1-CB 4.26Å; F2871-R2873 HydrophobicContact CE1-CG 3.94Å; F2871-R2873 HydrophobicContact CZ-CG 4.07Å; F2871-K2959 HydrophobicContact CD2-CD 4.3Å; F2871-K2959 VanDerWaalsContact CD2-CE 3.49Å; F2871-K2959 HydrophobicContact CD2-CG 4.11Å; F2871-K2997 HydrophobicContact CE1-CB 4.5Å; F2871-K2997 HydrophobicContact CE1-CD 4.49Å; F2871-M2998 CarbonylContact O-C 3.55Å; F2871-M2998 VanDerWaalsContact O-CA 3.28Å; F2871-M2998 WeakPolarHBondContact O-CA 3.4Å; F2871-V2999 HydrophobicContact CB-CB 4.32Å; F2871-V2999 PolarHBondContact N-O 3.47Å; F2871-V2999 PolarHBondContact O-N 3.16Å
2872	T	42.2	Very low	39.9	Very low	3 Å²	3	78.8 Å²	78.8	2%	0.018	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	135.3	166	61.8	0	0	0	0	111	L2870 S2957 L2958 I2989 L2995 K2997 M2998	L2870-T2872 HydrophobicContact CD2-CG2 3.8Å; L2870-T2872 HydrophobicContact CG-CG2 4.05Å; T2872-S2957 CarbonylContact O-C 3.59Å; T2872-S2957 VanDerWaalsContact O-CA 3.28Å; T2872-S2957 WeakPolarHBondContact O-CA 3.32Å; T2872-L2958 PolarHBondContact N-O 3.04Å; T2872-L2958 PolarHBondContact O-N 3.45Å; T2872-L2958 VanDerWaalsContact OG1-CB 3.32Å; T2872-L2958 WeakPolarHBondContact OG1-CB 3.28Å; T2872-I2989 HydrophobicContact CG2-CD1 4.29Å; T2872-L2995 HydrophobicContact CG2-CD1 4.36Å; T2872-K2997 VanDerWaalsContact CA-O 3.31Å; T2872-K2997 WeakPolarHBondContact CA-O 3.39Å; T2872-M2998 HydrophobicContact CG2-CG 4.19Å
2873	R	38.2	Very low	41.8	Very low	116 Å²	116	73.2 Å²	73.2	44%	0.438	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	125.3	157.6	-93.3	-172.5	178.6	171.3	2.5	109	F2871 I2956 D2970 Y2996 K2997	F2871-R2873 HydrophobicContact CE1-CB 4.26Å; F2871-R2873 HydrophobicContact CE1-CG 3.94Å; F2871-R2873 HydrophobicContact CZ-CG 4.07Å; R2873-I2956 CarbonylContact C-O 3.56Å; R2873-I2956 VanDerWaalsContact CA-O 3.32Å; R2873-I2956 WeakPolarHBondContact CA-O 3.42Å; R2873-D2970 IonicContact NH2-OD2 3.79Å; R2873-Y2996 HydrophobicContact CB-CD1 4.31Å; R2873-Y2996 WeakPolarHBondContact O-CB 3.15Å; R2873-Y2996 PolarHBondContact O-N 3.49Å; R2873-K2997 PolarHBondContact N-O 2.95Å; R2873-K2997 PolarHBondContact O-N 2.81Å
2874	V	46.5	Very low	43.3	Very low	8 Å²	8	71.7 Å²	71.7	5%	0.048	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	126.7	-174.2	-170.4	0	0	0	0	110.3	F2883 A2955 I2956 V2993 L2995	V2874-F2883 HydrophobicContact CG1-CE2 4.42Å; V2874-F2883 HydrophobicContact CG1-CZ 4.34Å; V2874-A2955 WeakPolarHBondContact O-CA 3.44Å; V2874-I2956 PolarHBondContact N-O 2.77Å; V2874-I2956 PolarHBondContact O-N 2.97Å; V2874-V2993 HydrophobicContact CG1-CB 3.61Å; V2874-V2993 HydrophobicContact CG1-CG1 3.52Å; V2874-V2993 HydrophobicContact CG1-CG2 4.34Å; V2874-L2995 HydrophobicContact CG2-CD1 4.07Å
2875	L	36.5	Very low	44.9	Very low	82 Å²	82	68.2 Å²	68.2	43%	0.429	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	129.6	170.3	-76.7	163.9	0	0	0	108.1	A2955 I2994 Y2996	L2875-A2955 HydrophobicContact CD2-CB 4.09Å; L2875-I2994 HydrophobicContact CB-CB 4.41Å; L2875-I2994 PolarHBondContact N-O 2.87Å; L2875-I2994 WeakPolarHBondContact O-CA 3.4Å; L2875-I2994 WeakPolarHBondContact O-CB 3.33Å; L2875-I2994 PolarHBondContact O-N 3.13Å; L2875-Y2996 HydrophobicContact CD1-CD2 4.34Å
2876	L	43.4	Very low	46.4	Very low	53 Å²	53	60.1 Å²	60.1	28%	0.277	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	143.5	172.3	-71.1	163.3	0	0	0	109.9	F2883 A2953 V2993	L2876-F2883 HydrophobicContact CD2-CD1 3.72Å; L2876-F2883 HydrophobicContact CD2-CE1 4.11Å; L2876-A2953 WeakPolarHBondContact CD1-O 3.38Å; L2876-V2993 HydrophobicContact CD2-CG1 4.01Å
2877	K	37.9	Very low	48.1	Very low	82 Å²	82	58.2 Å²	58.2	36%	0.357	28%	0.275	S	S	.	.			trans	-66.5	166	165.4	-74.7	179.3	176.6	170.9	0	109.4	T2879 D2992 V2993 I2994	K2877-T2879 PolarHBondContact O-N 3.15Å; K2877-D2992 WeakPolarHBondContact CB-OD1 3.37Å; K2877-D2992 VanDerWaalsContact CD-OD1 3.29Å; K2877-D2992 WeakPolarHBondContact CD-OD1 3.37Å; K2877-D2992 PolarHBondContact N-O 3.35Å; K2877-V2993 WeakPolarHBondContact CE-O 3.42Å; K2877-I2994 HydrophobicContact CD-CG1 4.42Å; K2877-I2994 HydrophobicContact CG-CD1 4.11Å; K2877-I2994 HydrophobicContact CG-CG1 3.49Å; K2877-I2994 VanDerWaalsContact CG-CG1 3.49Å
2878	K	39	Very low	49.1	Very low	161 Å²	161	52.1 Å²	52.1	70%	0.7	25%	0.249	S	C	*	.	S	Bend	trans	-64.3	-31.4	179	-80.9	-168.7	177.4	-171.4	0	112.1
2879	T	43.5	Very low	50.2	Low	82 Å²	82	51.5 Å²	51.5	50%	0.503	25%	0.246	S	C	.	.	S	Bend	trans	-71.3	135.6	170.9	42.1	0	0	0	0	110.3	K2877 D2992	K2877-T2879 PolarHBondContact O-N 3.15Å; T2879-D2992 VanDerWaalsContact C-OD2 3.32Å; T2879-D2992 WeakPolarHBondContact CB-OD2 3.11Å; T2879-D2992 VanDerWaalsContact OG1-CG 3.25Å; T2879-D2992 PolarHBondContact OG1-OD1 2.93Å; T2879-D2992 PolarHBondContact OG1-OD2 2.85Å
2880	R	44.3	Very low	51.2	Low	137 Å²	137	55 Å²	55	52%	0.517	26%	0.261	S	S	.	.			trans	-108.6	41.5	-157.3	-74.2	-174.5	162.6	-130.6	-4.9	114.9	P2951	R2880-P2951 HydrophobicContact CB-CB 4.32Å; R2880-P2951 WeakPolarHBondContact O-CG 3.46Å
2881	K	51.4	Low	51.9	Low	158 Å²	158	55.5 Å²	55.5	69%	0.687	26%	0.264	S	S	*	.			trans	-76.6	153	169.9	-70.1	175.4	-178.2	170.9	0	110.4	D2992	K2881-D2992 HydrophobicContact CB-CB 4.01Å
2882	A	58.9	Low	52.7	Low	58 Å²	58	56.4 Å²	56.4	48%	0.479	28%	0.276	S	S	.	.			trans	-65.3	161	172.9	0	0	0	0	0	110.2	F2949	A2882-F2949 WeakPolarHBondContact CB-O 3.45Å
2883	F	65.5	Low	52.7	Low	4 Å²	4	61.6 Å²	61.6	2%	0.018	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	156.2	176.8	90.4	-91.8	0	0	0	110.7	V2874 L2876 V2885 F2949 I2956 I2989 D2990 V2993	V2874-F2883 HydrophobicContact CG1-CE2 4.42Å; V2874-F2883 HydrophobicContact CG1-CZ 4.34Å; L2876-F2883 HydrophobicContact CD2-CD1 3.72Å; L2876-F2883 HydrophobicContact CD2-CE1 4.11Å; F2883-V2885 HydrophobicContact CD2-CG2 4.19Å; F2883-V2885 HydrophobicContact CE2-CG2 3.65Å; F2883-F2949 HydrophobicContact CD1-CB 3.58Å; F2883-F2949 HydrophobicContact CD1-CG 4.33Å; F2883-F2949 HydrophobicContact CD2-CD2 4.19Å; F2883-F2949 HydrophobicContact CE1-CB 3.35Å; F2883-F2949 HydrophobicContact CE1-CD2 4.06Å; F2883-F2949 AromaticContact CE1-CG 3.74Å; F2883-F2949 HydrophobicContact CE1-CG 3.74Å; F2883-F2949 HydrophobicContact CE2-CB 4.47Å; F2883-F2949 AromaticContact CE2-CD2 3.69Å; F2883-F2949 HydrophobicContact CE2-CD2 3.69Å; F2883-F2949 HydrophobicContact CE2-CE2 4.25Å; F2883-F2949 HydrophobicContact CE2-CG 4.23Å; F2883-F2949 HydrophobicContact CG-CB 4.25Å; F2883-F2949 HydrophobicContact CZ-CB 3.84Å; F2883-F2949 HydrophobicContact CZ-CD1 4.39Å; F2883-F2949 AromaticContact CZ-CD2 3.61Å; F2883-F2949 HydrophobicContact CZ-CD2 3.61Å; F2883-F2949 HydrophobicContact CZ-CE2 4.28Å; F2883-F2949 AromaticContact CZ-CG 3.68Å; F2883-F2949 HydrophobicContact CZ-CG 3.68Å; F2883-F2949 PolarHBondContact N-O 3.3Å; F2883-F2949 PolarHBondContact O-N 3.12Å; F2883-I2956 HydrophobicContact CE1-CD1 3.78Å; F2883-I2956 HydrophobicContact CZ-CD1 3.64Å; F2883-I2989 HydrophobicContact CD2-CG2 4.19Å; F2883-D2990 CarbonylContact C-O 3.55Å; F2883-D2990 WeakPolarHBondContact CA-O 3.44Å; F2883-D2990 WeakPolarHBondContact CB-O 3.37Å; F2883-V2993 HydrophobicContact CB-CG1 3.74Å; F2883-V2993 HydrophobicContact CD1-CG1 3.69Å; F2883-V2993 HydrophobicContact CD2-CG1 3.75Å; F2883-V2993 HydrophobicContact CE1-CG1 4.14Å; F2883-V2993 HydrophobicContact CE2-CG1 4.2Å; F2883-V2993 HydrophobicContact CG-CG1 3.47Å; F2883-V2993 VanDerWaalsContact CG-CG1 3.47Å; F2883-V2993 HydrophobicContact CZ-CG1 4.38Å
2884	T	65.4	Low	52.6	Low	19 Å²	19	60.4 Å²	60.4	12%	0.117	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	153.7	178.4	75.3	0	0	0	0	111.7	D2886 R2946 L2947 K2948 I2989 D2990	T2884-D2886 PolarHBondContact OG1-OD1 3.09Å; T2884-R2946 HydrophobicContact CG2-CG 4.48Å; T2884-L2947 CarbonylContact C-O 3.57Å; T2884-L2947 WeakPolarHBondContact CA-O 3.09Å; T2884-L2947 WeakPolarHBondContact CB-O 3.08Å; T2884-K2948 HydrophobicContact CG2-CB 4.17Å; T2884-K2948 HydrophobicContact CG2-CD 4.41Å; T2884-K2948 HydrophobicContact CG2-CG 3.76Å; T2884-I2989 WeakPolarHBondContact O-CA 3.24Å; T2884-D2990 PolarHBondContact N-O 3.34Å; T2884-D2990 PolarHBondContact O-N 2.82Å
2885	V	65.5	Low	52.1	Low	3 Å²	3	65.9 Å²	65.9	2%	0.018	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	114.4	171.5	-174.9	0	0	0	0	107.7	F2883 F2887 L2947 F2949 V2988 I2989	F2883-V2885 HydrophobicContact CD2-CG2 4.19Å; F2883-V2885 HydrophobicContact CE2-CG2 3.65Å; V2885-F2887 HydrophobicContact CB-CE2 4.36Å; V2885-F2887 HydrophobicContact CG1-CD2 4.29Å; V2885-F2887 HydrophobicContact CG1-CE1 4.37Å; V2885-F2887 HydrophobicContact CG1-CE2 3.51Å; V2885-F2887 HydrophobicContact CG1-CZ 3.56Å; V2885-L2947 PolarHBondContact N-O 2.77Å; V2885-L2947 PolarHBondContact O-N 3.29Å; V2885-F2949 HydrophobicContact CB-CE2 4.23Å; V2885-F2949 HydrophobicContact CG2-CD2 4.31Å; V2885-F2949 HydrophobicContact CG2-CE2 3.8Å; V2885-V2988 CarbonylContact C-O 3.59Å; V2885-V2988 WeakPolarHBondContact CA-O 3.14Å; V2885-I2989 HydrophobicContact CG1-CG1 4.25Å; V2885-I2989 HydrophobicContact CG2-CG1 4.3Å; V2885-I2989 HydrophobicContact CG2-CG2 4.4Å
2886	D	61.8	Low	52.3	Low	16 Å²	16	68.6 Å²	68.6	9%	0.086	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	118.6	-175.6	-68.5	11.9	0	0	0	109.8	T2884 L2945 R2946 A2987 V2988	T2884-D2886 PolarHBondContact OG1-OD1 3.09Å; D2886-L2945 CarbonylContact C-O 3.5Å; D2886-L2945 VanDerWaalsContact CA-O 3.28Å; D2886-L2945 WeakPolarHBondContact CA-O 3.45Å; D2886-R2946 VanDerWaalsContact CG-NE 3.3Å; D2886-R2946 WeakPolarHBondContact OD1-CA 3.31Å; D2886-R2946 WeakPolarHBondContact OD1-CB 3.33Å; D2886-R2946 WeakPolarHBondContact OD1-CG 3.46Å; D2886-R2946 IonicContact OD1-CZ 2.7Å; D2886-R2946 IonicContact OD1-NE 3.66Å; D2886-R2946 PolarHBondContact OD1-NE 2.9Å; D2886-R2946 IonicContact OD2-CZ 3.64Å; D2886-R2946 IonicContact OD2-NE 3.56Å; D2886-R2946 PolarHBondContact OD2-NE 2.88Å; D2886-R2946 IonicContact OD2-NH2 3.81Å; D2886-R2946 PolarHBondContact OD2-NH2 2.87Å; D2886-A2987 CarbonylContact O-C 3.5Å; D2886-A2987 VanDerWaalsContact O-CA 3.3Å; D2886-A2987 WeakPolarHBondContact O-CA 3.49Å; D2886-V2988 HydrophobicContact CB-CB 4.28Å; D2886-V2988 PolarHBondContact N-O 2.86Å; D2886-V2988 PolarHBondContact O-N 2.9Å
2887	F	65.6	Low	52	Low	3 Å²	3	73 Å²	73	1%	0.013	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	116.4	171.4	-63.1	-79.4	0	0	0	109.1	L2870 V2885 L2945 L2947 L2958 L2960 V2984 A2987	L2870-F2887 HydrophobicContact CD2-CE1 3.8Å; L2870-F2887 HydrophobicContact CD2-CZ 4.35Å; V2885-F2887 HydrophobicContact CB-CE2 4.36Å; V2885-F2887 HydrophobicContact CG1-CD2 4.29Å; V2885-F2887 HydrophobicContact CG1-CE1 4.37Å; V2885-F2887 HydrophobicContact CG1-CE2 3.51Å; V2885-F2887 HydrophobicContact CG1-CZ 3.56Å; F2887-L2945 HydrophobicContact CB-CB 4.37Å; F2887-L2945 HydrophobicContact CD2-CD2 4.44Å; F2887-L2945 PolarHBondContact N-O 3.41Å; F2887-L2945 PolarHBondContact O-N 3.45Å; F2887-L2947 HydrophobicContact CE2-CD1 4.03Å; F2887-L2958 HydrophobicContact CE2-CD2 4.03Å; F2887-L2958 HydrophobicContact CZ-CD2 3.94Å; F2887-L2960 HydrophobicContact CD1-CD2 3.86Å; F2887-L2960 HydrophobicContact CD2-CD2 4.01Å; F2887-L2960 HydrophobicContact CE1-CB 4.44Å; F2887-L2960 HydrophobicContact CE1-CD2 3.86Å; F2887-L2960 HydrophobicContact CE1-CG 4.5Å; F2887-L2960 HydrophobicContact CE2-CD1 3.92Å; F2887-L2960 HydrophobicContact CE2-CD2 4Å; F2887-L2960 HydrophobicContact CG-CD2 3.93Å; F2887-L2960 HydrophobicContact CZ-CB 4.48Å; F2887-L2960 HydrophobicContact CZ-CD1 3.87Å; F2887-L2960 HydrophobicContact CZ-CD2 3.93Å; F2887-L2960 HydrophobicContact CZ-CG 4.31Å; F2887-V2984 HydrophobicContact CD1-CG1 4.01Å; F2887-A2987 HydrophobicContact CD1-CB 3.89Å; F2887-A2987 HydrophobicContact CE1-CB 3.89Å
2888	I	63.5	Low	51.8	Low	19 Å²	19	72 Å²	72	10%	0.097	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	123.9	176.7	-48.7	178.4	0	0	0	106.9	Y2942 Y2944 D2985 R2986 V2988	I2888-Y2942 HydrophobicContact CG2-CD1 4.04Å; I2888-Y2942 HydrophobicContact CG2-CG 4.49Å; I2888-Y2944 HydrophobicContact CB-CE1 4.39Å; I2888-Y2944 HydrophobicContact CD1-CD1 4.16Å; I2888-Y2944 HydrophobicContact CD1-CE1 3.58Å; I2888-Y2944 HydrophobicContact CG1-CD1 3.79Å; I2888-Y2944 HydrophobicContact CG1-CE1 3.69Å; I2888-Y2944 HydrophobicContact CG2-CD1 4.28Å; I2888-Y2944 HydrophobicContact CG2-CE1 3.89Å; I2888-Y2944 HydrophobicContact CG2-CE2 4.2Å; I2888-D2985 WeakPolarHBondContact O-CB 3.48Å; I2888-D2985 PolarHBondContact O-N 3.27Å; I2888-R2986 HydrophobicContact CB-CB 4.17Å; I2888-R2986 HydrophobicContact CD1-CB 4.21Å; I2888-R2986 HydrophobicContact CG1-CB 4.4Å; I2888-R2986 PolarHBondContact N-O 2.68Å; I2888-R2986 PolarHBondContact O-N 2.71Å; I2888-R2986 VanDerWaalsContact O-N 3.13Å; I2888-V2988 HydrophobicContact CD1-CG2 4.42Å
2889	M	67.9	Low	51.7	Low	5 Å²	5	71.4 Å²	71.4	3%	0.025	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	124.9	-176.5	-68.6	160.1	-74.9	0	0	110.9	I2909 Y2942 L2943 L2945 A2982 H2983 V2984	M2889-I2909 HydrophobicContact CE-CD1 4.46Å; M2889-I2909 HydrophobicContact SD-CD1 4.45Å; M2889-Y2942 CarbonylContact O-C 3.56Å; M2889-Y2942 WeakPolarHBondContact O-CA 3.09Å; M2889-L2943 HydrophobicContact CB-CB 4.39Å; M2889-L2943 HydrophobicContact CE-CB 4.48Å; M2889-L2943 HydrophobicContact CE-CD2 4.05Å; M2889-L2943 HydrophobicContact CE-CG 4.22Å; M2889-L2943 PolarHBondContact N-O 2.8Å; M2889-L2943 PolarHBondContact O-N 3.07Å; M2889-L2945 HydrophobicContact CE-CB 3.72Å; M2889-A2982 HydrophobicContact CB-CB 4.15Å; M2889-A2982 HydrophobicContact CG-CB 4.4Å; M2889-A2982 HydrophobicContact SD-CB 3.99Å; M2889-H2983 WeakPolarHBondContact CA-O 3.48Å; M2889-H2983 WeakPolarHBondContact CB-O 3.37Å; M2889-V2984 HydrophobicContact CG-CB 4.39Å; M2889-V2984 HydrophobicContact CG-CG2 3.89Å; M2889-V2984 HydrophobicContact SD-CG2 4.36Å
2890	K	59.7	Low	51.7	Low	88 Å²	88	73.2 Å²	73.2	38%	0.383	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	127	175.2	-171.2	169.3	175.7	174.5	0	108.9	V2940 Y2942 H2983 D2985	K2890-V2940 HydrophobicContact CD-CG1 4.26Å; K2890-V2940 HydrophobicContact CG-CG1 3.92Å; K2890-Y2942 HydrophobicContact CB-CD1 4.03Å; K2890-Y2942 HydrophobicContact CB-CE1 3.79Å; K2890-Y2942 HydrophobicContact CD-CE1 4.14Å; K2890-Y2942 HydrophobicContact CG-CD1 4.39Å; K2890-Y2942 HydrophobicContact CG-CE1 3.86Å; K2890-H2983 PolarHBondContact N-O 2.85Å; K2890-D2985 HydrophobicContact CB-CB 4.27Å
2891	V	57.6	Low	51.8	Low	24 Å²	24	69.2 Å²	69.2	15%	0.145	42%	0.415	C	S	.	.			trans	-109.3	108.1	-177.2	-171.7	0	0	0	0	110	V2893 M2902 Q2941 L2943	V2891-V2893 PolarHBondContact O-N 3.41Å; V2891-M2902 HydrophobicContact CB-CE 3.83Å; V2891-M2902 HydrophobicContact CG1-CE 3.56Å; V2891-M2902 HydrophobicContact CG2-CE 4.36Å; V2891-Q2941 PolarHBondContact N-O 2.92Å; V2891-L2943 HydrophobicContact CG2-CB 3.87Å
2892	S	51.5	Low	51.9	Low	63 Å²	63	63.8 Å²	63.8	44%	0.441	39%	0.392	S	S	.	.			trans	-75	103.6	177.7	61.2	0	0	0	0	111.3	T2894	S2892-T2894 PolarHBondContact O-N 2.76Å
2893	V	43.5	Very low	51.8	Low	112 Å²	112	67.6 Å²	67.6	68%	0.679	40%	0.4	S	S	*	.			trans	-78.7	72.1	173.7	-171.1	0	0	0	0	109.7	V2891 M2902	V2891-V2893 PolarHBondContact O-N 3.41Å; V2893-M2902 HydrophobicContact CG2-CE 4.19Å
2894	T	36.3	Very low	51.5	Low	92 Å²	92	70.4 Å²	70.4	56%	0.564	42%	0.424	S	S	*	.			trans	-129.3	87.3	-175.8	63.1	0	0	0	0	111.6	S2892	S2892-T2894 PolarHBondContact O-N 2.76Å
2895	N	36.2	Very low	51	Low	123 Å²	123	70.5 Å²	70.5	66%	0.658	43%	0.426	S	S	*	.			trans	-163.1	116.9	157.5	-136.1	51.6	0	0	0	108.8	L2897	N2895-L2897 PolarHBondContact O-N 2.9Å
2896	P	40.1	Very low	50.9	Low	138 Å²	138	71.9 Å²	71.9	90%	0.896	43%	0.433	S	S	*	.	S	Bend	trans	-68.5	-13	-176.9	-23.6	35.1	0	0	0	115.4
2897	L	37.7	Very low	50.9	Low	147 Å²	147	75.3 Å²	75.3	77%	0.77	45%	0.448	S	S	*	.	S	Bend	trans	-95.9	102.4	173.2	-66.9	164.4	0	0	0	107.5	N2895	N2895-L2897 PolarHBondContact O-N 2.9Å
2898	G	33.9	Very low	50.8	Low	60 Å²	60	76 Å²	76	62%	0.619	46%	0.456	S	S	*	.			trans	-64	-174.7	-172.6	0	0	0	0	0	114.9
2899	T	36.9	Very low	50.7	Low	149 Å²	149	75.6 Å²	75.6	91%	0.914	45%	0.454	S	S	*	.			trans	69.8	39.3	-178.1	76.8	0	0	0	0	117.5
2900	T	42.6	Very low	50.5	Low	119 Å²	119	78.9 Å²	78.9	73%	0.73	47%	0.468	S	S	*	.			trans	-105.3	85.1	139	-51.4	0	0	0	0	108.3	M2902	T2900-M2902 PolarHBondContact O-N 2.95Å
2901	S	46.4	Very low	50.7	Low	53 Å²	53	78.3 Å²	78.3	37%	0.371	47%	0.47	S	S	.	.			trans	-53.7	138.1	-177.9	176.1	0	0	0	0	110.9	E2903 A2904	S2901-E2903 PolarHBondContact O-N 2.82Å; S2901-E2903 WeakPolarHBondContact OG-CB 3.15Å; S2901-E2903 WeakPolarHBondContact OG-CG 3.31Å; S2901-E2903 PolarHBondContact OG-N 2.84Å; S2901-E2903 PolarHBondContact OG-OE2 2.94Å; S2901-A2904 VanDerWaalsContact O-CB 3.32Å; S2901-A2904 WeakPolarHBondContact O-CB 3.38Å; S2901-A2904 PolarHBondContact O-N 3Å
2902	M	54.1	Low	50.7	Low	44 Å²	44	77.6 Å²	77.6	22%	0.217	47%	0.465	C	S	.	.	H	α-helix	trans	-60.2	-27.8	176.1	-167.6	172.2	-122.4	0	0	111.8	V2891 V2893 T2900 A2904 S2905 I2906 L2934 Q2941	V2891-M2902 HydrophobicContact CB-CE 3.83Å; V2891-M2902 HydrophobicContact CG1-CE 3.56Å; V2891-M2902 HydrophobicContact CG2-CE 4.36Å; V2893-M2902 HydrophobicContact CG2-CE 4.19Å; T2900-M2902 PolarHBondContact O-N 2.95Å; M2902-A2904 PolarHBondContact O-N 2.93Å; M2902-S2905 WeakPolarHBondContact O-CA 3.38Å; M2902-S2905 VanDerWaalsContact O-CB 3.32Å; M2902-S2905 WeakPolarHBondContact O-CB 3.26Å; M2902-S2905 PolarHBondContact O-N 2.97Å; M2902-I2906 PolarHBondContact O-N 2.98Å; M2902-L2934 HydrophobicContact CE-CD1 3.77Å; M2902-L2934 HydrophobicContact CE-CD2 4.24Å; M2902-L2934 HydrophobicContact CG-CD1 4.28Å; M2902-L2934 HydrophobicContact SD-CD1 3.49Å; M2902-L2934 WeakPolarHBondContact SD-CD1 3.15Å; M2902-L2934 HydrophobicContact SD-CD2 3.34Å; M2902-L2934 WeakPolarHBondContact SD-CD2 3.15Å; M2902-L2934 HydrophobicContact SD-CG 4.04Å; M2902-Q2941 HydrophobicContact CE-CB 3.84Å; M2902-Q2941 PolarHBondContact SD-OE1 3.04Å; M2902-Q2941 VanDerWaalsContact SD-OE1 3.42Å
2903	E	57.1	Low	51.1	Low	139 Å²	139	75.1 Å²	75.1	65%	0.65	45%	0.447	S	S	*	.	H	α-helix	trans	-57.2	-36.7	172	-58.2	162.7	114.3	0	0	111.8	S2901 S2905 I2906 Q2907	S2901-E2903 PolarHBondContact O-N 2.82Å; S2901-E2903 WeakPolarHBondContact OG-CB 3.15Å; S2901-E2903 WeakPolarHBondContact OG-CG 3.31Å; S2901-E2903 PolarHBondContact OG-N 2.84Å; S2901-E2903 PolarHBondContact OG-OE2 2.94Å; E2903-S2905 PolarHBondContact O-N 2.84Å; E2903-I2906 PolarHBondContact O-N 3.42Å; E2903-Q2907 WeakPolarHBondContact O-CB 3.33Å; E2903-Q2907 PolarHBondContact O-N 2.87Å
2904	A	57.7	Low	52.1	Low	62 Å²	62	72 Å²	72	51%	0.512	43%	0.426	S	S	.	.	H	α-helix	trans	-66.2	-28.5	176.4	0	0	0	0	0	112.3	S2901 M2902 G2908	S2901-A2904 VanDerWaalsContact O-CB 3.32Å; S2901-A2904 WeakPolarHBondContact O-CB 3.38Å; S2901-A2904 PolarHBondContact O-N 3Å; M2902-A2904 PolarHBondContact O-N 2.93Å; A2904-G2908 PolarHBondContact O-N 2.9Å
2905	S	56.3	Low	53.2	Low	22 Å²	22	72.5 Å²	72.5	15%	0.154	42%	0.42	C	S	.	.	H	α-helix	trans	-74.6	-44.5	172.8	-61	0	0	0	0	111.4	M2902 E2903 I2909 S2980	M2902-S2905 WeakPolarHBondContact O-CA 3.38Å; M2902-S2905 VanDerWaalsContact O-CB 3.32Å; M2902-S2905 WeakPolarHBondContact O-CB 3.26Å; M2902-S2905 PolarHBondContact O-N 2.97Å; E2903-S2905 PolarHBondContact O-N 2.84Å; S2905-I2909 PolarHBondContact O-N 2.84Å; S2905-I2909 VanDerWaalsContact O-N 3.16Å; S2905-S2980 WeakPolarHBondContact OG-CB 3.35Å
2906	I	62.4	Low	54.3	Low	32 Å²	32	66.9 Å²	66.9	16%	0.164	39%	0.391	C	S	.	.	H	α-helix	trans	-60.9	-50.2	175.2	-65.5	168.9	0	0	0	110.3	M2902 E2903 I2909 K2910 V2932 L2943	M2902-I2906 PolarHBondContact O-N 2.98Å; E2903-I2906 PolarHBondContact O-N 3.42Å; I2906-I2909 PolarHBondContact O-N 2.85Å; I2906-I2909 VanDerWaalsContact O-N 3.16Å; I2906-K2910 HydrophobicContact CG2-CD 4.09Å; I2906-K2910 HydrophobicContact CG2-CG 4.45Å; I2906-K2910 WeakPolarHBondContact O-CG 3.36Å; I2906-K2910 PolarHBondContact O-N 3.31Å; I2906-V2932 HydrophobicContact CG2-CG1 4.11Å; I2906-L2943 HydrophobicContact CG1-CD1 3.84Å
2907	Q	63.1	Low	55.2	Low	87 Å²	87	60.3 Å²	60.3	41%	0.407	35%	0.348	S	S	.	.	H	α-helix	trans	-69.2	-35.7	-177.9	-164.5	61.2	28.2	0	0	111.7	E2903 I2909 K2910 N2911	E2903-Q2907 WeakPolarHBondContact O-CB 3.33Å; E2903-Q2907 PolarHBondContact O-N 2.87Å; Q2907-I2909 VanDerWaalsContact C-N 3.27Å; Q2907-I2909 PolarHBondContact O-N 3.06Å; Q2907-K2910 PolarHBondContact O-N 2.98Å; Q2907-N2911 PolarHBondContact NE2-OD1 3.46Å; Q2907-N2911 WeakPolarHBondContact O-CB 3.45Å; Q2907-N2911 PolarHBondContact O-N 3Å; Q2907-N2911 PolarHBondContact O-OD1 2.93Å
2908	G	62.2	Low	56.2	Low	18 Å²	18	57.4 Å²	57.4	19%	0.186	33%	0.33	C	S	.	.	H	α-helix	trans	-58.7	-38.5	170.1	0	0	0	0	0	112.6	A2904 T2912	A2904-G2908 PolarHBondContact O-N 2.9Å; G2908-T2912 VanDerWaalsContact O-CB 3.25Å; G2908-T2912 WeakPolarHBondContact O-CB 3.42Å; G2908-T2912 PolarHBondContact O-N 2.81Å; G2908-T2912 VanDerWaalsContact O-N 3.1Å; G2908-T2912 PolarHBondContact O-OG1 3.38Å
2909	I	61.1	Low	57.1	Low	10 Å²	10	57.1 Å²	57.1	5%	0.051	32%	0.317	C	S	.	.	H	α-helix	trans	-74.5	-46.1	177	-75.1	166.3	0	0	0	111.1	M2889 S2905 I2906 Q2907 T2912 I2913 V2932 L2943 L2945 L2978	M2889-I2909 HydrophobicContact CE-CD1 4.46Å; M2889-I2909 HydrophobicContact SD-CD1 4.45Å; S2905-I2909 PolarHBondContact O-N 2.84Å; S2905-I2909 VanDerWaalsContact O-N 3.16Å; I2906-I2909 PolarHBondContact O-N 2.85Å; I2906-I2909 VanDerWaalsContact O-N 3.16Å; Q2907-I2909 VanDerWaalsContact C-N 3.27Å; Q2907-I2909 PolarHBondContact O-N 3.06Å; I2909-T2912 PolarHBondContact O-N 3.45Å; I2909-T2912 VanDerWaalsContact O-N 3.15Å; I2909-I2913 HydrophobicContact CG2-CD1 3.68Å; I2909-I2913 WeakPolarHBondContact O-CG1 3.42Å; I2909-I2913 PolarHBondContact O-N 2.81Å; I2909-V2932 HydrophobicContact CG2-CG2 4.01Å; I2909-L2943 HydrophobicContact CD1-CD2 3.3Å; I2909-L2945 HydrophobicContact CG2-CD2 4.35Å; I2909-L2978 HydrophobicContact CB-CD1 4.47Å; I2909-L2978 HydrophobicContact CG1-CD1 3.49Å; I2909-L2978 VanDerWaalsContact CG1-CD1 3.49Å; I2909-L2978 HydrophobicContact CG1-CD2 3.79Å; I2909-L2978 HydrophobicContact CG1-CG 4.29Å
2910	K	65	Low	57.7	Low	74 Å²	74	50.2 Å²	50.2	32%	0.322	27%	0.274	S	S	.	.	H	α-helix	trans	-52.9	-56.5	171.8	-71.4	173.9	176.7	176.5	0	111.4	I2906 Q2907 T2912 I2913 D2914 Y2930 V2932	I2906-K2910 HydrophobicContact CG2-CD 4.09Å; I2906-K2910 HydrophobicContact CG2-CG 4.45Å; I2906-K2910 WeakPolarHBondContact O-CG 3.36Å; I2906-K2910 PolarHBondContact O-N 3.31Å; Q2907-K2910 PolarHBondContact O-N 2.98Å; K2910-T2912 PolarHBondContact O-N 2.86Å; K2910-T2912 VanDerWaalsContact O-N 3.16Å; K2910-I2913 PolarHBondContact O-N 2.91Å; K2910-D2914 PolarHBondContact O-N 2.98Å; K2910-Y2930 VanDerWaalsContact CA-OH 3.29Å; K2910-Y2930 WeakPolarHBondContact CA-OH 3.3Å; K2910-Y2930 WeakPolarHBondContact CB-OH 3.17Å; K2910-Y2930 HydrophobicContact CG-CE2 4.28Å; K2910-Y2930 PolarHBondContact O-OH 2.84Å; K2910-V2932 HydrophobicContact CG-CG2 4.44Å
2911	N	62.4	Low	58.1	Low	77 Å²	77	47.8 Å²	47.8	41%	0.412	26%	0.257	S	S	.	.	H	α-helix	trans	-56.5	-33.4	177.7	-70	-3.5	0	0	0	113.2	Q2907 K2915	Q2907-N2911 PolarHBondContact NE2-OD1 3.46Å; Q2907-N2911 WeakPolarHBondContact O-CB 3.45Å; Q2907-N2911 PolarHBondContact O-N 3Å; Q2907-N2911 PolarHBondContact O-OD1 2.93Å; N2911-K2915 WeakPolarHBondContact O-CG 3.16Å; N2911-K2915 PolarHBondContact O-N 2.85Å
2912	T	58.6	Low	58.3	Low	9 Å²	9	51.5 Å²	51.5	6%	0.055	27%	0.272	C	S	.	.	H	α-helix	trans	-74.1	-37	178.5	-64.9	0	0	0	0	111.5	G2908 I2909 K2910 V2916 T2974 L2978	G2908-T2912 VanDerWaalsContact O-CB 3.25Å; G2908-T2912 WeakPolarHBondContact O-CB 3.42Å; G2908-T2912 PolarHBondContact O-N 2.81Å; G2908-T2912 VanDerWaalsContact O-N 3.1Å; G2908-T2912 PolarHBondContact O-OG1 3.38Å; I2909-T2912 PolarHBondContact O-N 3.45Å; I2909-T2912 VanDerWaalsContact O-N 3.15Å; K2910-T2912 PolarHBondContact O-N 2.86Å; K2910-T2912 VanDerWaalsContact O-N 3.16Å; T2912-V2916 PolarHBondContact O-N 3.47Å; T2912-T2974 HydrophobicContact CG2-CG2 3.64Å; T2912-L2978 HydrophobicContact CG2-CD1 4.36Å
2913	I	60.6	Low	57.8	Low	11 Å²	11	53.8 Å²	53.8	6%	0.056	29%	0.288	C	S	.	.	H	α-helix	trans	-84.9	-35.7	-177.7	-60.9	167.9	0	0	0	111.5	I2909 K2910 K2915 V2916 S2917 Y2930 L2945 L2947	I2909-I2913 HydrophobicContact CG2-CD1 3.68Å; I2909-I2913 WeakPolarHBondContact O-CG1 3.42Å; I2909-I2913 PolarHBondContact O-N 2.81Å; K2910-I2913 PolarHBondContact O-N 2.91Å; I2913-K2915 PolarHBondContact O-N 2.9Å; I2913-V2916 CarbonylContact O-C 3.54Å; I2913-V2916 PolarHBondContact O-N 3.17Å; I2913-V2916 VanDerWaalsContact O-N 3.11Å; I2913-S2917 WeakPolarHBondContact O-CB 3.44Å; I2913-S2917 PolarHBondContact O-N 2.93Å; I2913-Y2930 HydrophobicContact CB-CD1 4.38Å; I2913-Y2930 HydrophobicContact CB-CD2 4.27Å; I2913-Y2930 HydrophobicContact CB-CE1 4.25Å; I2913-Y2930 HydrophobicContact CB-CE2 4.15Å; I2913-Y2930 HydrophobicContact CB-CG 4.4Å; I2913-Y2930 HydrophobicContact CD1-CD2 4.11Å; I2913-Y2930 HydrophobicContact CD1-CE2 4.33Å; I2913-Y2930 HydrophobicContact CG2-CD1 3.51Å; I2913-Y2930 HydrophobicContact CG2-CD2 3.9Å; I2913-Y2930 HydrophobicContact CG2-CE1 3.84Å; I2913-Y2930 HydrophobicContact CG2-CE2 4.19Å; I2913-Y2930 HydrophobicContact CG2-CG 3.56Å; I2913-L2945 HydrophobicContact CD1-CD1 3.29Å; I2913-L2945 HydrophobicContact CD1-CD2 3.5Å; I2913-L2945 VanDerWaalsContact CD1-CD2 3.5Å; I2913-L2945 HydrophobicContact CD1-CG 4.01Å; I2913-L2947 HydrophobicContact CD1-CD2 4.45Å; I2913-L2947 HydrophobicContact CG2-CD2 4.2Å
2914	D	64.1	Low	57	Low	45 Å²	45	50.1 Å²	50.1	24%	0.241	28%	0.282	C	S	.	.	H	α-helix	trans	-61	-34.1	170.6	-87.6	-58.8	0	0	0	111.8	K2910 S2917 Q2918 R2927 Y2930	K2910-D2914 PolarHBondContact O-N 2.98Å; D2914-S2917 PolarHBondContact O-N 3.24Å; D2914-Q2918 VanDerWaalsContact O-CB 3.32Å; D2914-Q2918 WeakPolarHBondContact O-CB 3.39Å; D2914-Q2918 WeakPolarHBondContact O-CG 3.42Å; D2914-Q2918 PolarHBondContact O-N 2.83Å; D2914-R2927 IonicContact OD1-CZ 3.68Å; D2914-R2927 IonicContact OD1-NE 3.6Å; D2914-R2927 IonicContact OD1-NH2 2.76Å; D2914-R2927 PolarHBondContact OD1-NH2 3.36Å; D2914-Y2930 PolarHBondContact OD2-OH 3.05Å
2915	K	59.2	Low	56.8	Low	103 Å²	103	55.2 Å²	55.2	45%	0.448	30%	0.295	S	S	.	.	H	α-helix	trans	-61	-48.5	169.5	-76.5	179.2	-178.4	-167.8	0	112.2	N2911 I2913 S2917 Q2918 V2919 N2976	N2911-K2915 WeakPolarHBondContact O-CG 3.16Å; N2911-K2915 PolarHBondContact O-N 2.85Å; I2913-K2915 PolarHBondContact O-N 2.9Å; K2915-S2917 VanDerWaalsContact C-N 3.31Å; K2915-S2917 PolarHBondContact O-N 2.8Å; K2915-Q2918 PolarHBondContact O-N 2.92Å; K2915-V2919 WeakPolarHBondContact O-CG2 3.45Å; K2915-V2919 PolarHBondContact O-N 3.22Å; K2915-N2976 PolarHBondContact NZ-OD1 3.48Å
2916	V	58.2	Low	56.6	Low	5 Å²	5	56.1 Å²	56.1	3%	0.03	30%	0.295	C	S	.	.	H	α-helix	trans	-60.9	-42.5	174.8	175.6	0	0	0	0	111	T2912 I2913 Q2918 V2919 L2920 Q2973 T2974	T2912-V2916 PolarHBondContact O-N 3.47Å; I2913-V2916 CarbonylContact O-C 3.54Å; I2913-V2916 PolarHBondContact O-N 3.17Å; I2913-V2916 VanDerWaalsContact O-N 3.11Å; V2916-Q2918 PolarHBondContact O-N 3.05Å; V2916-V2919 PolarHBondContact O-N 2.86Å; V2916-L2920 HydrophobicContact CG1-CD1 3.92Å; V2916-L2920 HydrophobicContact CG1-CG 4.33Å; V2916-L2920 WeakPolarHBondContact O-CB 3.19Å; V2916-L2920 VanDerWaalsContact O-CG 3.32Å; V2916-L2920 WeakPolarHBondContact O-CG 3.44Å; V2916-L2920 PolarHBondContact O-N 2.88Å; V2916-Q2973 HydrophobicContact CB-CB 4.2Å; V2916-Q2973 HydrophobicContact CG1-CB 3.82Å; V2916-Q2973 HydrophobicContact CG1-CG 4.26Å; V2916-Q2973 HydrophobicContact CG2-CB 3.78Å; V2916-Q2973 PolarHBondContact O-OE1 3.35Å; V2916-T2974 HydrophobicContact CG2-CG2 3.5Å; V2916-T2974 VanDerWaalsContact CG2-CG2 3.5Å
2917	S	60.8	Low	56.4	Low	0 Å²	0	60.9 Å²	60.9	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-67.4	-35.2	-177.7	-159.5	0	0	0	0	112.2	I2913 D2914 K2915 L2921 R2927 L2928	I2913-S2917 WeakPolarHBondContact O-CB 3.44Å; I2913-S2917 PolarHBondContact O-N 2.93Å; D2914-S2917 PolarHBondContact O-N 3.24Å; K2915-S2917 VanDerWaalsContact C-N 3.31Å; K2915-S2917 PolarHBondContact O-N 2.8Å; S2917-L2921 WeakPolarHBondContact O-CB 3.32Å; S2917-L2921 PolarHBondContact O-N 2.89Å; S2917-R2927 WeakPolarHBondContact OG-CG 3.46Å; S2917-L2928 WeakPolarHBondContact OG-CA 3.38Å; S2917-L2928 PolarHBondContact OG-N 2.93Å; S2917-L2928 PolarHBondContact OG-O 2.79Å
2918	Q	58.2	Low	56.6	Low	86 Å²	86	57 Å²	57	40%	0.402	29%	0.293	S	S	.	.	H	α-helix	trans	-72.6	-38.1	171	-72.5	-74.9	23.2	0	0	112.6	D2914 K2915 V2916 L2921 N2922	D2914-Q2918 VanDerWaalsContact O-CB 3.32Å; D2914-Q2918 WeakPolarHBondContact O-CB 3.39Å; D2914-Q2918 WeakPolarHBondContact O-CG 3.42Å; D2914-Q2918 PolarHBondContact O-N 2.83Å; K2915-Q2918 PolarHBondContact O-N 2.92Å; V2916-Q2918 PolarHBondContact O-N 3.05Å; Q2918-L2921 WeakPolarHBondContact O-CB 3.42Å; Q2918-L2921 PolarHBondContact O-N 2.78Å; Q2918-N2922 WeakPolarHBondContact O-CB 3.41Å; Q2918-N2922 PolarHBondContact O-N 2.86Å; Q2918-N2922 PolarHBondContact O-ND2 2.83Å
2919	V	52.5	Low	56.9	Low	55 Å²	55	58.6 Å²	58.6	33%	0.333	30%	0.3	S	S	.	.	H	α-helix	trans	-68.5	-39	175.3	176.8	0	0	0	0	110.9	K2915 V2916 L2921 N2922 V2923 Q2973	K2915-V2919 WeakPolarHBondContact O-CG2 3.45Å; K2915-V2919 PolarHBondContact O-N 3.22Å; V2916-V2919 PolarHBondContact O-N 2.86Å; V2919-L2921 VanDerWaalsContact C-N 3.34Å; V2919-L2921 PolarHBondContact O-N 2.81Å; V2919-N2922 PolarHBondContact O-N 2.81Å; V2919-V2923 HydrophobicContact CG1-CG2 4.18Å; V2919-V2923 WeakPolarHBondContact O-CB 3.38Å; V2919-V2923 VanDerWaalsContact O-CG2 3.31Å; V2919-V2923 WeakPolarHBondContact O-CG2 3.42Å; V2919-V2923 PolarHBondContact O-N 2.92Å; V2919-Q2973 VanDerWaalsContact CB-OE1 3.29Å
2920	L	48.5	Very low	57.7	Low	4 Å²	4	60.5 Å²	60.5	2%	0.021	31%	0.307	C	S	.	.	H	α-helix	trans	-65.8	-32.9	170.7	-68.1	173	0	0	0	112.8	V2916 A2924 E2925 Y2926 L2928 Y2968	V2916-L2920 HydrophobicContact CG1-CD1 3.92Å; V2916-L2920 HydrophobicContact CG1-CG 4.33Å; V2916-L2920 WeakPolarHBondContact O-CB 3.19Å; V2916-L2920 VanDerWaalsContact O-CG 3.32Å; V2916-L2920 WeakPolarHBondContact O-CG 3.44Å; V2916-L2920 PolarHBondContact O-N 2.88Å; L2920-A2924 CarbonylContact O-C 3.49Å; L2920-A2924 WeakPolarHBondContact O-CA 3.49Å; L2920-A2924 WeakPolarHBondContact O-CB 3.45Å; L2920-A2924 PolarHBondContact O-N 2.82Å; L2920-E2925 PolarHBondContact O-N 3.05Å; L2920-Y2926 CarbonylContact C-O 3.6Å; L2920-Y2926 WeakPolarHBondContact CB-O 3.29Å; L2920-Y2926 PolarHBondContact O-N 2.81Å; L2920-L2928 HydrophobicContact CD1-CB 3.95Å; L2920-L2928 HydrophobicContact CD1-CD2 4.14Å; L2920-Y2968 HydrophobicContact CD2-CD1 3.57Å; L2920-Y2968 HydrophobicContact CD2-CE1 3.85Å; L2920-Y2968 HydrophobicContact CD2-CG 4.09Å
2921	L	52.6	Low	58.1	Low	68 Å²	68	59.3 Å²	59.3	36%	0.356	31%	0.308	S	S	.	.	H	α-helix	trans	-64	-44.3	170.1	-174.4	64	0	0	0	111.4	S2917 Q2918 V2919 E2925 Y2926 R2927	S2917-L2921 WeakPolarHBondContact O-CB 3.32Å; S2917-L2921 PolarHBondContact O-N 2.89Å; Q2918-L2921 WeakPolarHBondContact O-CB 3.42Å; Q2918-L2921 PolarHBondContact O-N 2.78Å; V2919-L2921 VanDerWaalsContact C-N 3.34Å; V2919-L2921 PolarHBondContact O-N 2.81Å; L2921-E2925 WeakPolarHBondContact O-CA 3.49Å; L2921-E2925 PolarHBondContact O-N 2.94Å; L2921-Y2926 PolarHBondContact N-O 2.84Å; L2921-R2927 HydrophobicContact CB-CB 4.46Å; L2921-R2927 HydrophobicContact CD1-CB 4.27Å
2922	N	49	Very low	58.6	Low	131 Å²	131	56.9 Å²	56.9	70%	0.701	30%	0.296	S	S	*	.	H	α-helix	trans	-72.6	-27.8	-179.4	-68.6	-27.8	0	0	0	114.4	Q2918 V2919	Q2918-N2922 WeakPolarHBondContact O-CB 3.41Å; Q2918-N2922 PolarHBondContact O-N 2.86Å; Q2918-N2922 PolarHBondContact O-ND2 2.83Å; V2919-N2922 PolarHBondContact O-N 2.81Å
2923	V	44	Very low	59.3	Low	91 Å²	91	59.2 Å²	59.2	55%	0.552	31%	0.313	S	S	*	.	H	α-helix	trans	-101.5	-27.2	-174.9	175.1	0	0	0	0	112.9	V2919	V2919-V2923 HydrophobicContact CG1-CG2 4.18Å; V2919-V2923 WeakPolarHBondContact O-CB 3.38Å; V2919-V2923 VanDerWaalsContact O-CG2 3.31Å; V2919-V2923 WeakPolarHBondContact O-CG2 3.42Å; V2919-V2923 PolarHBondContact O-N 2.92Å
2924	A	41.7	Very low	59.5	Low	62 Å²	62	61.6 Å²	61.6	51%	0.512	33%	0.325	S	S	.	.	H	α-helix	trans	-139.1	13.8	-172.1	0	0	0	0	0	114.1	L2920 Y2926	L2920-A2924 CarbonylContact O-C 3.49Å; L2920-A2924 WeakPolarHBondContact O-CA 3.49Å; L2920-A2924 WeakPolarHBondContact O-CB 3.45Å; L2920-A2924 PolarHBondContact O-N 2.82Å; A2924-Y2926 PolarHBondContact O-N 3.31Å
2925	E	52.3	Low	59.5	Low	170 Å²	170	65.4 Å²	65.4	79%	0.794	34%	0.336	S	S	*	.	S	Bend	trans	52.9	26.4	-176.3	-61.4	-177.9	172.5	0	0	113.3	L2920 L2921	L2920-E2925 PolarHBondContact O-N 3.05Å; L2921-E2925 WeakPolarHBondContact O-CA 3.49Å; L2921-E2925 PolarHBondContact O-N 2.94Å
2926	Y	52.7	Low	59.6	Low	40 Å²	40	64.5 Å²	64.5	16%	0.157	34%	0.336	C	S	.	.			trans	-126.9	93.5	-171	-175.3	-106.3	0	0	0	111.7	L2920 L2921 A2924 L2928 P2929 K2948 F2949 K2950	L2920-Y2926 CarbonylContact C-O 3.6Å; L2920-Y2926 WeakPolarHBondContact CB-O 3.29Å; L2920-Y2926 PolarHBondContact O-N 2.81Å; L2921-Y2926 PolarHBondContact N-O 2.84Å; A2924-Y2926 PolarHBondContact O-N 3.31Å; Y2926-L2928 HydrophobicContact CE1-CB 4.14Å; Y2926-L2928 HydrophobicContact CE1-CD1 3.91Å; Y2926-L2928 PolarHBondContact O-N 2.78Å; Y2926-P2929 WeakPolarHBondContact OH-CD 3.26Å; Y2926-K2948 PolarHBondContact OH-O 3Å; Y2926-F2949 WeakPolarHBondContact OH-CA 3.47Å; Y2926-K2950 HydrophobicContact CE2-CB 3.85Å; Y2926-K2950 HydrophobicContact CE2-CD 4.11Å; Y2926-K2950 HydrophobicContact CE2-CG 3.88Å; Y2926-K2950 PolarHBondContact OH-N 3.37Å
2927	R	58.4	Low	59.3	Low	132 Å²	132	66.7 Å²	66.7	50%	0.498	35%	0.347	S	S	.	.			trans	-64.1	121.8	161.2	-165.2	172.9	-173.7	165.4	0.7	107.8	D2914 S2917 L2921 P2929	D2914-R2927 IonicContact OD1-CZ 3.68Å; D2914-R2927 IonicContact OD1-NE 3.6Å; D2914-R2927 IonicContact OD1-NH2 2.76Å; D2914-R2927 PolarHBondContact OD1-NH2 3.36Å; S2917-R2927 WeakPolarHBondContact OG-CG 3.46Å; L2921-R2927 HydrophobicContact CB-CB 4.46Å; L2921-R2927 HydrophobicContact CD1-CB 4.27Å; R2927-P2929 WeakPolarHBondContact O-CD 3.5Å
2928	L	66.4	Low	59.2	Low	7 Å²	7	72.8 Å²	72.8	4%	0.037	38%	0.38	C	S	.	.			trans	-76.4	107.2	174.2	176.8	65.4	0	0	0	109.3	S2917 L2920 Y2926 L2947 K2948 F2949	S2917-L2928 WeakPolarHBondContact OG-CA 3.38Å; S2917-L2928 PolarHBondContact OG-N 2.93Å; S2917-L2928 PolarHBondContact OG-O 2.79Å; L2920-L2928 HydrophobicContact CD1-CB 3.95Å; L2920-L2928 HydrophobicContact CD1-CD2 4.14Å; Y2926-L2928 HydrophobicContact CE1-CB 4.14Å; Y2926-L2928 HydrophobicContact CE1-CD1 3.91Å; Y2926-L2928 PolarHBondContact O-N 2.78Å; L2928-L2947 HydrophobicContact CD2-CD2 4.17Å; L2928-K2948 WeakPolarHBondContact CD1-O 3.41Å; L2928-F2949 HydrophobicContact CD1-CD1 3.69Å; L2928-F2949 HydrophobicContact CD1-CE1 3.42Å; L2928-F2949 VanDerWaalsContact CD1-CE1 3.42Å; L2928-F2949 HydrophobicContact CD1-CE2 4.47Å; L2928-F2949 HydrophobicContact CD1-CG 4.34Å; L2928-F2949 HydrophobicContact CD1-CZ 3.85Å
2929	P	69.3	Low	59.3	Low	50 Å²	50	71.9 Å²	71.9	33%	0.325	39%	0.394	S	S	.	.			trans	-69.8	136.9	174.2	26.5	-28	0	0	0	110.1	Y2926 R2927 K2948	Y2926-P2929 WeakPolarHBondContact OH-CD 3.26Å; R2927-P2929 WeakPolarHBondContact O-CD 3.5Å; P2929-K2948 VanDerWaalsContact CD-O 3.29Å; P2929-K2948 WeakPolarHBondContact CD-O 3.31Å; P2929-K2948 HydrophobicContact CG-CB 4.08Å; P2929-K2948 WeakPolarHBondContact CG-O 3.34Å; P2929-K2948 PolarHBondContact O-N 2.99Å
2930	Y	77.4	Confident	59.3	Low	50 Å²	50	71.6 Å²	71.6	20%	0.196	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	162.5	-179.9	75.7	-80.3	0	0	0	110.2	K2910 I2913 D2914 V2932 L2945 R2946	K2910-Y2930 VanDerWaalsContact CA-OH 3.29Å; K2910-Y2930 WeakPolarHBondContact CA-OH 3.3Å; K2910-Y2930 WeakPolarHBondContact CB-OH 3.17Å; K2910-Y2930 HydrophobicContact CG-CE2 4.28Å; K2910-Y2930 PolarHBondContact O-OH 2.84Å; I2913-Y2930 HydrophobicContact CB-CD1 4.38Å; I2913-Y2930 HydrophobicContact CB-CD2 4.27Å; I2913-Y2930 HydrophobicContact CB-CE1 4.25Å; I2913-Y2930 HydrophobicContact CB-CE2 4.15Å; I2913-Y2930 HydrophobicContact CB-CG 4.4Å; I2913-Y2930 HydrophobicContact CD1-CD2 4.11Å; I2913-Y2930 HydrophobicContact CD1-CE2 4.33Å; I2913-Y2930 HydrophobicContact CG2-CD1 3.51Å; I2913-Y2930 HydrophobicContact CG2-CD2 3.9Å; I2913-Y2930 HydrophobicContact CG2-CE1 3.84Å; I2913-Y2930 HydrophobicContact CG2-CE2 4.19Å; I2913-Y2930 HydrophobicContact CG2-CG 3.56Å; D2914-Y2930 PolarHBondContact OD2-OH 3.05Å; Y2930-V2932 HydrophobicContact CD2-CG2 3.9Å; Y2930-V2932 HydrophobicContact CE2-CG2 3.83Å; Y2930-L2945 HydrophobicContact CD2-CD1 4.15Å; Y2930-R2946 CarbonylContact C-O 3.59Å; Y2930-R2946 WeakPolarHBondContact CA-O 3.24Å
2931	S	73	Confident	59.9	Low	49 Å²	49	74.1 Å²	74.1	34%	0.343	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	133.9	172.2	52.3	0	0	0	0	110	R2946	S2931-R2946 PolarHBondContact N-O 2.92Å; S2931-R2946 PolarHBondContact O-N 3.13Å
2932	V	72.8	Confident	60.7	Low	27 Å²	27	72.2 Å²	72.2	16%	0.164	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	125.4	175.5	179.5	0	0	0	0	108.3	I2906 I2909 K2910 Y2930 L2943 Y2944 L2945	I2906-V2932 HydrophobicContact CG2-CG1 4.11Å; I2909-V2932 HydrophobicContact CG2-CG2 4.01Å; K2910-V2932 HydrophobicContact CG-CG2 4.44Å; Y2930-V2932 HydrophobicContact CD2-CG2 3.9Å; Y2930-V2932 HydrophobicContact CE2-CG2 3.83Å; V2932-L2943 HydrophobicContact CG1-CD1 3.58Å; V2932-L2943 HydrophobicContact CG1-CG 4.19Å; V2932-Y2944 VanDerWaalsContact CA-O 3.32Å; V2932-Y2944 WeakPolarHBondContact CA-O 3.26Å; V2932-L2945 HydrophobicContact CG2-CD1 3.82Å
2933	S	73.3	Confident	61.5	Low	57 Å²	57	66.1 Å²	66.1	40%	0.399	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	141.6	176.3	57.5	0	0	0	0	110.8	Y2944	S2933-Y2944 PolarHBondContact N-O 3.04Å; S2933-Y2944 PolarHBondContact O-N 3.24Å
2934	L	65.6	Low	62.8	Low	61 Å²	61	64.3 Å²	64.3	32%	0.319	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	148.7	166.8	-157.1	87.1	0	0	0	109.7	M2902 Q2941 Y2942 L2943	M2902-L2934 HydrophobicContact CE-CD1 3.77Å; M2902-L2934 HydrophobicContact CE-CD2 4.24Å; M2902-L2934 HydrophobicContact CG-CD1 4.28Å; M2902-L2934 HydrophobicContact SD-CD1 3.49Å; M2902-L2934 WeakPolarHBondContact SD-CD1 3.15Å; M2902-L2934 HydrophobicContact SD-CD2 3.34Å; M2902-L2934 WeakPolarHBondContact SD-CD2 3.15Å; M2902-L2934 HydrophobicContact SD-CG 4.04Å; L2934-Q2941 HydrophobicContact CD2-CB 4.47Å; L2934-Y2942 WeakPolarHBondContact CA-O 3.45Å; L2934-L2943 HydrophobicContact CD1-CB 4.36Å; L2934-L2943 HydrophobicContact CD1-CD1 3.99Å
2935	R	63.9	Low	64.2	Low	125 Å²	125	62 Å²	62	47%	0.472	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	131.4	162	-66.3	-173.3	171	-146.2	-7.4	109.2	I2937 Y2942 Y2944	R2935-I2937 HydrophobicContact CB-CD1 4.38Å; R2935-I2937 HydrophobicContact CB-CG1 4.18Å; R2935-Y2942 PolarHBondContact N-O 3.21Å; R2935-Y2942 PolarHBondContact O-N 3.27Å; R2935-Y2944 HydrophobicContact CB-CD2 4.4Å; R2935-Y2944 HydrophobicContact CB-CE2 4.01Å; R2935-Y2944 HydrophobicContact CG-CD2 4.33Å; R2935-Y2944 HydrophobicContact CG-CE2 4.22Å
2936	D	61.1	Low	65.2	Low	85 Å²	85	56.8 Å²	56.8	46%	0.455	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	134.7	161	-153.1	-49.8	0	0	0	108.5	G2939 V2940 Q2941	D2936-G2939 WeakPolarHBondContact OD1-CA 3.23Å; D2936-G2939 PolarHBondContact OD1-N 2.97Å; D2936-V2940 PolarHBondContact OD1-N 3.43Å; D2936-Q2941 HydrophobicContact CB-CG 4.05Å; D2936-Q2941 WeakPolarHBondContact OD2-CG 3.34Å; D2936-Q2941 PolarHBondContact OD2-NE2 2.82Å
2937	I	51.4	Low	66.1	Low	50 Å²	50	55.3 Å²	55.3	26%	0.256	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	103.5	179.5	-54.8	179.7	0	0	0	107	R2935 G2939 V2940 Y2942 Y2944	R2935-I2937 HydrophobicContact CB-CD1 4.38Å; R2935-I2937 HydrophobicContact CB-CG1 4.18Å; I2937-G2939 PolarHBondContact O-N 3.33Å; I2937-V2940 PolarHBondContact N-O 2.73Å; I2937-V2940 PolarHBondContact O-N 2.87Å; I2937-V2940 VanDerWaalsContact O-N 3.16Å; I2937-Y2942 HydrophobicContact CB-CD2 4.09Å; I2937-Y2942 HydrophobicContact CB-CE2 4.16Å; I2937-Y2942 HydrophobicContact CD1-CD2 4.05Å; I2937-Y2942 HydrophobicContact CG1-CD2 4.2Å; I2937-Y2944 HydrophobicContact CD1-CE2 4.39Å; I2937-Y2944 WeakPolarHBondContact CD1-OH 3.43Å
2938	N	58.8	Low	66.6	Low	128 Å²	128	53.6 Å²	53.6	68%	0.684	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.6	44.8	-176.8	-53.7	-31.1	0	0	0	113.5	R2850 V2940	R2850-N2938 PolarHBondContact NH2-OD1 3.38Å; N2938-V2940 PolarHBondContact O-N 2.98Å
2939	G	59.8	Low	66.6	Low	68 Å²	68	53.4 Å²	53.4	70%	0.701	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	78	4.5	180	0	0	0	0	0	114.4	D2936 I2937	D2936-G2939 WeakPolarHBondContact OD1-CA 3.23Å; D2936-G2939 PolarHBondContact OD1-N 2.97Å; I2937-G2939 PolarHBondContact O-N 3.33Å
2940	V	54.5	Low	66.1	Low	49 Å²	49	57.3 Å²	57.3	30%	0.297	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	116.8	175.2	-177	0	0	0	0	109	K2890 D2936 I2937 N2938 Y2942	K2890-V2940 HydrophobicContact CD-CG1 4.26Å; K2890-V2940 HydrophobicContact CG-CG1 3.92Å; D2936-V2940 PolarHBondContact OD1-N 3.43Å; I2937-V2940 PolarHBondContact N-O 2.73Å; I2937-V2940 PolarHBondContact O-N 2.87Å; I2937-V2940 VanDerWaalsContact O-N 3.16Å; N2938-V2940 PolarHBondContact O-N 2.98Å; V2940-Y2942 HydrophobicContact CB-CD2 4.47Å; V2940-Y2942 HydrophobicContact CB-CE2 3.74Å; V2940-Y2942 HydrophobicContact CG1-CD2 4.14Å; V2940-Y2942 HydrophobicContact CG1-CE1 4.34Å; V2940-Y2942 HydrophobicContact CG1-CE2 3.44Å; V2940-Y2942 VanDerWaalsContact CG1-CE2 3.44Å; V2940-Y2942 WeakPolarHBondContact O-CD2 3.24Å; V2940-Y2942 WeakPolarHBondContact O-CE2 3.44Å
2941	Q	61.1	Low	64.9	Low	56 Å²	56	57.9 Å²	57.9	26%	0.262	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	122.5	-178.5	-67.6	177	-3.6	0	0	111.3	V2891 M2902 L2934 D2936	V2891-Q2941 PolarHBondContact N-O 2.92Å; M2902-Q2941 HydrophobicContact CE-CB 3.84Å; M2902-Q2941 PolarHBondContact SD-OE1 3.04Å; M2902-Q2941 VanDerWaalsContact SD-OE1 3.42Å; L2934-Q2941 HydrophobicContact CD2-CB 4.47Å; D2936-Q2941 HydrophobicContact CB-CG 4.05Å; D2936-Q2941 WeakPolarHBondContact OD2-CG 3.34Å; D2936-Q2941 PolarHBondContact OD2-NE2 2.82Å
2942	Y	68.3	Low	63.6	Low	28 Å²	28	57.6 Å²	57.6	11%	0.11	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	133.7	178.4	-66.7	-89.5	0	0	0	110.5	I2888 M2889 K2890 L2934 R2935 I2937 V2940	I2888-Y2942 HydrophobicContact CG2-CD1 4.04Å; I2888-Y2942 HydrophobicContact CG2-CG 4.49Å; M2889-Y2942 CarbonylContact O-C 3.56Å; M2889-Y2942 WeakPolarHBondContact O-CA 3.09Å; K2890-Y2942 HydrophobicContact CB-CD1 4.03Å; K2890-Y2942 HydrophobicContact CB-CE1 3.79Å; K2890-Y2942 HydrophobicContact CD-CE1 4.14Å; K2890-Y2942 HydrophobicContact CG-CD1 4.39Å; K2890-Y2942 HydrophobicContact CG-CE1 3.86Å; L2934-Y2942 WeakPolarHBondContact CA-O 3.45Å; R2935-Y2942 PolarHBondContact N-O 3.21Å; R2935-Y2942 PolarHBondContact O-N 3.27Å; I2937-Y2942 HydrophobicContact CB-CD2 4.09Å; I2937-Y2942 HydrophobicContact CB-CE2 4.16Å; I2937-Y2942 HydrophobicContact CD1-CD2 4.05Å; I2937-Y2942 HydrophobicContact CG1-CD2 4.2Å; V2940-Y2942 HydrophobicContact CB-CD2 4.47Å; V2940-Y2942 HydrophobicContact CB-CE2 3.74Å; V2940-Y2942 HydrophobicContact CG1-CD2 4.14Å; V2940-Y2942 HydrophobicContact CG1-CE1 4.34Å; V2940-Y2942 HydrophobicContact CG1-CE2 3.44Å; V2940-Y2942 VanDerWaalsContact CG1-CE2 3.44Å; V2940-Y2942 WeakPolarHBondContact O-CD2 3.24Å; V2940-Y2942 WeakPolarHBondContact O-CE2 3.44Å
2943	L	66.5	Low	62.4	Low	3 Å²	3	57.3 Å²	57.3	2%	0.016	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	117.4	171.7	-173.5	70.8	0	0	0	109.5	M2889 V2891 I2906 I2909 V2932 L2934	M2889-L2943 HydrophobicContact CB-CB 4.39Å; M2889-L2943 HydrophobicContact CE-CB 4.48Å; M2889-L2943 HydrophobicContact CE-CD2 4.05Å; M2889-L2943 HydrophobicContact CE-CG 4.22Å; M2889-L2943 PolarHBondContact N-O 2.8Å; M2889-L2943 PolarHBondContact O-N 3.07Å; V2891-L2943 HydrophobicContact CG2-CB 3.87Å; I2906-L2943 HydrophobicContact CG1-CD1 3.84Å; I2909-L2943 HydrophobicContact CD1-CD2 3.3Å; V2932-L2943 HydrophobicContact CG1-CD1 3.58Å; V2932-L2943 HydrophobicContact CG1-CG 4.19Å; L2934-L2943 HydrophobicContact CD1-CB 4.36Å; L2934-L2943 HydrophobicContact CD1-CD1 3.99Å
2944	Y	69.7	Low	61.3	Low	54 Å²	54	62.6 Å²	62.6	21%	0.212	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	123.6	176.6	-70.7	-105.7	0	0	0	109.5	I2888 V2932 S2933 R2935 I2937	I2888-Y2944 HydrophobicContact CB-CE1 4.39Å; I2888-Y2944 HydrophobicContact CD1-CD1 4.16Å; I2888-Y2944 HydrophobicContact CD1-CE1 3.58Å; I2888-Y2944 HydrophobicContact CG1-CD1 3.79Å; I2888-Y2944 HydrophobicContact CG1-CE1 3.69Å; I2888-Y2944 HydrophobicContact CG2-CD1 4.28Å; I2888-Y2944 HydrophobicContact CG2-CE1 3.89Å; I2888-Y2944 HydrophobicContact CG2-CE2 4.2Å; V2932-Y2944 VanDerWaalsContact CA-O 3.32Å; V2932-Y2944 WeakPolarHBondContact CA-O 3.26Å; S2933-Y2944 PolarHBondContact N-O 3.04Å; S2933-Y2944 PolarHBondContact O-N 3.24Å; R2935-Y2944 HydrophobicContact CB-CD2 4.4Å; R2935-Y2944 HydrophobicContact CB-CE2 4.01Å; R2935-Y2944 HydrophobicContact CG-CD2 4.33Å; R2935-Y2944 HydrophobicContact CG-CE2 4.22Å; I2937-Y2944 HydrophobicContact CD1-CE2 4.39Å; I2937-Y2944 WeakPolarHBondContact CD1-OH 3.43Å
2945	L	71	Confident	60.3	Low	14 Å²	14	62.6 Å²	62.6	7%	0.073	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	106.6	171.3	165.1	57.4	0	0	0	109.7	D2886 F2887 M2889 I2909 I2913 Y2930 V2932 L2947	D2886-L2945 CarbonylContact C-O 3.5Å; D2886-L2945 VanDerWaalsContact CA-O 3.28Å; D2886-L2945 WeakPolarHBondContact CA-O 3.45Å; F2887-L2945 HydrophobicContact CB-CB 4.37Å; F2887-L2945 HydrophobicContact CD2-CD2 4.44Å; F2887-L2945 PolarHBondContact N-O 3.41Å; F2887-L2945 PolarHBondContact O-N 3.45Å; M2889-L2945 HydrophobicContact CE-CB 3.72Å; I2909-L2945 HydrophobicContact CG2-CD2 4.35Å; I2913-L2945 HydrophobicContact CD1-CD1 3.29Å; I2913-L2945 HydrophobicContact CD1-CD2 3.5Å; I2913-L2945 VanDerWaalsContact CD1-CD2 3.5Å; I2913-L2945 HydrophobicContact CD1-CG 4.01Å; Y2930-L2945 HydrophobicContact CD2-CD1 4.15Å; V2932-L2945 HydrophobicContact CG2-CD1 3.82Å; L2945-L2947 HydrophobicContact CD1-CD2 3.91Å; L2945-L2947 HydrophobicContact CG-CD2 4.37Å
2946	R	75.1	Confident	59.6	Low	60 Å²	60	56.9 Å²	56.9	23%	0.226	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	113.3	175.5	166.5	167.3	-67.6	179.1	-2.6	110.3	T2884 D2886 Y2930 S2931 K2948	T2884-R2946 HydrophobicContact CG2-CG 4.48Å; D2886-R2946 VanDerWaalsContact CG-NE 3.3Å; D2886-R2946 WeakPolarHBondContact OD1-CA 3.31Å; D2886-R2946 WeakPolarHBondContact OD1-CB 3.33Å; D2886-R2946 WeakPolarHBondContact OD1-CG 3.46Å; D2886-R2946 IonicContact OD1-CZ 2.7Å; D2886-R2946 IonicContact OD1-NE 3.66Å; D2886-R2946 PolarHBondContact OD1-NE 2.9Å; D2886-R2946 IonicContact OD2-CZ 3.64Å; D2886-R2946 IonicContact OD2-NE 3.56Å; D2886-R2946 PolarHBondContact OD2-NE 2.88Å; D2886-R2946 IonicContact OD2-NH2 3.81Å; D2886-R2946 PolarHBondContact OD2-NH2 2.87Å; Y2930-R2946 CarbonylContact C-O 3.59Å; Y2930-R2946 WeakPolarHBondContact CA-O 3.24Å; S2931-R2946 PolarHBondContact N-O 2.92Å; S2931-R2946 PolarHBondContact O-N 3.13Å; R2946-K2948 HydrophobicContact CG-CG 4.01Å
2947	L	70.7	Confident	59.2	Low	8 Å²	8	53 Å²	53	4%	0.042	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	127.7	169.5	-57.9	-179.7	0	0	0	108.8	T2884 V2885 F2887 I2913 L2928 L2945 F2949 L2958	T2884-L2947 CarbonylContact C-O 3.57Å; T2884-L2947 WeakPolarHBondContact CA-O 3.09Å; T2884-L2947 WeakPolarHBondContact CB-O 3.08Å; V2885-L2947 PolarHBondContact N-O 2.77Å; V2885-L2947 PolarHBondContact O-N 3.29Å; F2887-L2947 HydrophobicContact CE2-CD1 4.03Å; I2913-L2947 HydrophobicContact CD1-CD2 4.45Å; I2913-L2947 HydrophobicContact CG2-CD2 4.2Å; L2928-L2947 HydrophobicContact CD2-CD2 4.17Å; L2945-L2947 HydrophobicContact CD1-CD2 3.91Å; L2945-L2947 HydrophobicContact CG-CD2 4.37Å; L2947-F2949 HydrophobicContact CB-CE2 3.71Å; L2947-F2949 HydrophobicContact CB-CZ 4.07Å; L2947-F2949 HydrophobicContact CD1-CZ 4.31Å; L2947-L2958 HydrophobicContact CD1-CD2 4.14Å
2948	K	68.7	Low	59.2	Low	97 Å²	97	50.9 Å²	50.9	42%	0.422	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	130.3	-179.9	-55.6	-169	178.7	-178.7	0	110.6	T2884 Y2926 L2928 P2929 R2946	T2884-K2948 HydrophobicContact CG2-CB 4.17Å; T2884-K2948 HydrophobicContact CG2-CD 4.41Å; T2884-K2948 HydrophobicContact CG2-CG 3.76Å; Y2926-K2948 PolarHBondContact OH-O 3Å; L2928-K2948 WeakPolarHBondContact CD1-O 3.41Å; P2929-K2948 VanDerWaalsContact CD-O 3.29Å; P2929-K2948 WeakPolarHBondContact CD-O 3.31Å; P2929-K2948 HydrophobicContact CG-CB 4.08Å; P2929-K2948 WeakPolarHBondContact CG-O 3.34Å; P2929-K2948 PolarHBondContact O-N 2.99Å; R2946-K2948 HydrophobicContact CG-CG 4.01Å
2949	F	66.9	Low	59	Low	2 Å²	2	46.2 Å²	46.2	1%	0.009	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	124.7	-176.6	-64.3	-87	0	0	0	111	A2882 F2883 V2885 Y2926 L2928 L2947 I2956 L2958 Y2968	A2882-F2949 WeakPolarHBondContact CB-O 3.45Å; F2883-F2949 HydrophobicContact CD1-CB 3.58Å; F2883-F2949 HydrophobicContact CD1-CG 4.33Å; F2883-F2949 HydrophobicContact CD2-CD2 4.19Å; F2883-F2949 HydrophobicContact CE1-CB 3.35Å; F2883-F2949 HydrophobicContact CE1-CD2 4.06Å; F2883-F2949 AromaticContact CE1-CG 3.74Å; F2883-F2949 HydrophobicContact CE1-CG 3.74Å; F2883-F2949 HydrophobicContact CE2-CB 4.47Å; F2883-F2949 AromaticContact CE2-CD2 3.69Å; F2883-F2949 HydrophobicContact CE2-CD2 3.69Å; F2883-F2949 HydrophobicContact CE2-CE2 4.25Å; F2883-F2949 HydrophobicContact CE2-CG 4.23Å; F2883-F2949 HydrophobicContact CG-CB 4.25Å; F2883-F2949 HydrophobicContact CZ-CB 3.84Å; F2883-F2949 HydrophobicContact CZ-CD1 4.39Å; F2883-F2949 AromaticContact CZ-CD2 3.61Å; F2883-F2949 HydrophobicContact CZ-CD2 3.61Å; F2883-F2949 HydrophobicContact CZ-CE2 4.28Å; F2883-F2949 AromaticContact CZ-CG 3.68Å; F2883-F2949 HydrophobicContact CZ-CG 3.68Å; F2883-F2949 PolarHBondContact N-O 3.3Å; F2883-F2949 PolarHBondContact O-N 3.12Å; V2885-F2949 HydrophobicContact CB-CE2 4.23Å; V2885-F2949 HydrophobicContact CG2-CD2 4.31Å; V2885-F2949 HydrophobicContact CG2-CE2 3.8Å; Y2926-F2949 WeakPolarHBondContact OH-CA 3.47Å; L2928-F2949 HydrophobicContact CD1-CD1 3.69Å; L2928-F2949 HydrophobicContact CD1-CE1 3.42Å; L2928-F2949 VanDerWaalsContact CD1-CE1 3.42Å; L2928-F2949 HydrophobicContact CD1-CE2 4.47Å; L2928-F2949 HydrophobicContact CD1-CG 4.34Å; L2928-F2949 HydrophobicContact CD1-CZ 3.85Å; L2947-F2949 HydrophobicContact CB-CE2 3.71Å; L2947-F2949 HydrophobicContact CB-CZ 4.07Å; L2947-F2949 HydrophobicContact CD1-CZ 4.31Å; F2949-I2956 HydrophobicContact CD1-CD1 3.58Å; F2949-I2956 HydrophobicContact CE1-CD1 3.95Å; F2949-I2956 HydrophobicContact CG-CD1 4.11Å; F2949-L2958 HydrophobicContact CE1-CD1 4.5Å; F2949-L2958 HydrophobicContact CZ-CD1 4Å; F2949-Y2968 HydrophobicContact CE1-CE2 4.06Å
2950	K	58.4	Low	58.6	Low	133 Å²	133	43.7 Å²	43.7	58%	0.578	23%	0.228	S	C	*	.			trans	-76.4	152.3	178.7	-65.3	-168.7	-178.6	-172.4	0	110.8	Y2926 G2952	Y2926-K2950 HydrophobicContact CE2-CB 3.85Å; Y2926-K2950 HydrophobicContact CE2-CD 4.11Å; Y2926-K2950 HydrophobicContact CE2-CG 3.88Å; Y2926-K2950 PolarHBondContact OH-N 3.37Å; K2950-G2952 PolarHBondContact O-N 2.96Å
2951	P	52.7	Low	58.4	Low	61 Å²	61	42.9 Å²	42.9	40%	0.396	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.4	138.3	177.2	-25.7	35.3	0	0	0	112.6	R2880	R2880-P2951 HydrophobicContact CB-CB 4.32Å; R2880-P2951 WeakPolarHBondContact O-CG 3.46Å
2952	G	45.7	Very low	57.8	Low	43 Å²	43	43.2 Å²	43.2	44%	0.443	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	99.9	-4.8	176.3	0	0	0	0	0	116.2	K2950 K2954	K2950-G2952 PolarHBondContact O-N 2.96Å; G2952-K2954 PolarHBondContact O-N 3.49Å
2953	A	48	Very low	56.9	Low	21 Å²	21	43 Å²	43	17%	0.174	24%	0.235	C	C	.	.			trans	-59.9	120.6	170.2	0	0	0	0	0	110.9	L2876 A2955 I2956	L2876-A2953 WeakPolarHBondContact CD1-O 3.38Å; A2953-A2955 PolarHBondContact O-N 2.91Å; A2953-I2956 HydrophobicContact CB-CD1 3.88Å; A2953-I2956 HydrophobicContact CB-CG1 4.45Å
2954	K	48.5	Very low	55.9	Low	168 Å²	168	46.2 Å²	46.2	73%	0.73	25%	0.25	S	S	*	.			trans	-74.1	127.2	-176.4	-69.6	-178.4	179.5	176.3	0	111.3	G2952 I2956 N2969	G2952-K2954 PolarHBondContact O-N 3.49Å; K2954-I2956 PolarHBondContact O-N 3.4Å; K2954-N2969 PolarHBondContact O-ND2 3.14Å
2955	A	46.1	Very low	54.9	Low	62 Å²	62	46.8 Å²	46.8	51%	0.512	25%	0.254	S	S	.	.	S	Bend	trans	24.6	87.8	167.1	0	0	0	0	0	114.6	V2874 L2875 A2953 S2957 N2969	V2874-A2955 WeakPolarHBondContact O-CA 3.44Å; L2875-A2955 HydrophobicContact CD2-CB 4.09Å; A2953-A2955 PolarHBondContact O-N 2.91Å; A2955-S2957 PolarHBondContact O-N 2.85Å; A2955-N2969 PolarHBondContact O-ND2 2.78Å; A2955-N2969 PolarHBondContact O-OD1 2.93Å
2956	I	49.1	Very low	53.9	Low	4 Å²	4	47.3 Å²	47.3	2%	0.021	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	119.8	-169.7	-69.2	168	0	0	0	110.4	R2873 V2874 F2883 F2949 A2953 K2954 L2958 Y2968 N2969	R2873-I2956 CarbonylContact C-O 3.56Å; R2873-I2956 VanDerWaalsContact CA-O 3.32Å; R2873-I2956 WeakPolarHBondContact CA-O 3.42Å; V2874-I2956 PolarHBondContact N-O 2.77Å; V2874-I2956 PolarHBondContact O-N 2.97Å; F2883-I2956 HydrophobicContact CE1-CD1 3.78Å; F2883-I2956 HydrophobicContact CZ-CD1 3.64Å; F2949-I2956 HydrophobicContact CD1-CD1 3.58Å; F2949-I2956 HydrophobicContact CE1-CD1 3.95Å; F2949-I2956 HydrophobicContact CG-CD1 4.11Å; A2953-I2956 HydrophobicContact CB-CD1 3.88Å; A2953-I2956 HydrophobicContact CB-CG1 4.45Å; K2954-I2956 PolarHBondContact O-N 3.4Å; I2956-L2958 HydrophobicContact CG2-CB 4.2Å; I2956-L2958 HydrophobicContact CG2-CD1 3.81Å; I2956-Y2968 HydrophobicContact CB-CE2 4.41Å; I2956-Y2968 HydrophobicContact CD1-CE2 4.11Å; I2956-Y2968 HydrophobicContact CG1-CE2 3.8Å; I2956-Y2968 HydrophobicContact CG2-CD2 4.21Å; I2956-Y2968 HydrophobicContact CG2-CE2 3.85Å; I2956-N2969 VanDerWaalsContact CA-OD1 3.28Å; I2956-N2969 WeakPolarHBondContact CA-OD1 3.31Å
2957	S	52.2	Low	52.7	Low	4 Å²	4	45.5 Å²	45.5	3%	0.028	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	94.6	161.8	172.3	0	0	0	0	109	T2872 A2955 Y2968 N2969	T2872-S2957 CarbonylContact O-C 3.59Å; T2872-S2957 VanDerWaalsContact O-CA 3.28Å; T2872-S2957 WeakPolarHBondContact O-CA 3.32Å; A2955-S2957 PolarHBondContact O-N 2.85Å; S2957-Y2968 WeakPolarHBondContact O-CA 3.28Å; S2957-N2969 PolarHBondContact N-OD1 2.77Å; S2957-N2969 PolarHBondContact O-N 2.86Å
2958	L	52.3	Low	51.6	Low	5 Å²	5	46.4 Å²	46.4	3%	0.026	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	128.3	172.8	-137.2	85.6	0	0	0	109.2	T2872 F2887 L2947 F2949 I2956 L2960 Y2968	T2872-L2958 PolarHBondContact N-O 3.04Å; T2872-L2958 PolarHBondContact O-N 3.45Å; T2872-L2958 VanDerWaalsContact OG1-CB 3.32Å; T2872-L2958 WeakPolarHBondContact OG1-CB 3.28Å; F2887-L2958 HydrophobicContact CE2-CD2 4.03Å; F2887-L2958 HydrophobicContact CZ-CD2 3.94Å; L2947-L2958 HydrophobicContact CD1-CD2 4.14Å; F2949-L2958 HydrophobicContact CE1-CD1 4.5Å; F2949-L2958 HydrophobicContact CZ-CD1 4Å; I2956-L2958 HydrophobicContact CG2-CB 4.2Å; I2956-L2958 HydrophobicContact CG2-CD1 3.81Å; L2958-L2960 HydrophobicContact CD2-CD1 4Å; L2958-Y2968 HydrophobicContact CD1-CD2 3.84Å
2959	K	53.9	Low	51	Low	30 Å²	30	44.6 Å²	44.6	13%	0.13	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	106.8	171.5	-51.1	167.7	170.4	170.9	0	109.5	L2870 F2871 F2961 V2966 I2967 D2970	L2870-K2959 VanDerWaalsContact O-CA 3.29Å; L2870-K2959 WeakPolarHBondContact O-CA 3.19Å; F2871-K2959 HydrophobicContact CD2-CD 4.3Å; F2871-K2959 VanDerWaalsContact CD2-CE 3.49Å; F2871-K2959 HydrophobicContact CD2-CG 4.11Å; K2959-F2961 HydrophobicContact CB-CD2 4.44Å; K2959-F2961 HydrophobicContact CB-CE2 3.68Å; K2959-F2961 HydrophobicContact CB-CZ 4.47Å; K2959-V2966 WeakPolarHBondContact O-CA 3.48Å; K2959-I2967 HydrophobicContact CB-CB 4Å; K2959-I2967 HydrophobicContact CB-CD1 4.42Å; K2959-I2967 HydrophobicContact CB-CG1 4.31Å; K2959-I2967 HydrophobicContact CD-CB 4.27Å; K2959-I2967 HydrophobicContact CD-CD1 4.16Å; K2959-I2967 HydrophobicContact CD-CG2 4.45Å; K2959-I2967 HydrophobicContact CG-CB 4.48Å; K2959-I2967 PolarHBondContact N-O 3.03Å; K2959-I2967 PolarHBondContact O-N 2.79Å; K2959-D2970 WeakPolarHBondContact CE-OD1 3.18Å; K2959-D2970 IonicContact NZ-OD1 3.63Å; K2959-D2970 PolarHBondContact NZ-OD1 2.76Å
2960	L	50.8	Low	50.1	Low	15 Å²	15	48.6 Å²	48.6	8%	0.079	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	128.7	174.7	-118	84.5	0	0	0	110.3	L2869 L2870 F2887 L2958 V2966	L2869-L2960 CarbonylContact C-O 3.54Å; L2869-L2960 VanDerWaalsContact CA-O 3.26Å; L2869-L2960 WeakPolarHBondContact CA-O 3.42Å; L2870-L2960 PolarHBondContact N-O 2.67Å; L2870-L2960 PolarHBondContact O-N 2.88Å; L2870-L2960 VanDerWaalsContact O-N 3.13Å; F2887-L2960 HydrophobicContact CD1-CD2 3.86Å; F2887-L2960 HydrophobicContact CD2-CD2 4.01Å; F2887-L2960 HydrophobicContact CE1-CB 4.44Å; F2887-L2960 HydrophobicContact CE1-CD2 3.86Å; F2887-L2960 HydrophobicContact CE1-CG 4.5Å; F2887-L2960 HydrophobicContact CE2-CD1 3.92Å; F2887-L2960 HydrophobicContact CE2-CD2 4Å; F2887-L2960 HydrophobicContact CG-CD2 3.93Å; F2887-L2960 HydrophobicContact CZ-CB 4.48Å; F2887-L2960 HydrophobicContact CZ-CD1 3.87Å; F2887-L2960 HydrophobicContact CZ-CD2 3.93Å; F2887-L2960 HydrophobicContact CZ-CG 4.31Å; L2958-L2960 HydrophobicContact CD2-CD1 4Å; L2960-V2966 HydrophobicContact CD1-CB 4.38Å; L2960-V2966 HydrophobicContact CD1-CG1 4Å; L2960-V2966 HydrophobicContact CD1-CG2 3.76Å; L2960-V2966 HydrophobicContact CG-CG2 4.18Å
2961	F	50.2	Low	49.3	Very low	32 Å²	32	47.3 Å²	47.3	14%	0.14	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	105.1	178.8	-61.8	-117.2	0	0	0	109.6	L2869 K2959 G2963 H2964 K2965 I2967 F3018	L2869-F2961 HydrophobicContact CD1-CD1 3.67Å; L2869-F2961 HydrophobicContact CD1-CE1 3.61Å; L2869-F2961 HydrophobicContact CD2-CD1 3.91Å; L2869-F2961 HydrophobicContact CD2-CD2 4.35Å; L2869-F2961 HydrophobicContact CD2-CE1 3.7Å; L2869-F2961 HydrophobicContact CD2-CE2 4.14Å; L2869-F2961 HydrophobicContact CD2-CG 4.22Å; L2869-F2961 HydrophobicContact CD2-CZ 3.82Å; L2869-F2961 HydrophobicContact CG-CD1 3.48Å; L2869-F2961 VanDerWaalsContact CG-CD1 3.48Å; L2869-F2961 HydrophobicContact CG-CE1 3.68Å; L2869-F2961 HydrophobicContact CG-CG 3.95Å; L2869-F2961 HydrophobicContact CG-CZ 4.3Å; K2959-F2961 HydrophobicContact CB-CD2 4.44Å; K2959-F2961 HydrophobicContact CB-CE2 3.68Å; K2959-F2961 HydrophobicContact CB-CZ 4.47Å; F2961-G2963 VanDerWaalsContact C-N 3.29Å; F2961-G2963 PolarHBondContact O-N 3.09Å; F2961-H2964 PolarHBondContact O-N 3.16Å; F2961-K2965 HydrophobicContact CB-CB 4.12Å; F2961-K2965 HydrophobicContact CD2-CB 4.17Å; F2961-K2965 HydrophobicContact CG-CB 4.36Å; F2961-K2965 PolarHBondContact N-O 2.71Å; F2961-K2965 PolarHBondContact O-N 2.7Å; F2961-I2967 HydrophobicContact CE2-CD1 3.47Å; F2961-I2967 VanDerWaalsContact CE2-CD1 3.47Å; F2961-I2967 HydrophobicContact CE2-CG1 3.82Å; F2961-I2967 HydrophobicContact CZ-CD1 3.81Å; F2961-F3018 HydrophobicContact CE1-CE2 4Å; F2961-F3018 HydrophobicContact CE1-CZ 4.39Å; F2961-F3018 HydrophobicContact CZ-CE2 4.41Å
2962	S	49.6	Very low	48.8	Very low	63 Å²	63	47.5 Å²	47.5	44%	0.441	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	37.4	49.2	168	72.5	0	0	0	0	116	I2868 H2964	I2868-S2962 PolarHBondContact O-N 3.08Å; I2868-S2962 VanDerWaalsContact O-N 3.14Å; S2962-H2964 PolarHBondContact O-N 3.18Å; S2962-H2964 VanDerWaalsContact O-N 3.09Å; S2962-H2964 PolarHBondContact O-ND1 2.88Å
2963	G	48	Very low	48.9	Very low	23 Å²	23	46.2 Å²	46.2	24%	0.237	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	67.6	2.6	179.5	0	0	0	0	0	116.9	F2961 L2978	F2961-G2963 VanDerWaalsContact C-N 3.29Å; F2961-G2963 PolarHBondContact O-N 3.09Å; G2963-L2978 VanDerWaalsContact O-CD1 3.27Å; G2963-L2978 WeakPolarHBondContact O-CD1 3.26Å
2964	H	47.2	Very low	48.7	Very low	72 Å²	72	45.7 Å²	45.7	33%	0.333	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.6	-24.1	-169.1	-79.7	65.3	0	0	0	115.3	F2961 S2962 L2978	F2961-H2964 PolarHBondContact O-N 3.16Å; S2962-H2964 PolarHBondContact O-N 3.18Å; S2962-H2964 VanDerWaalsContact O-N 3.09Å; S2962-H2964 PolarHBondContact O-ND1 2.88Å; H2964-L2978 PolarHBondContact CE1-O 2.81Å; H2964-L2978 PolarHBondContact NE2-O 2.96Å; H2964-L2978 VanDerWaalsContact NE2-O 3.15Å
2965	K	47.6	Very low	48.3	Very low	66 Å²	66	41.3 Å²	41.3	29%	0.287	23%	0.232	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	140.5	179.9	-52.4	-178.8	-175.9	-179.1	0	111.4	F2961	F2961-K2965 HydrophobicContact CB-CB 4.12Å; F2961-K2965 HydrophobicContact CD2-CB 4.17Å; F2961-K2965 HydrophobicContact CG-CB 4.36Å; F2961-K2965 PolarHBondContact N-O 2.71Å; F2961-K2965 PolarHBondContact O-N 2.7Å
2966	V	50.5	Low	47.8	Very low	25 Å²	25	41.4 Å²	41.4	15%	0.152	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	124.4	168.8	-174.9	0	0	0	0	108.2	K2959 L2960 Q2973	K2959-V2966 WeakPolarHBondContact O-CA 3.48Å; L2960-V2966 HydrophobicContact CD1-CB 4.38Å; L2960-V2966 HydrophobicContact CD1-CG1 4Å; L2960-V2966 HydrophobicContact CD1-CG2 3.76Å; L2960-V2966 HydrophobicContact CG-CG2 4.18Å; V2966-Q2973 PolarHBondContact O-N 3.39Å
2967	I	49.2	Very low	47.4	Very low	21 Å²	21	50.2 Å²	50.2	11%	0.108	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	133.3	168.5	-44.4	-178	0	0	0	107.1	K2959 F2961 Q2971 V2972	K2959-I2967 HydrophobicContact CB-CB 4Å; K2959-I2967 HydrophobicContact CB-CD1 4.42Å; K2959-I2967 HydrophobicContact CB-CG1 4.31Å; K2959-I2967 HydrophobicContact CD-CB 4.27Å; K2959-I2967 HydrophobicContact CD-CD1 4.16Å; K2959-I2967 HydrophobicContact CD-CG2 4.45Å; K2959-I2967 HydrophobicContact CG-CB 4.48Å; K2959-I2967 PolarHBondContact N-O 3.03Å; K2959-I2967 PolarHBondContact O-N 2.79Å; F2961-I2967 HydrophobicContact CE2-CD1 3.47Å; F2961-I2967 VanDerWaalsContact CE2-CD1 3.47Å; F2961-I2967 HydrophobicContact CE2-CG1 3.82Å; F2961-I2967 HydrophobicContact CZ-CD1 3.81Å; I2967-Q2971 WeakPolarHBondContact CA-O 3.45Å; I2967-Q2971 VanDerWaalsContact CG2-C 3.48Å; I2967-Q2971 WeakPolarHBondContact CG2-O 3.29Å; I2967-V2972 HydrophobicContact CD1-CG2 4Å; I2967-V2972 HydrophobicContact CG1-CG1 4.43Å; I2967-V2972 HydrophobicContact CG1-CG2 4.05Å; I2967-V2972 HydrophobicContact CG2-CG2 4.25Å
2968	Y	49.2	Very low	46.6	Very low	28 Å²	28	50.7 Å²	50.7	11%	0.11	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	125.1	177.1	177.9	-86.2	0	0	0	108.6	L2920 F2949 I2956 S2957 L2958 D2970 Q2971	L2920-Y2968 HydrophobicContact CD2-CD1 3.57Å; L2920-Y2968 HydrophobicContact CD2-CE1 3.85Å; L2920-Y2968 HydrophobicContact CD2-CG 4.09Å; F2949-Y2968 HydrophobicContact CE1-CE2 4.06Å; I2956-Y2968 HydrophobicContact CB-CE2 4.41Å; I2956-Y2968 HydrophobicContact CD1-CE2 4.11Å; I2956-Y2968 HydrophobicContact CG1-CE2 3.8Å; I2956-Y2968 HydrophobicContact CG2-CD2 4.21Å; I2956-Y2968 HydrophobicContact CG2-CE2 3.85Å; S2957-Y2968 WeakPolarHBondContact O-CA 3.28Å; L2958-Y2968 HydrophobicContact CD1-CD2 3.84Å; Y2968-D2970 PolarHBondContact O-N 3.33Å; Y2968-Q2971 PolarHBondContact N-O 2.89Å; Y2968-Q2971 PolarHBondContact O-N 3.28Å
2969	N	54.1	Low	45.9	Very low	59 Å²	59	62.3 Å²	62.3	32%	0.316	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.3	47.9	-179.4	-68.8	10.9	0	0	0	112.7	K2954 A2955 I2956 S2957 Q2971	K2954-N2969 PolarHBondContact O-ND2 3.14Å; A2955-N2969 PolarHBondContact O-ND2 2.78Å; A2955-N2969 PolarHBondContact O-OD1 2.93Å; I2956-N2969 VanDerWaalsContact CA-OD1 3.28Å; I2956-N2969 WeakPolarHBondContact CA-OD1 3.31Å; S2957-N2969 PolarHBondContact N-OD1 2.77Å; S2957-N2969 PolarHBondContact O-N 2.86Å; N2969-Q2971 PolarHBondContact O-N 2.76Å
2970	D	48.2	Very low	45.2	Very low	86 Å²	86	61.9 Å²	61.9	46%	0.46	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.5	9.9	178.9	-60.3	-53.3	0	0	0	115.8	R2873 K2959 Y2968	R2873-D2970 IonicContact NH2-OD2 3.79Å; K2959-D2970 WeakPolarHBondContact CE-OD1 3.18Å; K2959-D2970 IonicContact NZ-OD1 3.63Å; K2959-D2970 PolarHBondContact NZ-OD1 2.76Å; Y2968-D2970 PolarHBondContact O-N 3.33Å
2971	Q	41.8	Very low	44.8	Very low	106 Å²	106	67.1 Å²	67.1	50%	0.495	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	129.2	166.4	-64.8	-173.1	-13.4	0	0	111	I2967 Y2968 N2969	I2967-Q2971 WeakPolarHBondContact CA-O 3.45Å; I2967-Q2971 VanDerWaalsContact CG2-C 3.48Å; I2967-Q2971 WeakPolarHBondContact CG2-O 3.29Å; Y2968-Q2971 PolarHBondContact N-O 2.89Å; Y2968-Q2971 PolarHBondContact O-N 3.28Å; N2969-Q2971 PolarHBondContact O-N 2.76Å
2972	V	42.8	Very low	44.7	Very low	64 Å²	64	66 Å²	66	39%	0.388	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	117.5	179.2	-172.5	0	0	0	0	109	I2967	I2967-V2972 HydrophobicContact CD1-CG2 4Å; I2967-V2972 HydrophobicContact CG1-CG1 4.43Å; I2967-V2972 HydrophobicContact CG1-CG2 4.05Å; I2967-V2972 HydrophobicContact CG2-CG2 4.25Å
2973	Q	48.2	Very low	44.8	Very low	16 Å²	16	67.8 Å²	67.8	8%	0.075	33%	0.328	C	S	.	.			trans	-102.7	-15.3	-164.7	-65.4	-93.6	-34.2	0	0	114.2	V2916 V2919 V2966	V2916-Q2973 HydrophobicContact CB-CB 4.2Å; V2916-Q2973 HydrophobicContact CG1-CB 3.82Å; V2916-Q2973 HydrophobicContact CG1-CG 4.26Å; V2916-Q2973 HydrophobicContact CG2-CB 3.78Å; V2916-Q2973 PolarHBondContact O-OE1 3.35Å; V2919-Q2973 VanDerWaalsContact CB-OE1 3.29Å; V2966-Q2973 PolarHBondContact O-N 3.39Å
2974	T	43.9	Very low	45.1	Very low	11 Å²	11	67.9 Å²	67.9	7%	0.067	32%	0.324	C	S	.	.			trans	-159.8	152.9	179.1	-172.1	0	0	0	0	112.9	T2912 V2916	T2912-T2974 HydrophobicContact CG2-CG2 3.64Å; V2916-T2974 HydrophobicContact CG2-CG2 3.5Å; V2916-T2974 VanDerWaalsContact CG2-CG2 3.5Å
2975	T	40.2	Very low	45.5	Very low	76 Å²	76	65.6 Å²	65.6	47%	0.466	31%	0.314	S	S	.	.			trans	-134.8	8.4	-177.1	54.9	0	0	0	0	113.8	K2977	T2975-K2977 PolarHBondContact O-N 3.22Å
2976	N	36	Very low	45.9	Very low	63 Å²	63	67.4 Å²	67.4	34%	0.337	32%	0.319	S	S	.	.			trans	-61.7	124.4	-177.2	-106.6	37.7	0	0	0	111.2	K2915 L2978	K2915-N2976 PolarHBondContact NZ-OD1 3.48Å; N2976-L2978 PolarHBondContact O-N 3.48Å
2977	K	40.4	Very low	46.2	Very low	190 Å²	190	67.7 Å²	67.7	83%	0.826	32%	0.324	S	S	*	.			trans	-73.1	93.4	177	-70.1	179.2	-179	173	0	111.1	T2975 R2979	T2975-K2977 PolarHBondContact O-N 3.22Å; K2977-R2979 PolarHBondContact O-N 3.13Å
2978	L	34.8	Very low	46.7	Very low	14 Å²	14	70.1 Å²	70.1	7%	0.073	34%	0.34	C	S	.	.			trans	-64.5	116.6	169.6	-104.3	156	0	0	0	110.6	I2909 T2912 G2963 H2964 N2976 S2980	I2909-L2978 HydrophobicContact CB-CD1 4.47Å; I2909-L2978 HydrophobicContact CG1-CD1 3.49Å; I2909-L2978 VanDerWaalsContact CG1-CD1 3.49Å; I2909-L2978 HydrophobicContact CG1-CD2 3.79Å; I2909-L2978 HydrophobicContact CG1-CG 4.29Å; T2912-L2978 HydrophobicContact CG2-CD1 4.36Å; G2963-L2978 VanDerWaalsContact O-CD1 3.27Å; G2963-L2978 WeakPolarHBondContact O-CD1 3.26Å; H2964-L2978 PolarHBondContact CE1-O 2.81Å; H2964-L2978 PolarHBondContact NE2-O 2.96Å; H2964-L2978 VanDerWaalsContact NE2-O 3.15Å; N2976-L2978 PolarHBondContact O-N 3.48Å; L2978-S2980 PolarHBondContact O-N 2.85Å
2979	R	38.1	Very low	47.2	Very low	249 Å²	249	70.9 Å²	70.9	94%	0.94	35%	0.345	S	S	*	.			trans	-72.3	-10.8	178.8	-74.8	-170.7	-179.3	-178.6	3.1	113.7	K2977	K2977-R2979 PolarHBondContact O-N 3.13Å
2980	S	38.3	Very low	47.3	Very low	20 Å²	20	70.9 Å²	70.9	14%	0.14	35%	0.345	C	S	.	.	S	Bend	trans	-76.1	136.4	-175.5	60.3	0	0	0	0	112.1	S2905 L2978 A2982	S2905-S2980 WeakPolarHBondContact OG-CB 3.35Å; L2978-S2980 PolarHBondContact O-N 2.85Å; S2980-A2982 PolarHBondContact O-N 2.87Å
2981	K	42.9	Very low	47.9	Very low	126 Å²	126	67.9 Å²	67.9	55%	0.548	33%	0.334	S	S	.	.			trans	-77.4	45	169.6	-57.1	176.5	-170.6	163.5	0	111	H2983	K2981-H2983 PolarHBondContact O-CD2 2.86Å; K2981-H2983 PolarHBondContact O-N 2.71Å; K2981-H2983 VanDerWaalsContact O-N 3.1Å
2982	A	47	Very low	48.5	Very low	8 Å²	8	64.2 Å²	64.2	7%	0.066	32%	0.318	C	S	.	.			trans	-80.1	91.8	-179.4	0	0	0	0	0	109.5	M2889 S2980	M2889-A2982 HydrophobicContact CB-CB 4.15Å; M2889-A2982 HydrophobicContact CG-CB 4.4Å; M2889-A2982 HydrophobicContact SD-CB 3.99Å; S2980-A2982 PolarHBondContact O-N 2.87Å
2983	H	53.4	Low	49.1	Very low	101 Å²	101	62 Å²	62	47%	0.468	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	132.2	172.8	-73.6	-107.9	0	0	0	109.1	M2889 K2890 K2981 D2985	M2889-H2983 WeakPolarHBondContact CA-O 3.48Å; M2889-H2983 WeakPolarHBondContact CB-O 3.37Å; K2890-H2983 PolarHBondContact N-O 2.85Å; K2981-H2983 PolarHBondContact O-CD2 2.86Å; K2981-H2983 PolarHBondContact O-N 2.71Å; K2981-H2983 VanDerWaalsContact O-N 3.1Å; H2983-D2985 PolarHBondContact O-N 3.3Å; H2983-D2985 VanDerWaalsContact O-N 3.1Å
2984	V	53.6	Low	49	Very low	25 Å²	25	64.5 Å²	64.5	15%	0.152	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	105.4	173.5	177.8	0	0	0	0	107.6	I2868 F2887 M2889 R2986	I2868-V2984 WeakPolarHBondContact CD1-O 3.4Å; F2887-V2984 HydrophobicContact CD1-CG1 4.01Å; M2889-V2984 HydrophobicContact CG-CB 4.39Å; M2889-V2984 HydrophobicContact CG-CG2 3.89Å; M2889-V2984 HydrophobicContact SD-CG2 4.36Å; V2984-R2986 WeakPolarHBondContact CG1-O 3.32Å
2985	D	55	Low	49.1	Very low	24 Å²	24	65.6 Å²	65.6	13%	0.128	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	-43.6	177.8	-165.6	72.3	0	0	0	109.4	I2863 I2888 K2890 H2983	I2863-D2985 WeakPolarHBondContact CD1-O 3.2Å; I2888-D2985 WeakPolarHBondContact O-CB 3.48Å; I2888-D2985 PolarHBondContact O-N 3.27Å; K2890-D2985 HydrophobicContact CB-CB 4.27Å; H2983-D2985 PolarHBondContact O-N 3.3Å; H2983-D2985 VanDerWaalsContact O-N 3.1Å
2986	R	57.3	Low	49.2	Very low	104 Å²	104	70 Å²	70	39%	0.392	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	154.4	-176.1	-52.8	169.8	-142.9	-149.2	-8.5	111.2	I2888 V2984	I2888-R2986 HydrophobicContact CB-CB 4.17Å; I2888-R2986 HydrophobicContact CD1-CB 4.21Å; I2888-R2986 HydrophobicContact CG1-CB 4.4Å; I2888-R2986 PolarHBondContact N-O 2.68Å; I2888-R2986 PolarHBondContact O-N 2.71Å; I2888-R2986 VanDerWaalsContact O-N 3.13Å; V2984-R2986 WeakPolarHBondContact CG1-O 3.32Å
2987	A	57	Low	49.5	Very low	30 Å²	30	71.9 Å²	71.9	25%	0.248	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	125.7	168	0	0	0	0	0	109.6	L2870 D2886 F2887 M2998	L2870-A2987 HydrophobicContact CD2-CB 3.9Å; D2886-A2987 CarbonylContact O-C 3.5Å; D2886-A2987 VanDerWaalsContact O-CA 3.3Å; D2886-A2987 WeakPolarHBondContact O-CA 3.49Å; F2887-A2987 HydrophobicContact CD1-CB 3.89Å; F2887-A2987 HydrophobicContact CE1-CB 3.89Å; A2987-M2998 HydrophobicContact CB-CE 4.47Å
2988	V	58.3	Low	49.8	Very low	72 Å²	72	66.5 Å²	66.5	44%	0.436	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	138.7	178.5	-175.8	0	0	0	0	108.6	V2885 D2886 I2888	V2885-V2988 CarbonylContact C-O 3.59Å; V2885-V2988 WeakPolarHBondContact CA-O 3.14Å; D2886-V2988 HydrophobicContact CB-CB 4.28Å; D2886-V2988 PolarHBondContact N-O 2.86Å; D2886-V2988 PolarHBondContact O-N 2.9Å; I2888-V2988 HydrophobicContact CD1-CG2 4.42Å
2989	I	60.2	Low	50.3	Low	44 Å²	44	67.6 Å²	67.6	23%	0.226	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	123.1	173.8	-55	178	0	0	0	107.1	T2872 F2883 T2884 V2885 V2993 L2995	T2872-I2989 HydrophobicContact CG2-CD1 4.29Å; F2883-I2989 HydrophobicContact CD2-CG2 4.19Å; T2884-I2989 WeakPolarHBondContact O-CA 3.24Å; V2885-I2989 HydrophobicContact CG1-CG1 4.25Å; V2885-I2989 HydrophobicContact CG2-CG1 4.3Å; V2885-I2989 HydrophobicContact CG2-CG2 4.4Å; I2989-V2993 HydrophobicContact CG2-CG2 3.81Å; I2989-L2995 HydrophobicContact CD1-CD1 3.96Å; I2989-L2995 HydrophobicContact CD1-CD2 4.33Å
2990	D	56.7	Low	50.8	Low	59 Å²	59	58.6 Å²	58.6	32%	0.316	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	152.2	-177.6	176.8	33.1	0	0	0	110.2	F2883 T2884	F2883-D2990 CarbonylContact C-O 3.55Å; F2883-D2990 WeakPolarHBondContact CA-O 3.44Å; F2883-D2990 WeakPolarHBondContact CB-O 3.37Å; T2884-D2990 PolarHBondContact N-O 3.34Å; T2884-D2990 PolarHBondContact O-N 2.82Å
2991	G	59.7	Low	51.2	Low	23 Å²	23	58.4 Å²	58.4	24%	0.237	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	95.1	-167.7	-177	0	0	0	0	0	115.5	V2993	G2991-V2993 PolarHBondContact O-N 2.86Å
2992	D	55.5	Low	51.4	Low	29 Å²	29	55.9 Å²	55.9	16%	0.155	30%	0.299	C	S	.	.	S	Bend	trans	-90.8	69.3	-155.9	-153.7	-4.8	0	0	0	114	K2877 T2879 K2881	K2877-D2992 WeakPolarHBondContact CB-OD1 3.37Å; K2877-D2992 VanDerWaalsContact CD-OD1 3.29Å; K2877-D2992 WeakPolarHBondContact CD-OD1 3.37Å; K2877-D2992 PolarHBondContact N-O 3.35Å; T2879-D2992 VanDerWaalsContact C-OD2 3.32Å; T2879-D2992 WeakPolarHBondContact CB-OD2 3.11Å; T2879-D2992 VanDerWaalsContact OG1-CG 3.25Å; T2879-D2992 PolarHBondContact OG1-OD1 2.93Å; T2879-D2992 PolarHBondContact OG1-OD2 2.85Å; K2881-D2992 HydrophobicContact CB-CB 4.01Å
2993	V	55.3	Low	51.4	Low	17 Å²	17	60 Å²	60	10%	0.103	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	158.1	-170.3	-72.7	0	0	0	0	114.9	V2874 L2876 K2877 F2883 I2989 G2991	V2874-V2993 HydrophobicContact CG1-CB 3.61Å; V2874-V2993 HydrophobicContact CG1-CG1 3.52Å; V2874-V2993 HydrophobicContact CG1-CG2 4.34Å; L2876-V2993 HydrophobicContact CD2-CG1 4.01Å; K2877-V2993 WeakPolarHBondContact CE-O 3.42Å; F2883-V2993 HydrophobicContact CB-CG1 3.74Å; F2883-V2993 HydrophobicContact CD1-CG1 3.69Å; F2883-V2993 HydrophobicContact CD2-CG1 3.75Å; F2883-V2993 HydrophobicContact CE1-CG1 4.14Å; F2883-V2993 HydrophobicContact CE2-CG1 4.2Å; F2883-V2993 HydrophobicContact CG-CG1 3.47Å; F2883-V2993 VanDerWaalsContact CG-CG1 3.47Å; F2883-V2993 HydrophobicContact CZ-CG1 4.38Å; I2989-V2993 HydrophobicContact CG2-CG2 3.81Å; G2991-V2993 PolarHBondContact O-N 2.86Å
2994	I	46.4	Very low	51.1	Low	70 Å²	70	62.9 Å²	62.9	36%	0.359	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	114.4	163.1	-47.3	-178.4	0	0	0	107.3	L2875 K2877 Y2996	L2875-I2994 HydrophobicContact CB-CB 4.41Å; L2875-I2994 PolarHBondContact N-O 2.87Å; L2875-I2994 WeakPolarHBondContact O-CA 3.4Å; L2875-I2994 WeakPolarHBondContact O-CB 3.33Å; L2875-I2994 PolarHBondContact O-N 3.13Å; K2877-I2994 HydrophobicContact CD-CG1 4.42Å; K2877-I2994 HydrophobicContact CG-CD1 4.11Å; K2877-I2994 HydrophobicContact CG-CG1 3.49Å; K2877-I2994 VanDerWaalsContact CG-CG1 3.49Å; I2994-Y2996 PolarHBondContact O-N 3.47Å
2995	L	44.9	Very low	50.8	Low	34 Å²	34	64.4 Å²	64.4	18%	0.178	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	105.3	173.1	-176.9	58.2	0	0	0	108.8	L2827 T2872 V2874 I2989 M2998	L2827-L2995 HydrophobicContact CB-CD2 3.96Å; L2827-L2995 HydrophobicContact CD1-CD2 3.8Å; T2872-L2995 HydrophobicContact CG2-CD1 4.36Å; V2874-L2995 HydrophobicContact CG2-CD1 4.07Å; I2989-L2995 HydrophobicContact CD1-CD1 3.96Å; I2989-L2995 HydrophobicContact CD1-CD2 4.33Å; L2995-M2998 HydrophobicContact CD1-CB 4.28Å; L2995-M2998 HydrophobicContact CD2-CB 4.03Å; L2995-M2998 HydrophobicContact CD2-SD 3.94Å; L2995-M2998 HydrophobicContact CG-CB 4.34Å
2996	Y	41.7	Very low	50.2	Low	167 Å²	167	64.1 Å²	64.1	66%	0.655	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.9	-37.5	-175.5	-177.8	-91.1	0	0	0	112.3	R2873 L2875 I2994	R2873-Y2996 HydrophobicContact CB-CD1 4.31Å; R2873-Y2996 WeakPolarHBondContact O-CB 3.15Å; R2873-Y2996 PolarHBondContact O-N 3.49Å; L2875-Y2996 HydrophobicContact CD1-CD2 4.34Å; I2994-Y2996 PolarHBondContact O-N 3.47Å
2997	K	43.3	Very low	49.8	Very low	103 Å²	103	60.7 Å²	60.7	45%	0.448	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.3	138.2	174.7	-170.4	168.8	-175.3	172.5	0	109.7	F2871 T2872 R2873 V2999	F2871-K2997 HydrophobicContact CE1-CB 4.5Å; F2871-K2997 HydrophobicContact CE1-CD 4.49Å; T2872-K2997 VanDerWaalsContact CA-O 3.31Å; T2872-K2997 WeakPolarHBondContact CA-O 3.39Å; R2873-K2997 PolarHBondContact N-O 2.95Å; R2873-K2997 PolarHBondContact O-N 2.81Å; K2997-V2999 HydrophobicContact CD-CG2 4.25Å; K2997-V2999 HydrophobicContact CG-CG2 4.02Å
2998	M	46.9	Very low	49.4	Very low	77 Å²	77	63.3 Å²	63.3	38%	0.379	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	131.3	168.4	-173.6	165.7	168.7	0	0	108	L2827 L2870 F2871 T2872 A2987 L2995	L2827-M2998 HydrophobicContact CD1-SD 4.38Å; L2870-M2998 HydrophobicContact CD1-CE 3.65Å; L2870-M2998 HydrophobicContact CD1-CG 3.89Å; L2870-M2998 HydrophobicContact CD2-CE 4.22Å; F2871-M2998 CarbonylContact O-C 3.55Å; F2871-M2998 VanDerWaalsContact O-CA 3.28Å; F2871-M2998 WeakPolarHBondContact O-CA 3.4Å; T2872-M2998 HydrophobicContact CG2-CG 4.19Å; A2987-M2998 HydrophobicContact CB-CE 4.47Å; L2995-M2998 HydrophobicContact CD1-CB 4.28Å; L2995-M2998 HydrophobicContact CD2-CB 4.03Å; L2995-M2998 HydrophobicContact CD2-SD 3.94Å; L2995-M2998 HydrophobicContact CG-CB 4.34Å
2999	V	44.9	Very low	48.8	Very low	38 Å²	38	66.4 Å²	66.4	23%	0.23	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	133.1	175.1	-172	0	0	0	0	109	L2870 F2871 K2997 I3006	L2870-V2999 WeakPolarHBondContact CA-O 3.5Å; F2871-V2999 HydrophobicContact CB-CB 4.32Å; F2871-V2999 PolarHBondContact N-O 3.47Å; F2871-V2999 PolarHBondContact O-N 3.16Å; K2997-V2999 HydrophobicContact CD-CG2 4.25Å; K2997-V2999 HydrophobicContact CG-CG2 4.02Å; V2999-I3006 HydrophobicContact CG1-CD1 4.38Å; V2999-I3006 HydrophobicContact CG1-CG1 3.97Å
3000	A	48.3	Very low	48.1	Very low	59 Å²	59	65.9 Å²	65.9	49%	0.488	35%	0.345	S	S	.	.			trans	-125.3	151.7	167.2	0	0	0	0	0	108.8	I2868 L2870	I2868-A3000 HydrophobicContact CG2-CB 4.09Å; L2870-A3000 HydrophobicContact CD1-CB 4.26Å
3001	G	47.2	Very low	47.6	Very low	17 Å²	17	66.4 Å²	66.4	18%	0.175	35%	0.352	C	S	.	.			trans	159.2	-173	-176.5	0	0	0	0	0	112
3002	T	46.9	Very low	47.2	Very low	72 Å²	72	73.6 Å²	73.6	44%	0.442	38%	0.376	S	S	.	.			trans	-78.1	156.2	175.6	63.6	0	0	0	0	111.8	K3004 S3005 I3006	T3002-K3004 PolarHBondContact O-N 3.09Å; T3002-S3005 PolarHBondContact O-N 2.75Å; T3002-S3005 VanDerWaalsContact O-N 3.15Å; T3002-S3005 WeakPolarHBondContact OG1-CB 3.37Å; T3002-S3005 PolarHBondContact OG1-N 2.75Å; T3002-I3006 PolarHBondContact O-N 3.47Å
3003	E	46.5	Very low	46.9	Very low	94 Å²	94	78.9 Å²	78.9	44%	0.439	40%	0.398	S	S	.	.	H	α-helix	trans	-51.9	-39.7	175.3	-173.5	178.5	179	0	0	111.9	L2869 M3007 F3018 N3022	L2869-E3003 HydrophobicContact CD1-CB 4.3Å; L2869-E3003 HydrophobicContact CD1-CG 4.43Å; E3003-M3007 VanDerWaalsContact O-CB 3.24Å; E3003-M3007 WeakPolarHBondContact O-CB 3.46Å; E3003-M3007 WeakPolarHBondContact O-CG 3.36Å; E3003-M3007 PolarHBondContact O-N 2.82Å; E3003-F3018 HydrophobicContact CG-CE1 4.38Å; E3003-F3018 HydrophobicContact CG-CZ 4.31Å; E3003-F3018 VanDerWaalsContact OE1-CE1 3.3Å; E3003-F3018 WeakPolarHBondContact OE1-CE1 3.47Å; E3003-F3018 WeakPolarHBondContact OE1-CZ 3.28Å; E3003-N3022 PolarHBondContact OE1-ND2 2.86Å
3004	K	47.9	Very low	46.5	Very low	163 Å²	163	82.7 Å²	82.7	71%	0.709	42%	0.415	S	S	*	.	H	α-helix	trans	-64.5	-54.4	175.6	-172.4	-175.9	177.1	-171.3	0	112.1	T3002 I3006 M3007 D3008	T3002-K3004 PolarHBondContact O-N 3.09Å; K3004-I3006 VanDerWaalsContact C-N 3.29Å; K3004-I3006 PolarHBondContact O-N 3.07Å; K3004-M3007 WeakPolarHBondContact O-CB 3.34Å; K3004-M3007 PolarHBondContact O-N 3.2Å; K3004-M3007 VanDerWaalsContact O-N 3.15Å; K3004-D3008 PolarHBondContact O-N 2.95Å
3005	S	46.9	Very low	46.8	Very low	56 Å²	56	82.4 Å²	82.4	39%	0.392	41%	0.409	S	S	.	.	H	α-helix	trans	-59.2	-39.8	-178.5	176.9	0	0	0	0	112.3	T3002 D3008 H3009	T3002-S3005 PolarHBondContact O-N 2.75Å; T3002-S3005 VanDerWaalsContact O-N 3.15Å; T3002-S3005 WeakPolarHBondContact OG1-CB 3.37Å; T3002-S3005 PolarHBondContact OG1-N 2.75Å; S3005-D3008 PolarHBondContact O-N 3.24Å; S3005-H3009 PolarHBondContact O-N 3.41Å; S3005-H3009 PolarHBondContact O-ND1 3.46Å
3006	I	43.4	Very low	47.3	Very low	19 Å²	19	84.4 Å²	84.4	10%	0.097	42%	0.416	C	S	.	.	H	α-helix	trans	-71.8	-40.7	176.7	-72.7	163	0	0	0	111.3	L2869 V2999 T3002 K3004 D3008 H3009 V3010	L2869-I3006 HydrophobicContact CB-CD1 3.78Å; L2869-I3006 HydrophobicContact CD1-CD1 4.35Å; L2869-I3006 HydrophobicContact CD2-CD1 4.36Å; L2869-I3006 HydrophobicContact CG-CD1 4.38Å; L2869-I3006 WeakPolarHBondContact O-CD1 2.85Å; V2999-I3006 HydrophobicContact CG1-CD1 4.38Å; V2999-I3006 HydrophobicContact CG1-CG1 3.97Å; T3002-I3006 PolarHBondContact O-N 3.47Å; K3004-I3006 VanDerWaalsContact C-N 3.29Å; K3004-I3006 PolarHBondContact O-N 3.07Å; I3006-D3008 PolarHBondContact O-N 2.74Å; I3006-H3009 CarbonylContact O-C 3.58Å; I3006-H3009 WeakPolarHBondContact O-CA 3.39Å; I3006-H3009 PolarHBondContact O-N 2.92Å; I3006-V3010 WeakPolarHBondContact O-CG2 3.34Å; I3006-V3010 PolarHBondContact O-N 3.23Å; I3006-V3010 VanDerWaalsContact O-N 3.09Å
3007	M	47.4	Very low	47.9	Very low	31 Å²	31	79.4 Å²	79.4	15%	0.153	40%	0.4	C	S	.	.	H	α-helix	trans	-58.8	-31	171.9	-80	-70.4	-72.3	0	0	112.4	E3003 K3004 H3009 V3010 R3015 F3018	E3003-M3007 VanDerWaalsContact O-CB 3.24Å; E3003-M3007 WeakPolarHBondContact O-CB 3.46Å; E3003-M3007 WeakPolarHBondContact O-CG 3.36Å; E3003-M3007 PolarHBondContact O-N 2.82Å; K3004-M3007 WeakPolarHBondContact O-CB 3.34Å; K3004-M3007 PolarHBondContact O-N 3.2Å; K3004-M3007 VanDerWaalsContact O-N 3.15Å; M3007-H3009 PolarHBondContact O-N 3.03Å; M3007-V3010 PolarHBondContact O-N 3.43Å; M3007-V3010 VanDerWaalsContact O-N 3.16Å; M3007-V3010 HydrophobicContact SD-CB 4.45Å; M3007-V3010 HydrophobicContact SD-CG2 4.47Å; M3007-R3015 HydrophobicContact CE-CB 3.81Å; M3007-R3015 HydrophobicContact CE-CG 3.9Å; M3007-R3015 PolarHBondContact O-NE 3.35Å; M3007-R3015 PolarHBondContact O-NH2 2.93Å; M3007-F3018 HydrophobicContact CE-CB 4.06Å; M3007-F3018 HydrophobicContact CE-CD1 3.58Å; M3007-F3018 HydrophobicContact CE-CE1 4.37Å; M3007-F3018 HydrophobicContact CE-CG 4.1Å; M3007-F3018 HydrophobicContact CG-CD1 4.31Å; M3007-F3018 HydrophobicContact CG-CE1 4.28Å; M3007-F3018 HydrophobicContact SD-CB 3.99Å; M3007-F3018 HydrophobicContact SD-CD1 3.41Å; M3007-F3018 WeakPolarHBondContact SD-CD1 3.39Å; M3007-F3018 HydrophobicContact SD-CD2 4.39Å; M3007-F3018 HydrophobicContact SD-CE1 3.91Å; M3007-F3018 HydrophobicContact SD-CG 3.68Å
3008	D	50.1	Low	48.2	Very low	86 Å²	86	76.9 Å²	76.9	46%	0.46	39%	0.389	S	S	.	.	H	α-helix	trans	-69.9	-19.7	174.1	-76.5	-43.8	0	0	0	114.1	K3004 S3005 I3006 R3015	K3004-D3008 PolarHBondContact O-N 2.95Å; S3005-D3008 PolarHBondContact O-N 3.24Å; I3006-D3008 PolarHBondContact O-N 2.74Å; D3008-R3015 VanDerWaalsContact C-NH2 3.34Å; D3008-R3015 VanDerWaalsContact CA-NH2 3.33Å; D3008-R3015 PolarHBondContact O-NH2 3.44Å; D3008-R3015 IonicContact OD1-CZ 2.75Å; D3008-R3015 IonicContact OD1-NH1 2.72Å; D3008-R3015 PolarHBondContact OD1-NH1 2.95Å; D3008-R3015 IonicContact OD1-NH2 2.61Å
3009	H	45.7	Very low	48.8	Very low	137 Å²	137	75.8 Å²	75.8	63%	0.634	39%	0.385	S	S	*	.	H	α-helix	trans	-96.3	-3.8	170.6	-64.4	83.6	0	0	0	113.9	S3005 I3006 M3007	S3005-H3009 PolarHBondContact O-N 3.41Å; S3005-H3009 PolarHBondContact O-ND1 3.46Å; I3006-H3009 CarbonylContact O-C 3.58Å; I3006-H3009 WeakPolarHBondContact O-CA 3.39Å; I3006-H3009 PolarHBondContact O-N 2.92Å; M3007-H3009 PolarHBondContact O-N 3.03Å
3010	V	44.8	Very low	49.5	Very low	32 Å²	32	74.8 Å²	74.8	19%	0.194	38%	0.377	C	S	.	.	S	Bend	trans	-83.5	132.4	173.6	169.9	0	0	0	0	109.3	I3006 M3007 E3014 R3015	I3006-V3010 WeakPolarHBondContact O-CG2 3.34Å; I3006-V3010 PolarHBondContact O-N 3.23Å; I3006-V3010 VanDerWaalsContact O-N 3.09Å; M3007-V3010 PolarHBondContact O-N 3.43Å; M3007-V3010 VanDerWaalsContact O-N 3.16Å; M3007-V3010 HydrophobicContact SD-CB 4.45Å; M3007-V3010 HydrophobicContact SD-CG2 4.47Å; V3010-E3014 HydrophobicContact CG1-CB 3.4Å; V3010-R3015 HydrophobicContact CB-CG 4.18Å; V3010-R3015 HydrophobicContact CG1-CG 3.91Å; V3010-R3015 WeakPolarHBondContact O-CG 3.46Å; V3010-R3015 PolarHBondContact O-NE 3.42Å
3011	P	46.1	Very low	49.9	Very low	71 Å²	71	73.8 Å²	73.8	46%	0.461	36%	0.361	S	S	.	.			trans	-55.6	141.2	177.8	-26.1	34.4	0	0	0	112.4	K3013 E3014 R3015	P3011-K3013 PolarHBondContact O-N 3.43Å; P3011-E3014 WeakPolarHBondContact O-CA 3.28Å; P3011-E3014 PolarHBondContact O-N 3.07Å; P3011-R3015 PolarHBondContact O-N 2.93Å
3012	K	50.3	Low	50.3	Low	173 Å²	173	75.3 Å²	75.3	75%	0.752	37%	0.365	S	S	*	.	H	α-helix	trans	-49.5	-35.6	-177.5	-72.3	-175.1	178	177.9	0	113.7	R3015 K3016	K3012-R3015 PolarHBondContact O-N 3.36Å; K3012-K3016 PolarHBondContact O-N 2.85Å
3013	K	49.3	Very low	51	Low	141 Å²	141	74.6 Å²	74.6	61%	0.613	36%	0.357	S	S	*	.	H	α-helix	trans	-63.1	-44.6	175.4	-64.1	174.4	-179	169.1	0	112.6	P3011	P3011-K3013 PolarHBondContact O-N 3.43Å
3014	E	47	Very low	51.7	Low	97 Å²	97	70.3 Å²	70.3	45%	0.453	34%	0.337	S	S	.	.	H	α-helix	trans	-71.2	-32.1	174.9	-73.4	-179	-148.9	0	0	112.3	V3010 P3011 K3016 I3017 F3018	V3010-E3014 HydrophobicContact CG1-CB 3.4Å; P3011-E3014 WeakPolarHBondContact O-CA 3.28Å; P3011-E3014 PolarHBondContact O-N 3.07Å; E3014-K3016 VanDerWaalsContact C-N 3.3Å; E3014-K3016 PolarHBondContact O-N 3Å; E3014-I3017 WeakPolarHBondContact O-CB 3.42Å; E3014-I3017 PolarHBondContact O-N 2.71Å; E3014-I3017 VanDerWaalsContact O-N 3.13Å; E3014-F3018 PolarHBondContact O-N 2.95Å
3015	R	54.1	Low	52.1	Low	64 Å²	64	64.2 Å²	64.2	24%	0.242	32%	0.315	C	S	.	.	H	α-helix	trans	-58.1	-40.8	175.5	-61.5	-170.8	-159.3	-158	3.8	111.9	M3007 D3008 V3010 P3011 K3012 I3017 F3018 L3019	M3007-R3015 HydrophobicContact CE-CB 3.81Å; M3007-R3015 HydrophobicContact CE-CG 3.9Å; M3007-R3015 PolarHBondContact O-NE 3.35Å; M3007-R3015 PolarHBondContact O-NH2 2.93Å; D3008-R3015 VanDerWaalsContact C-NH2 3.34Å; D3008-R3015 VanDerWaalsContact CA-NH2 3.33Å; D3008-R3015 PolarHBondContact O-NH2 3.44Å; D3008-R3015 IonicContact OD1-CZ 2.75Å; D3008-R3015 IonicContact OD1-NH1 2.72Å; D3008-R3015 PolarHBondContact OD1-NH1 2.95Å; D3008-R3015 IonicContact OD1-NH2 2.61Å; V3010-R3015 HydrophobicContact CB-CG 4.18Å; V3010-R3015 HydrophobicContact CG1-CG 3.91Å; V3010-R3015 WeakPolarHBondContact O-CG 3.46Å; V3010-R3015 PolarHBondContact O-NE 3.42Å; P3011-R3015 PolarHBondContact O-N 2.93Å; K3012-R3015 PolarHBondContact O-N 3.36Å; R3015-I3017 PolarHBondContact O-N 2.88Å; R3015-F3018 PolarHBondContact O-N 2.85Å; R3015-L3019 WeakPolarHBondContact O-CB 3.32Å; R3015-L3019 WeakPolarHBondContact O-CG 3.04Å; R3015-L3019 PolarHBondContact O-N 2.97Å
3016	K	54.5	Low	52.7	Low	75 Å²	75	68.8 Å²	68.8	33%	0.326	33%	0.327	S	S	.	.	H	α-helix	trans	-58.1	-46.9	173.9	-76.8	-158.3	177.2	-159.8	0	112.2	K3012 E3014 F3018 L3019 Y3020 G3154	K3012-K3016 PolarHBondContact O-N 2.85Å; E3014-K3016 VanDerWaalsContact C-N 3.3Å; E3014-K3016 PolarHBondContact O-N 3Å; K3016-F3018 VanDerWaalsContact C-N 3.3Å; K3016-F3018 PolarHBondContact O-N 2.97Å; K3016-L3019 PolarHBondContact O-N 2.65Å; K3016-Y3020 HydrophobicContact CB-CE2 4.41Å; K3016-Y3020 WeakPolarHBondContact O-CD2 3.47Å; K3016-Y3020 PolarHBondContact O-N 3.14Å; K3016-G3154 WeakPolarHBondContact CE-O 3.41Å; K3016-G3154 PolarHBondContact NZ-O 2.92Å
3017	I	53.9	Low	53.5	Low	63 Å²	63	69.5 Å²	69.5	32%	0.323	33%	0.331	S	S	.	.	H	α-helix	trans	-59.5	-43.6	177.8	-63.8	171.2	0	0	0	110.4	E3014 R3015 Y3021 L3041 L3044	E3014-I3017 WeakPolarHBondContact O-CB 3.42Å; E3014-I3017 PolarHBondContact O-N 2.71Å; E3014-I3017 VanDerWaalsContact O-N 3.13Å; R3015-I3017 PolarHBondContact O-N 2.88Å; I3017-Y3021 WeakPolarHBondContact O-CB 3.49Å; I3017-Y3021 PolarHBondContact O-N 2.98Å; I3017-L3041 HydrophobicContact CD1-CD2 3.95Å; I3017-L3041 HydrophobicContact CG1-CD2 4.09Å; I3017-L3041 HydrophobicContact CG2-CD2 3.79Å; I3017-L3044 HydrophobicContact CG1-CD1 3.89Å
3018	F	51.2	Low	54.3	Low	49 Å²	49	78.3 Å²	78.3	22%	0.215	37%	0.368	C	S	.	.	H	α-helix	trans	-66.9	-40	177.5	-170.7	-91.5	0	0	0	112.7	F2961 E3003 M3007 E3014 R3015 K3016 Y3021 N3022	F2961-F3018 HydrophobicContact CE1-CE2 4Å; F2961-F3018 HydrophobicContact CE1-CZ 4.39Å; F2961-F3018 HydrophobicContact CZ-CE2 4.41Å; E3003-F3018 HydrophobicContact CG-CE1 4.38Å; E3003-F3018 HydrophobicContact CG-CZ 4.31Å; E3003-F3018 VanDerWaalsContact OE1-CE1 3.3Å; E3003-F3018 WeakPolarHBondContact OE1-CE1 3.47Å; E3003-F3018 WeakPolarHBondContact OE1-CZ 3.28Å; M3007-F3018 HydrophobicContact CE-CB 4.06Å; M3007-F3018 HydrophobicContact CE-CD1 3.58Å; M3007-F3018 HydrophobicContact CE-CE1 4.37Å; M3007-F3018 HydrophobicContact CE-CG 4.1Å; M3007-F3018 HydrophobicContact CG-CD1 4.31Å; M3007-F3018 HydrophobicContact CG-CE1 4.28Å; M3007-F3018 HydrophobicContact SD-CB 3.99Å; M3007-F3018 HydrophobicContact SD-CD1 3.41Å; M3007-F3018 WeakPolarHBondContact SD-CD1 3.39Å; M3007-F3018 HydrophobicContact SD-CD2 4.39Å; M3007-F3018 HydrophobicContact SD-CE1 3.91Å; M3007-F3018 HydrophobicContact SD-CG 3.68Å; E3014-F3018 PolarHBondContact O-N 2.95Å; R3015-F3018 PolarHBondContact O-N 2.85Å; K3016-F3018 VanDerWaalsContact C-N 3.3Å; K3016-F3018 PolarHBondContact O-N 2.97Å; F3018-Y3021 PolarHBondContact O-N 3.31Å; F3018-N3022 VanDerWaalsContact O-CB 3.27Å; F3018-N3022 WeakPolarHBondContact O-CB 3.45Å; F3018-N3022 PolarHBondContact O-N 2.86Å
3019	L	58.1	Low	55.2	Low	54 Å²	54	79.7 Å²	79.7	28%	0.283	37%	0.37	S	S	.	.	H	α-helix	trans	-61.4	-50.1	175	-82.4	161.5	0	0	0	111.7	R3015 K3016 Y3021 N3022 Q3023 E3155	R3015-L3019 WeakPolarHBondContact O-CB 3.32Å; R3015-L3019 WeakPolarHBondContact O-CG 3.04Å; R3015-L3019 PolarHBondContact O-N 2.97Å; K3016-L3019 PolarHBondContact O-N 2.65Å; L3019-Y3021 VanDerWaalsContact C-N 3.34Å; L3019-Y3021 PolarHBondContact O-N 2.94Å; L3019-N3022 PolarHBondContact O-N 2.83Å; L3019-N3022 VanDerWaalsContact O-N 3.16Å; L3019-Q3023 WeakPolarHBondContact O-CG 3.48Å; L3019-Q3023 PolarHBondContact O-N 3.15Å; L3019-E3155 HydrophobicContact CD1-CG 4.38Å
3020	Y	59.6	Low	56	Low	17 Å²	17	77.2 Å²	77.2	7%	0.067	36%	0.359	C	S	.	.	H	α-helix	trans	-59.2	-44.2	174.4	-72.8	-55.3	0	0	0	111.6	K3016 N3022 Q3023 L3024 I3040 T3152	K3016-Y3020 HydrophobicContact CB-CE2 4.41Å; K3016-Y3020 WeakPolarHBondContact O-CD2 3.47Å; K3016-Y3020 PolarHBondContact O-N 3.14Å; Y3020-N3022 VanDerWaalsContact C-N 3.34Å; Y3020-N3022 PolarHBondContact O-N 3.4Å; Y3020-Q3023 PolarHBondContact O-N 3.21Å; Y3020-L3024 WeakPolarHBondContact O-CB 3.31Å; Y3020-L3024 VanDerWaalsContact O-CG 3.29Å; Y3020-L3024 WeakPolarHBondContact O-CG 3.02Å; Y3020-L3024 PolarHBondContact O-N 2.95Å; Y3020-I3040 HydrophobicContact CD1-CD1 4.06Å; Y3020-I3040 HydrophobicContact CD2-CG2 3.7Å; Y3020-I3040 HydrophobicContact CE2-CG2 4.1Å; Y3020-I3040 HydrophobicContact CG-CD1 4.1Å; Y3020-I3040 HydrophobicContact CG-CG2 4.16Å; Y3020-T3152 HydrophobicContact CE1-CG2 4.18Å; Y3020-T3152 WeakPolarHBondContact CE1-OG1 3.32Å; Y3020-T3152 PolarHBondContact OH-OG1 3.23Å
3021	Y	57.8	Low	57	Low	39 Å²	39	78 Å²	78	15%	0.153	37%	0.373	C	S	.	.	H	α-helix	trans	-62.2	-38.4	175.2	-179.4	-104.5	0	0	0	112.8	I3017 F3018 L3019 Q3023 S3025 L3037	I3017-Y3021 WeakPolarHBondContact O-CB 3.49Å; I3017-Y3021 PolarHBondContact O-N 2.98Å; F3018-Y3021 PolarHBondContact O-N 3.31Å; L3019-Y3021 VanDerWaalsContact C-N 3.34Å; L3019-Y3021 PolarHBondContact O-N 2.94Å; Y3021-Q3023 VanDerWaalsContact C-N 3.33Å; Y3021-S3025 WeakPolarHBondContact O-CB 3.33Å; Y3021-S3025 PolarHBondContact O-N 3.02Å; Y3021-S3025 PolarHBondContact O-OG 2.71Å; Y3021-L3037 HydrophobicContact CD2-CD1 4.3Å; Y3021-L3037 HydrophobicContact CD2-CD2 3.83Å; Y3021-L3037 HydrophobicContact CE2-CD2 4.35Å
3022	N	55.8	Low	58.2	Low	48 Å²	48	74.8 Å²	74.8	26%	0.257	35%	0.352	S	S	.	.	H	α-helix	trans	-71.3	-26.8	177.1	-159.8	-34.3	0	0	0	111.9	E3003 F3018 L3019 Y3020 K3026	E3003-N3022 PolarHBondContact OE1-ND2 2.86Å; F3018-N3022 VanDerWaalsContact O-CB 3.27Å; F3018-N3022 WeakPolarHBondContact O-CB 3.45Å; F3018-N3022 PolarHBondContact O-N 2.86Å; L3019-N3022 PolarHBondContact O-N 2.83Å; L3019-N3022 VanDerWaalsContact O-N 3.16Å; Y3020-N3022 VanDerWaalsContact C-N 3.34Å; Y3020-N3022 PolarHBondContact O-N 3.4Å; N3022-K3026 VanDerWaalsContact O-CD 3.26Å; N3022-K3026 WeakPolarHBondContact O-CD 3.48Å; N3022-K3026 WeakPolarHBondContact O-CE 3.31Å; N3022-K3026 WeakPolarHBondContact O-CG 3.31Å; N3022-K3026 PolarHBondContact O-NZ 2.96Å; N3022-K3026 WeakPolarHBondContact OD1-CE 3.44Å; N3022-K3026 PolarHBondContact OD1-NZ 3.09Å
3023	Q	60.9	Low	59.1	Low	58 Å²	58	66.9 Å²	66.9	27%	0.271	32%	0.319	S	S	.	.	H	α-helix	trans	-74.9	-55	169.2	-68.1	171.5	10.2	0	0	111.2	L3019 Y3020 Y3021 S3025 K3026 E3155	L3019-Q3023 WeakPolarHBondContact O-CG 3.48Å; L3019-Q3023 PolarHBondContact O-N 3.15Å; Y3020-Q3023 PolarHBondContact O-N 3.21Å; Y3021-Q3023 VanDerWaalsContact C-N 3.33Å; Q3023-S3025 PolarHBondContact O-N 3.31Å; Q3023-K3026 WeakPolarHBondContact O-CB 3.19Å; Q3023-K3026 PolarHBondContact O-N 3.01Å; Q3023-E3155 PolarHBondContact NE2-O 3.44Å
3024	L	61.1	Low	59.9	Low	3 Å²	3	64.6 Å²	64.6	2%	0.016	31%	0.312	C	S	.	.	H	α-helix	trans	-63.7	-39.7	-176.4	-67.8	176.8	0	0	0	113.3	Y3020 K3026 M3027 A3033 L3036 L3037 I3040 L3157	Y3020-L3024 WeakPolarHBondContact O-CB 3.31Å; Y3020-L3024 VanDerWaalsContact O-CG 3.29Å; Y3020-L3024 WeakPolarHBondContact O-CG 3.02Å; Y3020-L3024 PolarHBondContact O-N 2.95Å; L3024-K3026 PolarHBondContact O-N 2.85Å; L3024-M3027 HydrophobicContact CD2-CE 3.53Å; L3024-M3027 HydrophobicContact CD2-SD 3.84Å; L3024-M3027 VanDerWaalsContact O-CB 3.29Å; L3024-M3027 WeakPolarHBondContact O-CB 3.36Å; L3024-M3027 VanDerWaalsContact O-CG 3.3Å; L3024-M3027 WeakPolarHBondContact O-CG 3.08Å; L3024-M3027 PolarHBondContact O-N 2.79Å; L3024-A3033 HydrophobicContact CB-CB 4.23Å; L3024-A3033 WeakPolarHBondContact O-CB 3.47Å; L3024-L3036 HydrophobicContact CD1-CB 3.97Å; L3024-L3036 HydrophobicContact CD2-CB 3.75Å; L3024-L3036 HydrophobicContact CD2-CD1 3.74Å; L3024-L3036 HydrophobicContact CD2-CG 4.38Å; L3024-L3037 HydrophobicContact CD1-CB 3.88Å; L3024-L3037 HydrophobicContact CD1-CD1 4.16Å; L3024-I3040 HydrophobicContact CD1-CD1 4.2Å; L3024-L3157 HydrophobicContact CD2-CD2 3.78Å
3025	S	56.3	Low	61	Low	35 Å²	35	60.9 Å²	60.9	25%	0.245	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-11.7	-179.8	57.7	0	0	0	0	114.5	Y3021 Q3023 Q3030	Y3021-S3025 WeakPolarHBondContact O-CB 3.33Å; Y3021-S3025 PolarHBondContact O-N 3.02Å; Y3021-S3025 PolarHBondContact O-OG 2.71Å; Q3023-S3025 PolarHBondContact O-N 3.31Å; S3025-Q3030 PolarHBondContact O-NE2 2.87Å
3026	K	59.5	Low	61.9	Low	152 Å²	152	58 Å²	58	66%	0.661	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-8.9	172.9	-65.7	166.6	-175.5	136.2	0	113.4	N3022 Q3023 L3024	N3022-K3026 VanDerWaalsContact O-CD 3.26Å; N3022-K3026 WeakPolarHBondContact O-CD 3.48Å; N3022-K3026 WeakPolarHBondContact O-CE 3.31Å; N3022-K3026 WeakPolarHBondContact O-CG 3.31Å; N3022-K3026 PolarHBondContact O-NZ 2.96Å; N3022-K3026 WeakPolarHBondContact OD1-CE 3.44Å; N3022-K3026 PolarHBondContact OD1-NZ 3.09Å; Q3023-K3026 WeakPolarHBondContact O-CB 3.19Å; Q3023-K3026 PolarHBondContact O-N 3.01Å; L3024-K3026 PolarHBondContact O-N 2.85Å
3027	M	60.8	Low	62.7	Low	35 Å²	35	55.4 Å²	55.4	17%	0.172	28%	0.275	C	S	.	.			trans	-70.9	139.4	178.7	-65	178.5	170.3	0	0	112.2	L3024 K3029 Q3030 A3033 L3036 Y3150 L3157	L3024-M3027 HydrophobicContact CD2-CE 3.53Å; L3024-M3027 HydrophobicContact CD2-SD 3.84Å; L3024-M3027 VanDerWaalsContact O-CB 3.29Å; L3024-M3027 WeakPolarHBondContact O-CB 3.36Å; L3024-M3027 VanDerWaalsContact O-CG 3.3Å; L3024-M3027 WeakPolarHBondContact O-CG 3.08Å; L3024-M3027 PolarHBondContact O-N 2.79Å; M3027-K3029 VanDerWaalsContact C-N 3.32Å; M3027-K3029 PolarHBondContact O-N 3.41Å; M3027-Q3030 PolarHBondContact O-NE2 2.95Å; M3027-A3033 HydrophobicContact CB-CB 4.25Å; M3027-A3033 HydrophobicContact SD-CB 4.11Å; M3027-L3036 HydrophobicContact CE-CD1 3.95Å; M3027-L3036 HydrophobicContact SD-CD1 3.88Å; M3027-Y3150 HydrophobicContact CE-CD1 4.26Å; M3027-Y3150 HydrophobicContact CE-CE1 3.43Å; M3027-Y3150 VanDerWaalsContact CE-CE1 3.43Å; M3027-L3157 HydrophobicContact CE-CD2 4.24Å
3028	K	62.8	Low	63.5	Low	215 Å²	215	57.3 Å²	57.3	94%	0.935	28%	0.282	S	S	*	.	S	Bend	trans	-61.1	-38.2	175.8	-69.3	-169.8	179.6	-174.1	0	112.8	Q3030	K3028-Q3030 PolarHBondContact O-N 2.84Å
3029	K	69.1	Low	64.3	Low	115 Å²	115	55.1 Å²	55.1	50%	0.5	27%	0.272	S	S	.	.			trans	-92.5	89.9	-176.4	-70.7	171.7	176.2	171.8	0	109.9	M3027 G3031 E3032 A3033	M3027-K3029 VanDerWaalsContact C-N 3.32Å; M3027-K3029 PolarHBondContact O-N 3.41Å; K3029-G3031 VanDerWaalsContact C-N 3.32Å; K3029-G3031 PolarHBondContact O-N 2.86Å; K3029-E3032 HydrophobicContact CB-CB 3.94Å; K3029-E3032 VanDerWaalsContact CB-OE2 3.31Å; K3029-E3032 WeakPolarHBondContact CB-OE2 3.28Å; K3029-E3032 WeakPolarHBondContact CD-OE2 3.34Å; K3029-E3032 WeakPolarHBondContact O-CB 3.18Å; K3029-E3032 PolarHBondContact O-N 3.39Å; K3029-E3032 VanDerWaalsContact O-N 3.15Å; K3029-A3033 PolarHBondContact O-N 3.07Å; K3029-A3033 VanDerWaalsContact O-N 3.13Å
3030	Q	62.7	Low	64.9	Low	86 Å²	86	52.8 Å²	52.8	40%	0.402	26%	0.26	S	S	.	.	H	α-helix	trans	-62.8	-32.3	-173.8	-68.2	-72.4	-68.5	0	0	114	S3025 M3027 K3028 A3033 M3034	S3025-Q3030 PolarHBondContact O-NE2 2.87Å; M3027-Q3030 PolarHBondContact O-NE2 2.95Å; K3028-Q3030 PolarHBondContact O-N 2.84Å; Q3030-A3033 PolarHBondContact O-N 3.47Å; Q3030-M3034 PolarHBondContact O-N 2.99Å
3031	G	66.3	Low	65.1	Low	47 Å²	47	54.5 Å²	54.5	49%	0.485	27%	0.27	S	S	.	.	H	α-helix	trans	-66.2	-35.1	174.8	0	0	0	0	0	113.6	K3029 M3034 T3035	K3029-G3031 VanDerWaalsContact C-N 3.32Å; K3029-G3031 PolarHBondContact O-N 2.86Å; G3031-M3034 PolarHBondContact O-N 3.19Å; G3031-T3035 PolarHBondContact O-N 3.49Å; G3031-T3035 VanDerWaalsContact O-N 3.1Å; G3031-T3035 PolarHBondContact O-OG1 2.96Å; G3031-T3035 VanDerWaalsContact O-OG1 3.08Å
3032	E	71.6	Confident	65.6	Low	5 Å²	5	58.6 Å²	58.6	2%	0.023	29%	0.286	C	S	.	.	H	α-helix	trans	-67.7	-44.4	172.9	171.3	175	-168.2	0	0	110.5	K3029 M3034 T3035 L3036 Y3145 R3148 Y3150	K3029-E3032 HydrophobicContact CB-CB 3.94Å; K3029-E3032 VanDerWaalsContact CB-OE2 3.31Å; K3029-E3032 WeakPolarHBondContact CB-OE2 3.28Å; K3029-E3032 WeakPolarHBondContact CD-OE2 3.34Å; K3029-E3032 WeakPolarHBondContact O-CB 3.18Å; K3029-E3032 PolarHBondContact O-N 3.39Å; K3029-E3032 VanDerWaalsContact O-N 3.15Å; E3032-M3034 VanDerWaalsContact C-N 3.32Å; E3032-M3034 PolarHBondContact O-N 3.02Å; E3032-T3035 PolarHBondContact O-N 3.24Å; E3032-L3036 HydrophobicContact CG-CD1 4.11Å; E3032-L3036 VanDerWaalsContact O-CG 3.27Å; E3032-L3036 WeakPolarHBondContact O-CG 3.49Å; E3032-L3036 PolarHBondContact O-N 2.89Å; E3032-Y3145 HydrophobicContact CB-CD1 4.11Å; E3032-Y3145 HydrophobicContact CB-CE1 3.58Å; E3032-Y3145 HydrophobicContact CG-CD1 3.55Å; E3032-Y3145 HydrophobicContact CG-CE1 3.58Å; E3032-Y3145 HydrophobicContact CG-CG 4.12Å; E3032-R3148 WeakPolarHBondContact OE1-CD 3.47Å; E3032-R3148 IonicContact OE1-CZ 3.72Å; E3032-R3148 IonicContact OE1-NE 3.12Å; E3032-R3148 IonicContact OE1-NH1 2.85Å; E3032-R3148 PolarHBondContact OE1-NH1 3.4Å; E3032-R3148 IonicContact OE2-CZ 2.58Å; E3032-R3148 IonicContact OE2-NH1 3.2Å; E3032-R3148 PolarHBondContact OE2-NH1 3.5Å; E3032-Y3150 PolarHBondContact OE1-OH 3.31Å
3033	A	69.6	Low	66.1	Low	7 Å²	7	56.9 Å²	56.9	6%	0.058	28%	0.277	C	S	.	.	H	α-helix	trans	-60.1	-38.1	174.4	0	0	0	0	0	113.2	L3024 M3027 K3029 Q3030 L3037	L3024-A3033 HydrophobicContact CB-CB 4.23Å; L3024-A3033 WeakPolarHBondContact O-CB 3.47Å; M3027-A3033 HydrophobicContact CB-CB 4.25Å; M3027-A3033 HydrophobicContact SD-CB 4.11Å; K3029-A3033 PolarHBondContact O-N 3.07Å; K3029-A3033 VanDerWaalsContact O-N 3.13Å; Q3030-A3033 PolarHBondContact O-N 3.47Å; A3033-L3037 WeakPolarHBondContact O-CB 3.47Å; A3033-L3037 PolarHBondContact O-N 3.25Å
3034	M	66	Low	66.2	Low	93 Å²	93	56.1 Å²	56.1	46%	0.458	28%	0.275	S	S	.	.	H	α-helix	trans	-66.8	-47.2	175	-79.5	-59.7	-55.3	0	0	112.2	Q3030 G3031 E3032 L3036 L3037 E3038	Q3030-M3034 PolarHBondContact O-N 2.99Å; G3031-M3034 PolarHBondContact O-N 3.19Å; E3032-M3034 VanDerWaalsContact C-N 3.32Å; E3032-M3034 PolarHBondContact O-N 3.02Å; M3034-L3036 VanDerWaalsContact C-N 3.31Å; M3034-L3036 PolarHBondContact O-N 3.11Å; M3034-L3037 WeakPolarHBondContact O-CB 3.26Å; M3034-L3037 PolarHBondContact O-N 2.68Å; M3034-L3037 VanDerWaalsContact O-N 3.15Å; M3034-L3037 HydrophobicContact SD-CD2 4.41Å; M3034-E3038 WeakPolarHBondContact O-CG 3.44Å; M3034-E3038 PolarHBondContact O-N 3.02Å
3035	T	70.5	Confident	66.1	Low	19 Å²	19	63.2 Å²	63.2	12%	0.117	31%	0.306	C	S	.	.	H	α-helix	trans	-61.1	-40	176.9	-52.8	0	0	0	0	111.7	G3031 E3032 E3038 I3039 A3071 Y3145 I3188	G3031-T3035 PolarHBondContact O-N 3.49Å; G3031-T3035 VanDerWaalsContact O-N 3.1Å; G3031-T3035 PolarHBondContact O-OG1 2.96Å; G3031-T3035 VanDerWaalsContact O-OG1 3.08Å; E3032-T3035 PolarHBondContact O-N 3.24Å; T3035-E3038 PolarHBondContact O-N 2.85Å; T3035-I3039 HydrophobicContact CG2-CD1 4.33Å; T3035-I3039 WeakPolarHBondContact O-CG1 3.23Å; T3035-I3039 PolarHBondContact O-N 2.82Å; T3035-A3071 HydrophobicContact CG2-CB 4.39Å; T3035-Y3145 HydrophobicContact CG2-CD2 4.11Å; T3035-Y3145 HydrophobicContact CG2-CE2 3.98Å; T3035-I3188 HydrophobicContact CG2-CD1 3.75Å
3036	L	72.6	Confident	66.1	Low	2 Å²	2	68.6 Å²	68.6	1%	0.01	32%	0.321	C	S	.	.	H	α-helix	trans	-63.2	-41.4	174.6	-69.8	166.7	0	0	0	112.2	L3024 M3027 E3032 M3034 I3039 I3040 I3143 Y3150	L3024-L3036 HydrophobicContact CD1-CB 3.97Å; L3024-L3036 HydrophobicContact CD2-CB 3.75Å; L3024-L3036 HydrophobicContact CD2-CD1 3.74Å; L3024-L3036 HydrophobicContact CD2-CG 4.38Å; M3027-L3036 HydrophobicContact CE-CD1 3.95Å; M3027-L3036 HydrophobicContact SD-CD1 3.88Å; E3032-L3036 HydrophobicContact CG-CD1 4.11Å; E3032-L3036 VanDerWaalsContact O-CG 3.27Å; E3032-L3036 WeakPolarHBondContact O-CG 3.49Å; E3032-L3036 PolarHBondContact O-N 2.89Å; M3034-L3036 VanDerWaalsContact C-N 3.31Å; M3034-L3036 PolarHBondContact O-N 3.11Å; L3036-I3039 PolarHBondContact O-N 3.41Å; L3036-I3040 WeakPolarHBondContact O-CG1 3.48Å; L3036-I3040 PolarHBondContact O-N 3.04Å; L3036-I3143 HydrophobicContact CD2-CB 4.18Å; L3036-I3143 HydrophobicContact CD2-CD1 3.86Å; L3036-I3143 HydrophobicContact CD2-CG2 3.84Å; L3036-Y3150 HydrophobicContact CD1-CD1 4.12Å; L3036-Y3150 HydrophobicContact CD1-CD2 4.14Å; L3036-Y3150 HydrophobicContact CD1-CE1 3.82Å; L3036-Y3150 HydrophobicContact CD1-CE2 3.82Å; L3036-Y3150 HydrophobicContact CD1-CG 4.28Å; L3036-Y3150 HydrophobicContact CD2-CD1 4.45Å; L3036-Y3150 HydrophobicContact CD2-CD2 3.69Å; L3036-Y3150 HydrophobicContact CD2-CE2 4.12Å; L3036-Y3150 HydrophobicContact CD2-CG 3.88Å
3037	L	70.6	Confident	65.6	Low	22 Å²	22	66.2 Å²	66.2	12%	0.115	31%	0.312	C	S	.	.	H	α-helix	trans	-65.2	-40.8	176.7	-173.7	71.2	0	0	0	111.7	Y3021 L3024 A3033 M3034 I3040 L3041	Y3021-L3037 HydrophobicContact CD2-CD1 4.3Å; Y3021-L3037 HydrophobicContact CD2-CD2 3.83Å; Y3021-L3037 HydrophobicContact CE2-CD2 4.35Å; L3024-L3037 HydrophobicContact CD1-CB 3.88Å; L3024-L3037 HydrophobicContact CD1-CD1 4.16Å; A3033-L3037 WeakPolarHBondContact O-CB 3.47Å; A3033-L3037 PolarHBondContact O-N 3.25Å; M3034-L3037 WeakPolarHBondContact O-CB 3.26Å; M3034-L3037 PolarHBondContact O-N 2.68Å; M3034-L3037 VanDerWaalsContact O-N 3.15Å; M3034-L3037 HydrophobicContact SD-CD2 4.41Å; L3037-I3040 PolarHBondContact O-N 2.91Å; L3037-L3041 HydrophobicContact CD1-CD1 4.43Å; L3037-L3041 HydrophobicContact CD2-CD1 4.45Å; L3037-L3041 HydrophobicContact CG-CD1 3.94Å; L3037-L3041 HydrophobicContact CG-CG 4.42Å; L3037-L3041 VanDerWaalsContact O-CB 3.3Å; L3037-L3041 WeakPolarHBondContact O-CB 3.5Å; L3037-L3041 VanDerWaalsContact O-CG 3.26Å; L3037-L3041 WeakPolarHBondContact O-CG 3.06Å; L3037-L3041 PolarHBondContact O-N 3.23Å
3038	E	70	Confident	64.8	Low	103 Å²	103	71.1 Å²	71.1	48%	0.481	33%	0.334	S	S	.	.	H	α-helix	trans	-62.7	-42.4	176.4	-74.3	171.8	172.5	0	0	111.9	M3034 T3035 L3041 Y3042	M3034-E3038 WeakPolarHBondContact O-CG 3.44Å; M3034-E3038 PolarHBondContact O-N 3.02Å; T3035-E3038 PolarHBondContact O-N 2.85Å; E3038-L3041 PolarHBondContact O-N 2.84Å; E3038-Y3042 VanDerWaalsContact O-CB 3.27Å; E3038-Y3042 WeakPolarHBondContact O-CB 3.45Å; E3038-Y3042 PolarHBondContact O-N 2.89Å
3039	I	69.7	Low	63.6	Low	2 Å²	2	64.5 Å²	64.5	1%	0.01	33%	0.327	C	S	.	.	H	α-helix	trans	-62.8	-49.3	174.8	-65.1	168	0	0	0	110.8	T3035 L3036 L3041 Y3042 V3043 A3071 F3073 I3143 I3188	T3035-I3039 HydrophobicContact CG2-CD1 4.33Å; T3035-I3039 WeakPolarHBondContact O-CG1 3.23Å; T3035-I3039 PolarHBondContact O-N 2.82Å; L3036-I3039 PolarHBondContact O-N 3.41Å; I3039-L3041 VanDerWaalsContact C-N 3.34Å; I3039-L3041 PolarHBondContact O-N 3.06Å; I3039-Y3042 WeakPolarHBondContact O-CB 3.36Å; I3039-Y3042 PolarHBondContact O-N 2.66Å; I3039-Y3042 VanDerWaalsContact O-N 3.15Å; I3039-V3043 HydrophobicContact CG2-CG2 4.42Å; I3039-V3043 WeakPolarHBondContact O-CG2 3.38Å; I3039-V3043 PolarHBondContact O-N 2.89Å; I3039-A3071 HydrophobicContact CD1-CB 3.9Å; I3039-F3073 HydrophobicContact CD1-CD1 4.07Å; I3039-F3073 HydrophobicContact CG1-CD1 4.06Å; I3039-F3073 HydrophobicContact CG1-CE1 4.31Å; I3039-F3073 HydrophobicContact CG2-CB 3.97Å; I3039-F3073 HydrophobicContact CG2-CD1 3.68Å; I3039-F3073 HydrophobicContact CG2-CD2 4.1Å; I3039-F3073 HydrophobicContact CG2-CE1 4.1Å; I3039-F3073 HydrophobicContact CG2-CE2 4.49Å; I3039-F3073 HydrophobicContact CG2-CG 3.67Å; I3039-F3073 HydrophobicContact CG2-CZ 4.48Å; I3039-I3143 HydrophobicContact CB-CD1 4.12Å; I3039-I3143 HydrophobicContact CD1-CD1 4.44Å; I3039-I3143 HydrophobicContact CD1-CG2 3.6Å; I3039-I3143 HydrophobicContact CG2-CD1 3.69Å; I3039-I3143 HydrophobicContact CG2-CG1 4.05Å; I3039-I3188 HydrophobicContact CD1-CD1 3.9Å; I3039-I3188 HydrophobicContact CG1-CD1 3.45Å; I3039-I3188 VanDerWaalsContact CG1-CD1 3.45Å; I3039-I3188 HydrophobicContact CG1-CG1 4.28Å
3040	I	68.7	Low	62.1	Low	6 Å²	6	67.4 Å²	67.4	3%	0.031	34%	0.339	C	S	.	.	H	α-helix	trans	-61.1	-43.7	179.7	-69.5	169.6	0	0	0	110.9	Y3020 L3024 L3036 L3037 Y3042 V3043 L3044 L3141 I3143	Y3020-I3040 HydrophobicContact CD1-CD1 4.06Å; Y3020-I3040 HydrophobicContact CD2-CG2 3.7Å; Y3020-I3040 HydrophobicContact CE2-CG2 4.1Å; Y3020-I3040 HydrophobicContact CG-CD1 4.1Å; Y3020-I3040 HydrophobicContact CG-CG2 4.16Å; L3024-I3040 HydrophobicContact CD1-CD1 4.2Å; L3036-I3040 WeakPolarHBondContact O-CG1 3.48Å; L3036-I3040 PolarHBondContact O-N 3.04Å; L3037-I3040 PolarHBondContact O-N 2.91Å; I3040-Y3042 VanDerWaalsContact C-N 3.33Å; I3040-Y3042 PolarHBondContact O-N 3.13Å; I3040-V3043 PolarHBondContact O-N 2.86Å; I3040-L3044 HydrophobicContact CG2-CD1 3.73Å; I3040-L3044 HydrophobicContact CG2-CG 4.34Å; I3040-L3044 WeakPolarHBondContact O-CB 3.01Å; I3040-L3044 VanDerWaalsContact O-CG 3.26Å; I3040-L3044 WeakPolarHBondContact O-CG 3.38Å; I3040-L3044 PolarHBondContact O-N 3.48Å; I3040-L3141 HydrophobicContact CG1-CD2 4.05Å; I3040-I3143 HydrophobicContact CG1-CD1 4.37Å
3041	L	65.4	Low	61	Low	52 Å²	52	73.2 Å²	73.2	27%	0.272	36%	0.363	S	S	.	.	H	α-helix	trans	-67.8	-29.8	176.3	-74.1	173.6	0	0	0	113.4	I3017 L3037 E3038 I3039 K3045	I3017-L3041 HydrophobicContact CD1-CD2 3.95Å; I3017-L3041 HydrophobicContact CG1-CD2 4.09Å; I3017-L3041 HydrophobicContact CG2-CD2 3.79Å; L3037-L3041 HydrophobicContact CD1-CD1 4.43Å; L3037-L3041 HydrophobicContact CD2-CD1 4.45Å; L3037-L3041 HydrophobicContact CG-CD1 3.94Å; L3037-L3041 HydrophobicContact CG-CG 4.42Å; L3037-L3041 VanDerWaalsContact O-CB 3.3Å; L3037-L3041 WeakPolarHBondContact O-CB 3.5Å; L3037-L3041 VanDerWaalsContact O-CG 3.26Å; L3037-L3041 WeakPolarHBondContact O-CG 3.06Å; L3037-L3041 PolarHBondContact O-N 3.23Å; E3038-L3041 PolarHBondContact O-N 2.84Å; I3039-L3041 VanDerWaalsContact C-N 3.34Å; I3039-L3041 PolarHBondContact O-N 3.06Å; L3041-K3045 WeakPolarHBondContact O-CB 3.29Å; L3041-K3045 WeakPolarHBondContact O-CD 3.46Å; L3041-K3045 VanDerWaalsContact O-CG 3.23Å; L3041-K3045 WeakPolarHBondContact O-CG 3.39Å; L3041-K3045 PolarHBondContact O-N 3.25Å
3042	Y	68.7	Low	59.8	Low	126 Å²	126	75 Å²	75	49%	0.494	36%	0.361	S	S	.	.	H	α-helix	trans	-69.8	-48.9	173.9	175.3	-93.8	0	0	0	111.2	E3038 I3039 I3040 K3045 R3046 F3073	E3038-Y3042 VanDerWaalsContact O-CB 3.27Å; E3038-Y3042 WeakPolarHBondContact O-CB 3.45Å; E3038-Y3042 PolarHBondContact O-N 2.89Å; I3039-Y3042 WeakPolarHBondContact O-CB 3.36Å; I3039-Y3042 PolarHBondContact O-N 2.66Å; I3039-Y3042 VanDerWaalsContact O-N 3.15Å; I3040-Y3042 VanDerWaalsContact C-N 3.33Å; I3040-Y3042 PolarHBondContact O-N 3.13Å; Y3042-K3045 PolarHBondContact O-N 2.91Å; Y3042-R3046 PolarHBondContact O-N 2.91Å; Y3042-F3073 HydrophobicContact CD1-CE2 4.48Å; Y3042-F3073 AromaticContact CD1-CZ 3.95Å; Y3042-F3073 HydrophobicContact CD1-CZ 3.95Å; Y3042-F3073 HydrophobicContact CE1-CZ 4.05Å
3043	V	65.4	Low	58.8	Low	11 Å²	11	82.8 Å²	82.8	7%	0.067	40%	0.403	C	S	.	.	H	α-helix	trans	-67.6	-46	-178.1	-179.3	0	0	0	0	111.3	I3039 I3040 K3045 R3046 E3047 F3073 M3075 L3141	I3039-V3043 HydrophobicContact CG2-CG2 4.42Å; I3039-V3043 WeakPolarHBondContact O-CG2 3.38Å; I3039-V3043 PolarHBondContact O-N 2.89Å; I3040-V3043 PolarHBondContact O-N 2.86Å; V3043-K3045 PolarHBondContact O-N 3.24Å; V3043-K3045 VanDerWaalsContact O-N 3.12Å; V3043-R3046 WeakPolarHBondContact O-CB 3.48Å; V3043-R3046 PolarHBondContact O-N 3.5Å; V3043-E3047 PolarHBondContact O-N 3.28Å; V3043-F3073 HydrophobicContact CG2-CD2 4.16Å; V3043-F3073 HydrophobicContact CG2-CE2 3.77Å; V3043-F3073 HydrophobicContact CG2-CZ 4.48Å; V3043-M3075 HydrophobicContact CG1-CB 4.27Å; V3043-M3075 HydrophobicContact CG1-CE 3.75Å; V3043-M3075 HydrophobicContact CG1-CG 4.07Å; V3043-M3075 HydrophobicContact CG1-SD 4.32Å; V3043-L3141 HydrophobicContact CG2-CD1 4.26Å
3044	L	62.2	Low	58.5	Low	43 Å²	43	85.5 Å²	85.5	23%	0.225	42%	0.416	C	S	.	.	H	α-helix	trans	-59.1	-25.6	175.3	-72.2	173.2	0	0	0	113.3	I3017 I3040 H3048	I3017-L3044 HydrophobicContact CG1-CD1 3.89Å; I3040-L3044 HydrophobicContact CG2-CD1 3.73Å; I3040-L3044 HydrophobicContact CG2-CG 4.34Å; I3040-L3044 WeakPolarHBondContact O-CB 3.01Å; I3040-L3044 VanDerWaalsContact O-CG 3.26Å; I3040-L3044 WeakPolarHBondContact O-CG 3.38Å; I3040-L3044 PolarHBondContact O-N 3.48Å; L3044-H3048 PolarHBondContact O-CD2 3.2Å
3045	K	59	Low	59.1	Low	152 Å²	152	89.3 Å²	89.3	66%	0.661	43%	0.432	S	S	*	.	H	α-helix	trans	-80.7	-24.3	172.8	-78.3	173.9	-178.1	175	0	113.3	L3041 Y3042 V3043	L3041-K3045 WeakPolarHBondContact O-CB 3.29Å; L3041-K3045 WeakPolarHBondContact O-CD 3.46Å; L3041-K3045 VanDerWaalsContact O-CG 3.23Å; L3041-K3045 WeakPolarHBondContact O-CG 3.39Å; L3041-K3045 PolarHBondContact O-N 3.25Å; Y3042-K3045 PolarHBondContact O-N 2.91Å; V3043-K3045 PolarHBondContact O-N 3.24Å; V3043-K3045 VanDerWaalsContact O-N 3.12Å
3046	R	56.1	Low	59.7	Low	147 Å²	147	91.8 Å²	91.8	56%	0.555	45%	0.449	S	S	*	.	H	α-helix	trans	-85.6	-25	-173.5	-161.5	175.2	-173.6	-119.7	8.7	113.4	Y3042 V3043 H3048 S3184	Y3042-R3046 PolarHBondContact O-N 2.91Å; V3043-R3046 WeakPolarHBondContact O-CB 3.48Å; V3043-R3046 PolarHBondContact O-N 3.5Å; R3046-H3048 PolarHBondContact O-N 2.98Å; R3046-S3184 PolarHBondContact NH1-OG 3.28Å
3047	E	49.5	Very low	60.3	Low	103 Å²	103	94.1 Å²	94.1	48%	0.481	46%	0.461	S	S	.	.	S	Bend	trans	-59.7	-22.3	172.5	-71.1	169.5	-152.8	0	0	113.1	V3043 G3049 M3075	V3043-E3047 PolarHBondContact O-N 3.28Å; E3047-G3049 PolarHBondContact O-N 3.1Å; E3047-M3075 WeakPolarHBondContact OE1-CE 2.94Å
3048	H	43.4	Very low	61	Low	138 Å²	138	97 Å²	97	64%	0.639	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	84	179.5	-70.5	-66	0	0	0	113.3	L3044 R3046	L3044-H3048 PolarHBondContact O-CD2 3.2Å; R3046-H3048 PolarHBondContact O-N 2.98Å
3049	G	38.2	Very low	61.8	Low	75 Å²	75	94.3 Å²	94.3	77%	0.773	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	151.2	1	154.6	0	0	0	0	0	119.3	E3047	E3047-G3049 PolarHBondContact O-N 3.1Å
3050	K	37.4	Very low	62.6	Low	177 Å²	177	98.2 Å²	98.2	77%	0.77	50%	0.502	S	S	*	.			trans	-121.5	98.4	-176	-82.5	-177.2	158.9	-156.9	0	113.2	I3052	K3050-I3052 HydrophobicContact CB-CD1 4.25Å; K3050-I3052 HydrophobicContact CB-CG1 4.2Å; K3050-I3052 HydrophobicContact CD-CD1 3.65Å; K3050-I3052 HydrophobicContact CD-CG1 4.45Å; K3050-I3052 HydrophobicContact CG-CD1 4.09Å; K3050-I3052 HydrophobicContact CG-CG1 4.38Å
3051	K	40.6	Very low	63.7	Low	207 Å²	207	101.8 Å²	101.8	90%	0.9	52%	0.516	S	S	*	.			trans	-75.6	115.4	144.4	-83.8	-170.9	173.8	-173.4	0	106.5
3052	I	41.2	Very low	64.9	Low	86 Å²	86	103.8 Å²	103.8	44%	0.441	52%	0.52	S	S	.	.			trans	-130.5	133.5	167.5	-66.3	179.7	0	0	0	105.8	K3050 L3054	K3050-I3052 HydrophobicContact CB-CD1 4.25Å; K3050-I3052 HydrophobicContact CB-CG1 4.2Å; K3050-I3052 HydrophobicContact CD-CD1 3.65Å; K3050-I3052 HydrophobicContact CD-CG1 4.45Å; K3050-I3052 HydrophobicContact CG-CD1 4.09Å; K3050-I3052 HydrophobicContact CG-CG1 4.38Å; I3052-L3054 HydrophobicContact CB-CD2 4.34Å; I3052-L3054 HydrophobicContact CB-CG 4.23Å; I3052-L3054 HydrophobicContact CG2-CD2 3.7Å; I3052-L3054 HydrophobicContact CG2-CG 3.93Å; I3052-L3054 PolarHBondContact O-N 2.83Å; I3052-L3054 VanDerWaalsContact O-N 3.15Å
3053	N	50.8	Low	65.9	Low	168 Å²	168	97.9 Å²	97.9	90%	0.898	50%	0.498	S	S	*	.			trans	-71.8	104.4	166.1	-68.5	-4.7	0	0	0	106.3
3054	L	62.9	Low	66.9	Low	63 Å²	63	101.7 Å²	101.7	33%	0.33	52%	0.522	S	S	.	.	P	Polyproline II helix	trans	-99	125.5	-178.5	-69.4	166.3	0	0	0	108.6	I3052 Y3181 E3182	I3052-L3054 HydrophobicContact CB-CD2 4.34Å; I3052-L3054 HydrophobicContact CB-CG 4.23Å; I3052-L3054 HydrophobicContact CG2-CD2 3.7Å; I3052-L3054 HydrophobicContact CG2-CG 3.93Å; I3052-L3054 PolarHBondContact O-N 2.83Å; I3052-L3054 VanDerWaalsContact O-N 3.15Å; L3054-Y3181 HydrophobicContact CB-CD1 4.35Å; L3054-Y3181 WeakPolarHBondContact O-CD1 3.43Å; L3054-E3182 HydrophobicContact CD1-CB 4.16Å
3055	E	78	Confident	68.1	Low	173 Å²	173	100.3 Å²	100.3	81%	0.808	51%	0.514	S	S	*	.	P	Polyproline II helix	trans	-72.8	146.8	167.9	-65	-176.6	163.4	0	0	110	I3057	E3055-I3057 PolarHBondContact O-N 3.23Å
3056	P	82.7	Confident	69.1	Low	71 Å²	71	98.5 Å²	98.5	46%	0.461	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-72.9	122.9	-179.2	29.5	-34.2	0	0	0	111.4	A3058 N3179 Y3181	P3056-A3058 PolarHBondContact O-N 3.39Å; P3056-N3179 HydrophobicContact CB-CB 3.98Å; P3056-Y3181 HydrophobicContact CB-CD1 4.47Å; P3056-Y3181 HydrophobicContact CB-CE1 4.23Å
3057	I	85.6	Confident	70.1	Confident	51 Å²	51	98.2 Å²	98.2	26%	0.262	51%	0.506	S	S	.	.	B	Isolated β-bridge	trans	-63.7	129.3	172.5	-55.9	173.8	0	0	0	109.1	E3055 Y3061 L3180	E3055-I3057 PolarHBondContact O-N 3.23Å; I3057-Y3061 HydrophobicContact CG2-CD2 3.37Å; I3057-Y3061 HydrophobicContact CG2-CE2 3.61Å; I3057-Y3061 HydrophobicContact CG2-CG 3.85Å; I3057-L3180 HydrophobicContact CB-CB 4.42Å; I3057-L3180 HydrophobicContact CB-CD2 4.36Å; I3057-L3180 HydrophobicContact CB-CG 4.3Å; I3057-L3180 VanDerWaalsContact CB-O 3.26Å; I3057-L3180 WeakPolarHBondContact CB-O 3.09Å; I3057-L3180 HydrophobicContact CD1-CG 4.35Å; I3057-L3180 WeakPolarHBondContact CG1-O 3.13Å; I3057-L3180 HydrophobicContact CG2-CD2 4.45Å; I3057-L3180 PolarHBondContact N-O 3.45Å
3058	A	85.4	Confident	71.3	Confident	83 Å²	83	100.9 Å²	100.9	69%	0.686	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-60.5	141.9	178.2	0	0	0	0	0	112.2	P3056	P3056-A3058 PolarHBondContact O-N 3.39Å
3059	L	86.4	Confident	72.9	Confident	46 Å²	46	96 Å²	96	24%	0.241	50%	0.503	C	S	.	.	S	Bend	trans	-110.7	148.1	177.3	-63.6	-173.9	0	0	0	110.6	I3174 G3176 V3178 L3180	L3059-I3174 HydrophobicContact CD1-CG2 4.44Å; L3059-I3174 HydrophobicContact CD2-CB 4.28Å; L3059-I3174 HydrophobicContact CD2-CG2 4.04Å; L3059-G3176 WeakPolarHBondContact CD1-O 3.49Å; L3059-V3178 HydrophobicContact CD1-CG2 3.8Å; L3059-V3178 VanDerWaalsContact CD1-O 3.22Å; L3059-V3178 WeakPolarHBondContact CD1-O 3.48Å; L3059-L3180 HydrophobicContact CD2-CB 4.02Å; L3059-L3180 HydrophobicContact CD2-CD2 3.8Å
3060	P	87.9	Confident	74.6	Confident	85 Å²	85	93.8 Å²	93.8	55%	0.552	48%	0.475	S	S	*	.	S	Bend	cis	-78.7	133	5.8	31.5	-35.5	0	0	0	113.8	K3173 I3174	P3060-K3173 HydrophobicContact CB-CG 4.35Å; P3060-I3174 CarbonylContact C-O 3.55Å; P3060-I3174 WeakPolarHBondContact CA-O 3.39Å
3061	Y	90.9	Very high	76.7	Confident	81 Å²	81	85.4 Å²	85.4	32%	0.318	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	142.7	-178.9	-171	-104.4	0	0	0	111.5	I3057 V3063 K3173 I3174 L3180 T3183	I3057-Y3061 HydrophobicContact CG2-CD2 3.37Å; I3057-Y3061 HydrophobicContact CG2-CE2 3.61Å; I3057-Y3061 HydrophobicContact CG2-CG 3.85Å; Y3061-V3063 HydrophobicContact CD1-CG2 3.99Å; Y3061-V3063 HydrophobicContact CE1-CG2 3.93Å; Y3061-K3173 CarbonylContact O-C 3.6Å; Y3061-K3173 WeakPolarHBondContact O-CA 3.29Å; Y3061-I3174 PolarHBondContact N-O 3.35Å; Y3061-I3174 PolarHBondContact O-N 2.74Å; Y3061-L3180 HydrophobicContact CD1-CD2 3.79Å; Y3061-L3180 HydrophobicContact CG-CD2 4.01Å; Y3061-T3183 HydrophobicContact CD1-CG2 3.91Å; Y3061-T3183 HydrophobicContact CE1-CG2 3.66Å
3062	Y	91	Very high	78.9	Confident	93 Å²	93	76 Å²	76	37%	0.365	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	125	-179.4	-176.8	-106.8	0	0	0	111.6	P3064 M3092 N3170 G3171 I3172 K3173	Y3062-P3064 HydrophobicContact CD1-CB 4.48Å; Y3062-P3064 HydrophobicContact CE1-CB 3.97Å; Y3062-P3064 WeakPolarHBondContact O-CD 3.39Å; Y3062-M3092 HydrophobicContact CE2-CB 4.15Å; Y3062-M3092 HydrophobicContact CE2-CG 3.98Å; Y3062-N3170 VanDerWaalsContact OH-C 3.29Å; Y3062-N3170 PolarHBondContact OH-O 3.11Å; Y3062-G3171 WeakPolarHBondContact OH-CA 3.5Å; Y3062-G3171 PolarHBondContact OH-N 3.41Å; Y3062-I3172 CarbonylContact C-O 3.55Å; Y3062-I3172 WeakPolarHBondContact CA-O 3.41Å; Y3062-I3172 WeakPolarHBondContact CD2-O 3.17Å; Y3062-K3173 HydrophobicContact CD2-CB 4.2Å
3063	V	90.2	Very high	81.2	Confident	3 Å²	3	72.6 Å²	72.6	2%	0.018	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	106.9	174.4	-172.9	0	0	0	0	108.6	Y3061 A3074 L3076 G3171 I3172 I3174 T3183 P3185	Y3061-V3063 HydrophobicContact CD1-CG2 3.99Å; Y3061-V3063 HydrophobicContact CE1-CG2 3.93Å; V3063-A3074 HydrophobicContact CG1-CB 4.13Å; V3063-L3076 HydrophobicContact CG2-CD2 4.42Å; V3063-G3171 CarbonylContact O-C 3.58Å; V3063-G3171 WeakPolarHBondContact O-CA 3.42Å; V3063-I3172 HydrophobicContact CB-CD1 4.42Å; V3063-I3172 HydrophobicContact CB-CG1 3.78Å; V3063-I3172 HydrophobicContact CG2-CG1 4.2Å; V3063-I3172 PolarHBondContact N-O 2.98Å; V3063-I3172 PolarHBondContact O-N 3.45Å; V3063-I3174 HydrophobicContact CG2-CD1 4.17Å; V3063-T3183 HydrophobicContact CG2-CG2 3.87Å; V3063-P3185 HydrophobicContact CG1-CB 4.02Å
3064	P	86.4	Confident	82.9	Confident	90 Å²	90	64.6 Å²	64.6	58%	0.584	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.1	145.8	177	29.3	-34.4	0	0	0	111.7	Y3062	Y3062-P3064 HydrophobicContact CD1-CB 4.48Å; Y3062-P3064 HydrophobicContact CE1-CB 3.97Å; Y3062-P3064 WeakPolarHBondContact O-CD 3.39Å
3065	F	86.7	Confident	84	Confident	14 Å²	14	62.9 Å²	62.9	6%	0.061	33%	0.327	C	S	.	.			trans	-110.6	139.8	173.2	-71.8	-23.7	0	0	0	110.5	N3072 A3074 V3142 L3144 V3169 N3170 I3172	F3065-N3072 HydrophobicContact CB-CB 3.96Å; F3065-N3072 HydrophobicContact CD1-CB 3.61Å; F3065-N3072 HydrophobicContact CD2-CB 4.3Å; F3065-N3072 HydrophobicContact CE1-CB 4.13Å; F3065-N3072 HydrophobicContact CG-CB 3.71Å; F3065-A3074 HydrophobicContact CE1-CB 4.2Å; F3065-V3142 HydrophobicContact CZ-CG1 4.33Å; F3065-L3144 HydrophobicContact CD2-CB 4.22Å; F3065-L3144 HydrophobicContact CD2-CD2 3.66Å; F3065-L3144 HydrophobicContact CE2-CB 3.99Å; F3065-L3144 HydrophobicContact CE2-CD2 4.18Å; F3065-L3144 HydrophobicContact CG-CD2 4.48Å; F3065-V3169 HydrophobicContact CD2-CG1 4.23Å; F3065-V3169 HydrophobicContact CE2-CG1 4.43Å; F3065-N3170 PolarHBondContact N-O 3.41Å; F3065-I3172 HydrophobicContact CE2-CG2 3.98Å; F3065-I3172 HydrophobicContact CZ-CD1 4.31Å; F3065-I3172 HydrophobicContact CZ-CG1 4.26Å; F3065-I3172 HydrophobicContact CZ-CG2 4.09Å
3066	K	79.8	Confident	84.4	Confident	114 Å²	114	54.6 Å²	54.6	50%	0.496	29%	0.289	S	S	.	.			trans	-69.5	133.7	175.8	-72.3	-163.7	-172	-177.8	0	110.3	V3069 N3072 V3187 E3189	K3066-V3069 HydrophobicContact CB-CG1 3.65Å; K3066-V3069 HydrophobicContact CB-CG2 4.33Å; K3066-V3069 HydrophobicContact CD-CG1 4.21Å; K3066-V3069 WeakPolarHBondContact O-CG2 3.49Å; K3066-N3072 PolarHBondContact N-OD1 3.05Å; K3066-N3072 PolarHBondContact O-ND2 3.3Å; K3066-V3187 HydrophobicContact CB-CG2 4.45Å; K3066-V3187 HydrophobicContact CD-CG1 4.29Å; K3066-V3187 HydrophobicContact CD-CG2 4.12Å; K3066-V3187 HydrophobicContact CG-CG2 4.12Å; K3066-E3189 IonicContact NZ-OE1 2.78Å; K3066-E3189 PolarHBondContact NZ-OE1 3.1Å
3067	R	77	Confident	84.7	Confident	142 Å²	142	54.1 Å²	54.1	54%	0.536	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.8	156.7	165.9	-68.9	178.2	168.9	-177	-9.5	110.4	V3069 D3094 N3170	R3067-V3069 VanDerWaalsContact C-N 3.33Å; R3067-V3069 PolarHBondContact O-N 2.96Å; R3067-D3094 IonicContact CZ-OD1 3.36Å; R3067-D3094 IonicContact NH2-OD1 3.64Å; R3067-D3094 PolarHBondContact NH2-OD1 3.01Å; R3067-D3094 IonicContact NH2-OD2 3.82Å; R3067-N3170 VanDerWaalsContact CZ-OD1 3.29Å; R3067-N3170 PolarHBondContact NE-OD1 3.27Å; R3067-N3170 VanDerWaalsContact NH2-CG 3.31Å; R3067-N3170 PolarHBondContact NH2-ND2 2.58Å; R3067-N3170 VanDerWaalsContact NH2-ND2 3.12Å; R3067-N3170 PolarHBondContact NH2-OD1 3.45Å
3068	N	73.9	Confident	84.8	Confident	159 Å²	159	51.7 Å²	51.7	85%	0.85	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.9	21.9	172.9	-58.4	-22.3	0	0	0	117.4
3069	V	77.1	Confident	84.9	Confident	34 Å²	34	47.8 Å²	47.8	21%	0.206	23%	0.234	C	C	.	.	S	Bend	trans	-101.5	170.2	176.3	-55.9	0	0	0	0	112	K3066 R3067 N3072 V3187 E3189	K3066-V3069 HydrophobicContact CB-CG1 3.65Å; K3066-V3069 HydrophobicContact CB-CG2 4.33Å; K3066-V3069 HydrophobicContact CD-CG1 4.21Å; K3066-V3069 WeakPolarHBondContact O-CG2 3.49Å; R3067-V3069 VanDerWaalsContact C-N 3.33Å; R3067-V3069 PolarHBondContact O-N 2.96Å; V3069-N3072 WeakPolarHBondContact CG2-ND2 3.08Å; V3069-V3187 HydrophobicContact CB-CG1 3.73Å; V3069-V3187 HydrophobicContact CG1-CG1 3.57Å; V3069-V3187 HydrophobicContact CG2-CG1 3.97Å; V3069-E3189 HydrophobicContact CG1-CG 4.21Å
3070	V	74.7	Confident	84.8	Confident	30 Å²	30	45.6 Å²	45.6	18%	0.182	22%	0.223	C	C	.	.	S	Bend	trans	-75.5	-44.2	179	-174.5	0	0	0	0	110.7	Y3145 I3188 K3190	V3070-Y3145 HydrophobicContact CG1-CE2 3.85Å; V3070-I3188 HydrophobicContact CB-CG2 4.19Å; V3070-I3188 VanDerWaalsContact CB-O 3.31Å; V3070-I3188 WeakPolarHBondContact CB-O 3.47Å; V3070-I3188 PolarHBondContact N-O 2.83Å; V3070-K3190 HydrophobicContact CG2-CB 3.61Å; V3070-K3190 HydrophobicContact CG2-CG 4.14Å
3071	A	81.4	Confident	84.6	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.008	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	146.8	174	0	0	0	0	0	110.8	T3035 I3039 L3144 Y3145 V3187 I3188	T3035-A3071 HydrophobicContact CG2-CB 4.39Å; I3039-A3071 HydrophobicContact CD1-CB 3.9Å; A3071-L3144 CarbonylContact C-O 3.59Å; A3071-L3144 VanDerWaalsContact CA-O 3.25Å; A3071-L3144 WeakPolarHBondContact CA-O 3.35Å; A3071-Y3145 HydrophobicContact CB-CD2 4.09Å; A3071-V3187 WeakPolarHBondContact O-CA 3.41Å; A3071-I3188 HydrophobicContact CB-CB 4.48Å; A3071-I3188 PolarHBondContact N-O 2.84Å; A3071-I3188 PolarHBondContact O-N 2.7Å
3072	N	87.5	Confident	84	Confident	9 Å²	9	48 Å²	48	5%	0.048	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	152.9	159.4	-65.4	-82.4	0	0	0	108.5	F3065 K3066 V3069 I3143 L3144 G3186	F3065-N3072 HydrophobicContact CB-CB 3.96Å; F3065-N3072 HydrophobicContact CD1-CB 3.61Å; F3065-N3072 HydrophobicContact CD2-CB 4.3Å; F3065-N3072 HydrophobicContact CE1-CB 4.13Å; F3065-N3072 HydrophobicContact CG-CB 3.71Å; K3066-N3072 PolarHBondContact N-OD1 3.05Å; K3066-N3072 PolarHBondContact O-ND2 3.3Å; V3069-N3072 WeakPolarHBondContact CG2-ND2 3.08Å; N3072-I3143 CarbonylContact O-C 3.55Å; N3072-I3143 WeakPolarHBondContact O-CA 3.33Å; N3072-I3143 WeakPolarHBondContact O-CG2 3.2Å; N3072-L3144 HydrophobicContact CB-CB 4.42Å; N3072-L3144 PolarHBondContact N-O 2.66Å; N3072-L3144 PolarHBondContact O-N 3.33Å; N3072-G3186 CarbonylContact C-O 3.59Å
3073	F	88.9	Confident	83.1	Confident	15 Å²	15	50.3 Å²	50.3	7%	0.066	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	158.8	167.3	64.3	-91.9	0	0	0	111.1	I3039 Y3042 V3043 L3141 V3142 I3143 P3185 G3186	I3039-F3073 HydrophobicContact CD1-CD1 4.07Å; I3039-F3073 HydrophobicContact CG1-CD1 4.06Å; I3039-F3073 HydrophobicContact CG1-CE1 4.31Å; I3039-F3073 HydrophobicContact CG2-CB 3.97Å; I3039-F3073 HydrophobicContact CG2-CD1 3.68Å; I3039-F3073 HydrophobicContact CG2-CD2 4.1Å; I3039-F3073 HydrophobicContact CG2-CE1 4.1Å; I3039-F3073 HydrophobicContact CG2-CE2 4.49Å; I3039-F3073 HydrophobicContact CG2-CG 3.67Å; I3039-F3073 HydrophobicContact CG2-CZ 4.48Å; Y3042-F3073 HydrophobicContact CD1-CE2 4.48Å; Y3042-F3073 AromaticContact CD1-CZ 3.95Å; Y3042-F3073 HydrophobicContact CD1-CZ 3.95Å; Y3042-F3073 HydrophobicContact CE1-CZ 4.05Å; V3043-F3073 HydrophobicContact CG2-CD2 4.16Å; V3043-F3073 HydrophobicContact CG2-CE2 3.77Å; V3043-F3073 HydrophobicContact CG2-CZ 4.48Å; F3073-L3141 HydrophobicContact CB-CD1 4.47Å; F3073-L3141 HydrophobicContact CD2-CD1 4.34Å; F3073-V3142 CarbonylContact C-O 3.52Å; F3073-V3142 WeakPolarHBondContact CA-O 3.18Å; F3073-V3142 WeakPolarHBondContact CB-O 3.36Å; F3073-I3143 HydrophobicContact CB-CB 4.31Å; F3073-I3143 HydrophobicContact CB-CG1 3.93Å; F3073-I3143 HydrophobicContact CB-CG2 4.26Å; F3073-P3185 CarbonylContact O-C 3.55Å; F3073-P3185 WeakPolarHBondContact O-CA 2.72Å; F3073-G3186 WeakPolarHBondContact CD1-O 3.37Å; F3073-G3186 VanDerWaalsContact CE1-C 3.49Å; F3073-G3186 PolarHBondContact N-O 2.9Å; F3073-G3186 PolarHBondContact O-N 3.19Å
3074	A	85.6	Confident	82	Confident	0 Å²	0	51 Å²	51	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	123.7	170.3	0	0	0	0	0	109	V3063 F3065 L3076 V3142 I3172	V3063-A3074 HydrophobicContact CG1-CB 4.13Å; F3065-A3074 HydrophobicContact CE1-CB 4.2Å; A3074-L3076 HydrophobicContact CB-CD2 4.12Å; A3074-V3142 PolarHBondContact N-O 3.04Å; A3074-V3142 PolarHBondContact O-N 2.96Å; A3074-I3172 HydrophobicContact CB-CD1 4.24Å
3075	M	86.5	Confident	81.4	Confident	26 Å²	26	48.1 Å²	48.1	13%	0.128	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	127.5	164.5	-170.5	56.8	135.9	0	0	108.4	V3043 E3047 D3139 L3141 S3184	V3043-M3075 HydrophobicContact CG1-CB 4.27Å; V3043-M3075 HydrophobicContact CG1-CE 3.75Å; V3043-M3075 HydrophobicContact CG1-CG 4.07Å; V3043-M3075 HydrophobicContact CG1-SD 4.32Å; E3047-M3075 WeakPolarHBondContact OE1-CE 2.94Å; M3075-D3139 HydrophobicContact CE-CB 3.66Å; M3075-D3139 HydrophobicContact SD-CB 4.05Å; M3075-L3141 HydrophobicContact CB-CD1 4.28Å; M3075-L3141 HydrophobicContact CE-CB 4.38Å; M3075-L3141 HydrophobicContact SD-CB 3.68Å; M3075-L3141 HydrophobicContact SD-CD1 4.21Å; M3075-L3141 HydrophobicContact SD-CG 4.48Å; M3075-S3184 PolarHBondContact N-O 2.78Å; M3075-S3184 VanDerWaalsContact N-O 3.08Å; M3075-S3184 PolarHBondContact O-N 3.19Å
3076	L	87.7	Confident	81.4	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	126.1	-176.4	-52	179.3	0	0	0	109.1	V3063 A3074 L3078 I3089 D3139 V3140 V3142 I3172 I3174 L3180 T3183	V3063-L3076 HydrophobicContact CG2-CD2 4.42Å; A3074-L3076 HydrophobicContact CB-CD2 4.12Å; L3076-L3078 HydrophobicContact CB-CD1 4.47Å; L3076-L3078 HydrophobicContact CB-CG 4.39Å; L3076-I3089 HydrophobicContact CD1-CD1 3.8Å; L3076-I3089 HydrophobicContact CD1-CG1 4.33Å; L3076-D3139 CarbonylContact O-C 3.55Å; L3076-D3139 WeakPolarHBondContact O-CA 3.04Å; L3076-V3140 HydrophobicContact CB-CB 4.5Å; L3076-V3140 PolarHBondContact N-O 3.24Å; L3076-V3140 PolarHBondContact O-N 3.21Å; L3076-V3142 HydrophobicContact CD1-CG2 4.18Å; L3076-I3172 HydrophobicContact CD1-CD1 4.1Å; L3076-I3172 HydrophobicContact CD2-CD1 4.41Å; L3076-I3174 HydrophobicContact CD1-CD1 3.78Å; L3076-I3174 HydrophobicContact CD1-CG1 4.3Å; L3076-I3174 HydrophobicContact CD2-CD1 3.65Å; L3076-I3174 HydrophobicContact CG-CD1 4.3Å; L3076-L3180 HydrophobicContact CB-CD1 4.46Å; L3076-T3183 HydrophobicContact CD2-CG2 3.84Å
3077	K	88.2	Confident	81.9	Confident	61 Å²	61	45 Å²	45	27%	0.265	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	112.5	178.2	-167.5	166.6	-157.1	103	0	110.5	D3139 L3180 Y3181 E3182	K3077-D3139 WeakPolarHBondContact CE-OD1 3.4Å; K3077-D3139 WeakPolarHBondContact CG-OD1 3.3Å; K3077-D3139 IonicContact NZ-OD1 3.78Å; K3077-D3139 PolarHBondContact NZ-OD1 2.81Å; K3077-D3139 IonicContact NZ-OD2 3.73Å; K3077-L3180 CarbonylContact O-C 3.54Å; K3077-L3180 WeakPolarHBondContact O-CA 2.94Å; K3077-Y3181 PolarHBondContact O-N 3.28Å; K3077-E3182 HydrophobicContact CB-CB 4Å; K3077-E3182 PolarHBondContact N-O 2.67Å
3078	L	87.6	Confident	82.6	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	148	-165.1	-62.8	170.9	0	0	0	111.2	L3076 F3087 P3137 F3138 V3140 V3178 N3179 L3180	L3076-L3078 HydrophobicContact CB-CD1 4.47Å; L3076-L3078 HydrophobicContact CB-CG 4.39Å; L3078-F3087 HydrophobicContact CD1-CD2 4.3Å; L3078-F3087 HydrophobicContact CD1-CE1 4.42Å; L3078-F3087 HydrophobicContact CD1-CE2 3.67Å; L3078-F3087 HydrophobicContact CD1-CZ 3.73Å; L3078-P3137 CarbonylContact O-C 3.58Å; L3078-P3137 VanDerWaalsContact O-CA 3.26Å; L3078-P3137 WeakPolarHBondContact O-CA 3.2Å; L3078-F3138 HydrophobicContact CB-CD2 4.36Å; L3078-F3138 HydrophobicContact CB-CE1 4.14Å; L3078-F3138 HydrophobicContact CB-CE2 3.83Å; L3078-F3138 HydrophobicContact CB-CZ 3.69Å; L3078-F3138 HydrophobicContact CD1-CE2 4.06Å; L3078-F3138 HydrophobicContact CD1-CZ 4.37Å; L3078-F3138 PolarHBondContact N-O 2.86Å; L3078-F3138 WeakPolarHBondContact O-CD1 3.48Å; L3078-F3138 PolarHBondContact O-N 3.38Å; L3078-V3140 HydrophobicContact CD1-CG2 4.05Å; L3078-V3178 HydrophobicContact CD2-CB 4.39Å; L3078-V3178 HydrophobicContact CD2-CG2 3.93Å; L3078-N3179 CarbonylContact C-O 3.52Å; L3078-N3179 VanDerWaalsContact CA-O 3.32Å; L3078-N3179 WeakPolarHBondContact CA-O 3.38Å; L3078-L3180 HydrophobicContact CD2-CB 4.13Å; L3078-L3180 HydrophobicContact CD2-CD1 3.62Å; L3078-L3180 HydrophobicContact CD2-CG 4.46Å
3079	A	87	Confident	83.4	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	145.3	159.1	0	0	0	0	0	109.9	V3178 N3179 Y3181	A3079-V3178 CarbonylContact O-C 3.54Å; A3079-V3178 WeakPolarHBondContact O-CA 3.47Å; A3079-V3178 VanDerWaalsContact O-CB 3.31Å; A3079-V3178 WeakPolarHBondContact O-CB 3.32Å; A3079-N3179 PolarHBondContact N-O 3.35Å; A3079-N3179 PolarHBondContact O-N 3.16Å; A3079-Y3181 HydrophobicContact CB-CE2 3.74Å
3080	F	85.4	Confident	84.1	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	134.1	171	-75.2	-85	0	0	0	110.5	G3085 F3087 L3105 I3130 N3135 F3138 V3178	F3080-G3085 WeakPolarHBondContact CE1-O 3.46Å; F3080-F3087 AromaticContact CE1-CD1 3.79Å; F3080-F3087 HydrophobicContact CE1-CD1 3.79Å; F3080-F3087 HydrophobicContact CE1-CE1 4.3Å; F3080-F3087 HydrophobicContact CE2-CE1 4.25Å; F3080-F3087 AromaticContact CZ-CD1 3.68Å; F3080-F3087 HydrophobicContact CZ-CD1 3.68Å; F3080-F3087 AromaticContact CZ-CE1 3.7Å; F3080-F3087 HydrophobicContact CZ-CE1 3.7Å; F3080-L3105 HydrophobicContact CB-CD2 4.33Å; F3080-L3105 HydrophobicContact CD1-CB 4.15Å; F3080-L3105 HydrophobicContact CD2-CB 4.21Å; F3080-L3105 HydrophobicContact CD2-CD1 3.84Å; F3080-L3105 HydrophobicContact CD2-CD2 4.5Å; F3080-L3105 HydrophobicContact CD2-CG 4.41Å; F3080-L3105 HydrophobicContact CE1-CB 3.99Å; F3080-L3105 HydrophobicContact CE2-CB 4.06Å; F3080-L3105 HydrophobicContact CE2-CD1 4.04Å; F3080-L3105 HydrophobicContact CG-CB 4.25Å; F3080-L3105 HydrophobicContact CG-CD1 4.4Å; F3080-L3105 HydrophobicContact CG-CD2 4.25Å; F3080-L3105 HydrophobicContact CZ-CB 3.94Å; F3080-I3130 HydrophobicContact CE2-CB 3.82Å; F3080-I3130 HydrophobicContact CE2-CG1 3.94Å; F3080-I3130 HydrophobicContact CE2-CG2 3.91Å; F3080-I3130 HydrophobicContact CZ-CB 4.28Å; F3080-I3130 HydrophobicContact CZ-CG1 4.04Å; F3080-N3135 PolarHBondContact O-N 3.16Å; F3080-N3135 PolarHBondContact O-OD1 3.38Å; F3080-F3138 AromaticContact CD2-CE1 3.72Å; F3080-F3138 HydrophobicContact CD2-CE1 3.72Å; F3080-F3138 HydrophobicContact CD2-CZ 4.15Å; F3080-F3138 AromaticContact CE2-CE1 3.78Å; F3080-F3138 HydrophobicContact CE2-CE1 3.78Å; F3080-F3138 AromaticContact CE2-CZ 3.78Å; F3080-F3138 HydrophobicContact CE2-CZ 3.78Å; F3080-V3178 HydrophobicContact CD1-CG1 3.97Å; F3080-V3178 HydrophobicContact CE1-CG1 4.21Å; F3080-V3178 HydrophobicContact CG-CG1 4.25Å
3081	K	83.9	Confident	84.8	Confident	85 Å²	85	28.5 Å²	28.5	37%	0.37	15%	0.152	S	C	.	.	P	Polyproline II helix	trans	-64.7	150.2	169.4	-68	177.5	-178.8	177.4	0	109.6	A3084 D3177 V3178 N3179	K3081-A3084 HydrophobicContact CB-CB 4.18Å; K3081-A3084 PolarHBondContact O-N 3.09Å; K3081-A3084 VanDerWaalsContact O-N 3.08Å; K3081-D3177 WeakPolarHBondContact CB-O 3.47Å; K3081-D3177 PolarHBondContact N-O 3.14Å; K3081-V3178 WeakPolarHBondContact CE-O 3.31Å; K3081-N3179 WeakPolarHBondContact CE-OD1 3.49Å; K3081-N3179 WeakPolarHBondContact CG-OD1 3.46Å
3082	Q	78.5	Confident	85	Confident	133 Å²	133	29.3 Å²	29.3	62%	0.621	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	140.2	179.1	-164.2	166.4	-4.1	0	0	111.3	A3084 E3134	Q3082-A3084 PolarHBondContact O-N 3.2Å; Q3082-A3084 VanDerWaalsContact O-N 3.12Å; Q3082-E3134 VanDerWaalsContact CA-OE2 3.3Å; Q3082-E3134 WeakPolarHBondContact CA-OE2 3.47Å
3083	N	71.2	Confident	84.9	Confident	141 Å²	141	29.4 Å²	29.4	75%	0.754	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.7	-6.8	-171.3	-59.7	-32.3	0	0	0	116.7	E3134	N3083-E3134 PolarHBondContact N-OE2 2.67Å
3084	A	66.7	Low	84.5	Confident	17 Å²	17	32.4 Å²	32.4	14%	0.14	17%	0.173	C	C	.	.			trans	-100.9	153.5	-169	0	0	0	0	0	114.8	K3081 Q3082 D3177	K3081-A3084 HydrophobicContact CB-CB 4.18Å; K3081-A3084 PolarHBondContact O-N 3.09Å; K3081-A3084 VanDerWaalsContact O-N 3.08Å; Q3082-A3084 PolarHBondContact O-N 3.2Å; Q3082-A3084 VanDerWaalsContact O-N 3.12Å; A3084-D3177 HydrophobicContact CB-CB 3.29Å
3085	G	75.3	Confident	84.1	Confident	30 Å²	30	39.4 Å²	39.4	31%	0.309	21%	0.211	S	C	.	.			trans	-114.9	-24.3	-162.4	0	0	0	0	0	117.5	F3080 T3104 L3105	F3080-G3085 WeakPolarHBondContact CE1-O 3.46Å; G3085-T3104 WeakPolarHBondContact O-CA 3.11Å; G3085-L3105 PolarHBondContact O-N 2.79Å
3086	T	85.4	Confident	83.9	Confident	58 Å²	58	43.2 Å²	43.2	36%	0.356	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	144.8	-165.9	47.5	0	0	0	0	115.3	G3103 T3104 D3177	T3086-G3103 CarbonylContact C-O 3.57Å; T3086-G3103 WeakPolarHBondContact CA-O 3.41Å; T3086-T3104 HydrophobicContact CG2-CG2 4.01Å; T3086-D3177 PolarHBondContact O-N 3.23Å
3087	F	90.9	Very high	83.7	Confident	4 Å²	4	45.8 Å²	45.8	2%	0.018	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	171.3	163.9	70.6	-87.4	0	0	0	111.3	L3078 F3080 I3089 Q3102 G3103 I3130 F3138 S3175 V3178	L3078-F3087 HydrophobicContact CD1-CD2 4.3Å; L3078-F3087 HydrophobicContact CD1-CE1 4.42Å; L3078-F3087 HydrophobicContact CD1-CE2 3.67Å; L3078-F3087 HydrophobicContact CD1-CZ 3.73Å; F3080-F3087 AromaticContact CE1-CD1 3.79Å; F3080-F3087 HydrophobicContact CE1-CD1 3.79Å; F3080-F3087 HydrophobicContact CE1-CE1 4.3Å; F3080-F3087 HydrophobicContact CE2-CE1 4.25Å; F3080-F3087 AromaticContact CZ-CD1 3.68Å; F3080-F3087 HydrophobicContact CZ-CD1 3.68Å; F3080-F3087 AromaticContact CZ-CE1 3.7Å; F3080-F3087 HydrophobicContact CZ-CE1 3.7Å; F3087-I3089 HydrophobicContact CD2-CG1 4.36Å; F3087-I3089 HydrophobicContact CE2-CD1 4.11Å; F3087-I3089 HydrophobicContact CE2-CG1 4.05Å; F3087-Q3102 CarbonylContact O-C 3.6Å; F3087-Q3102 WeakPolarHBondContact O-CA 3.12Å; F3087-G3103 WeakPolarHBondContact CD1-O 3.35Å; F3087-G3103 PolarHBondContact N-O 2.89Å; F3087-G3103 PolarHBondContact O-N 3.48Å; F3087-I3130 HydrophobicContact CE1-CG1 4.2Å; F3087-F3138 HydrophobicContact CE1-CE2 4.22Å; F3087-F3138 AromaticContact CE1-CZ 3.83Å; F3087-F3138 HydrophobicContact CE1-CZ 3.83Å; F3087-F3138 HydrophobicContact CZ-CE2 4.21Å; F3087-F3138 HydrophobicContact CZ-CZ 4.27Å; F3087-S3175 CarbonylContact C-O 3.58Å; F3087-S3175 VanDerWaalsContact CA-O 3.31Å; F3087-S3175 WeakPolarHBondContact CA-O 3.46Å; F3087-S3175 WeakPolarHBondContact CB-O 3.33Å; F3087-V3178 HydrophobicContact CB-CB 4.28Å; F3087-V3178 HydrophobicContact CB-CG1 3.75Å; F3087-V3178 HydrophobicContact CB-CG2 3.54Å; F3087-V3178 HydrophobicContact CD1-CG1 3.51Å; F3087-V3178 HydrophobicContact CD1-CG2 4.5Å; F3087-V3178 HydrophobicContact CD2-CG2 4.5Å; F3087-V3178 HydrophobicContact CE1-CG1 4.3Å; F3087-V3178 HydrophobicContact CG-CG1 3.83Å; F3087-V3178 HydrophobicContact CG-CG2 3.98Å
3088	S	91.2	Very high	83.5	Confident	10 Å²	10	44.2 Å²	44.2	7%	0.07	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	147.4	171.1	78.2	0	0	0	0	113	D3090 V3101 I3174 S3175	S3088-D3090 WeakPolarHBondContact CB-OD1 3.27Å; S3088-D3090 PolarHBondContact OG-OD1 2.81Å; S3088-V3101 WeakPolarHBondContact CA-O 3.2Å; S3088-I3174 WeakPolarHBondContact O-CA 3.25Å; S3088-S3175 PolarHBondContact N-O 3.35Å; S3088-S3175 PolarHBondContact O-N 3.44Å; S3088-S3175 PolarHBondContact OG-OG 3.03Å
3089	I	91.9	Very high	83.4	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	107.8	164.5	-57.7	170.6	0	0	0	106.6	L3076 F3087 F3091 V3101 V3140 V3142 I3172	L3076-I3089 HydrophobicContact CD1-CD1 3.8Å; L3076-I3089 HydrophobicContact CD1-CG1 4.33Å; F3087-I3089 HydrophobicContact CD2-CG1 4.36Å; F3087-I3089 HydrophobicContact CE2-CD1 4.11Å; F3087-I3089 HydrophobicContact CE2-CG1 4.05Å; I3089-F3091 HydrophobicContact CB-CE2 4.44Å; I3089-F3091 HydrophobicContact CG2-CD2 4.42Å; I3089-F3091 HydrophobicContact CG2-CE2 3.73Å; I3089-F3091 HydrophobicContact CG2-CZ 3.96Å; I3089-V3101 PolarHBondContact N-O 3.26Å; I3089-V3101 PolarHBondContact O-N 3.19Å; I3089-V3140 HydrophobicContact CD1-CG1 4.2Å; I3089-V3142 HydrophobicContact CD1-CG2 4.33Å; I3089-I3172 HydrophobicContact CG2-CB 4.05Å; I3089-I3172 HydrophobicContact CG2-CD1 4.14Å; I3089-I3172 HydrophobicContact CG2-CG2 4.12Å
3090	D	90.6	Very high	83.5	Confident	7 Å²	7	48.3 Å²	48.3	4%	0.037	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	120.6	-178.2	-67.6	11.4	0	0	0	109.2	S3088 M3092 M3097 L3099 R3100 I3172 K3173	S3088-D3090 WeakPolarHBondContact CB-OD1 3.27Å; S3088-D3090 PolarHBondContact OG-OD1 2.81Å; D3090-M3092 HydrophobicContact CB-SD 3.97Å; D3090-M3097 HydrophobicContact CB-CG 3.94Å; D3090-L3099 CarbonylContact C-O 3.53Å; D3090-L3099 WeakPolarHBondContact CA-O 3.04Å; D3090-R3100 VanDerWaalsContact OD1-CG 3.3Å; D3090-R3100 WeakPolarHBondContact OD1-CG 3.2Å; D3090-R3100 IonicContact OD1-CZ 2.8Å; D3090-R3100 IonicContact OD1-NE 3.47Å; D3090-R3100 PolarHBondContact OD1-NE 2.86Å; D3090-R3100 IonicContact OD1-NH2 2.8Å; D3090-R3100 IonicContact OD2-CZ 3.68Å; D3090-R3100 IonicContact OD2-NE 2.97Å; D3090-R3100 PolarHBondContact OD2-NE 2.86Å; D3090-R3100 IonicContact OD2-NH2 3.76Å; D3090-R3100 PolarHBondContact OD2-NH2 2.86Å; D3090-I3172 CarbonylContact O-C 3.53Å; D3090-I3172 VanDerWaalsContact O-CA 3.28Å; D3090-I3172 WeakPolarHBondContact O-CA 3.41Å; D3090-K3173 HydrophobicContact CB-CB 4.3Å; D3090-K3173 PolarHBondContact N-O 3Å; D3090-K3173 PolarHBondContact O-N 3.32Å
3091	F	89.4	Confident	83.6	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	126.8	178.1	-66.5	-99.4	0	0	0	109.7	I3089 V3098 L3099 V3101 V3142 I3149 I3151 V3169 I3172	I3089-F3091 HydrophobicContact CB-CE2 4.44Å; I3089-F3091 HydrophobicContact CG2-CD2 4.42Å; I3089-F3091 HydrophobicContact CG2-CE2 3.73Å; I3089-F3091 HydrophobicContact CG2-CZ 3.96Å; F3091-V3098 HydrophobicContact CB-CG2 4.35Å; F3091-V3098 WeakPolarHBondContact O-CG2 3.32Å; F3091-V3098 PolarHBondContact O-N 2.81Å; F3091-L3099 HydrophobicContact CB-CB 4.25Å; F3091-L3099 HydrophobicContact CD2-CB 4.21Å; F3091-L3099 HydrophobicContact CD2-CD2 4.09Å; F3091-L3099 HydrophobicContact CD2-CG 4.17Å; F3091-L3099 HydrophobicContact CE2-CD2 4.39Å; F3091-L3099 PolarHBondContact N-O 2.83Å; F3091-V3101 HydrophobicContact CE2-CG2 4.19Å; F3091-V3142 HydrophobicContact CE1-CG1 3.55Å; F3091-V3142 HydrophobicContact CZ-CG1 3.66Å; F3091-I3149 HydrophobicContact CB-CD1 4.06Å; F3091-I3149 HydrophobicContact CD1-CD1 3.49Å; F3091-I3149 VanDerWaalsContact CD1-CD1 3.49Å; F3091-I3149 HydrophobicContact CD1-CG1 3.86Å; F3091-I3149 HydrophobicContact CD1-CG2 4.01Å; F3091-I3149 HydrophobicContact CD2-CD1 4.29Å; F3091-I3149 HydrophobicContact CE1-CB 4.3Å; F3091-I3149 HydrophobicContact CE1-CD1 4.01Å; F3091-I3149 HydrophobicContact CE1-CG1 3.99Å; F3091-I3149 HydrophobicContact CE1-CG2 3.33Å; F3091-I3149 HydrophobicContact CE2-CG2 4.09Å; F3091-I3149 HydrophobicContact CG-CD1 3.67Å; F3091-I3149 HydrophobicContact CZ-CG2 3.4Å; F3091-I3151 HydrophobicContact CE2-CD1 3.74Å; F3091-I3151 HydrophobicContact CZ-CD1 3.64Å; F3091-I3151 HydrophobicContact CZ-CG1 4.12Å; F3091-V3169 HydrophobicContact CB-CG1 4.22Å; F3091-V3169 HydrophobicContact CD1-CG1 4.2Å; F3091-I3172 HydrophobicContact CD1-CG2 3.32Å; F3091-I3172 HydrophobicContact CD2-CG2 4.4Å; F3091-I3172 HydrophobicContact CE1-CG2 3.36Å; F3091-I3172 HydrophobicContact CE2-CG2 4.41Å; F3091-I3172 HydrophobicContact CG-CG2 3.87Å; F3091-I3172 HydrophobicContact CZ-CG2 3.92Å
3092	M	85.9	Confident	83.8	Confident	19 Å²	19	47.4 Å²	47.4	9%	0.094	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	136.5	-166	-52.3	-55.4	-64.3	0	0	112.6	Y3062 D3090 N3095 E3096 M3097 V3169 N3170 G3171 K3173	Y3062-M3092 HydrophobicContact CE2-CB 4.15Å; Y3062-M3092 HydrophobicContact CE2-CG 3.98Å; D3090-M3092 HydrophobicContact CB-SD 3.97Å; M3092-N3095 WeakPolarHBondContact CE-O 3.49Å; M3092-E3096 CarbonylContact C-O 3.59Å; M3092-E3096 VanDerWaalsContact CA-O 3.3Å; M3092-E3096 WeakPolarHBondContact CA-O 3.34Å; M3092-M3097 HydrophobicContact CE-CB 4.14Å; M3092-M3097 HydrophobicContact SD-CB 3.94Å; M3092-M3097 HydrophobicContact SD-CG 4.32Å; M3092-V3169 CarbonylContact O-C 3.59Å; M3092-V3169 WeakPolarHBondContact O-CA 3.49Å; M3092-N3170 PolarHBondContact O-N 2.73Å; M3092-G3171 PolarHBondContact N-O 2.97Å; M3092-K3173 HydrophobicContact CG-CB 4.19Å; M3092-K3173 HydrophobicContact SD-CB 4.36Å
3093	I	84.6	Confident	84.2	Confident	11 Å²	11	41 Å²	41	6%	0.056	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	115.8	167.1	-65.3	-167.3	0	0	0	107.2	N3095 E3096 V3098 R3167 V3169	I3093-N3095 PolarHBondContact O-N 3.24Å; I3093-N3095 VanDerWaalsContact O-N 3.1Å; I3093-E3096 PolarHBondContact N-O 3.25Å; I3093-E3096 WeakPolarHBondContact O-CA 3.41Å; I3093-E3096 WeakPolarHBondContact O-CB 3.15Å; I3093-E3096 PolarHBondContact O-N 2.97Å; I3093-V3098 HydrophobicContact CB-CG1 4.02Å; I3093-V3098 HydrophobicContact CD1-CG1 3.88Å; I3093-V3098 HydrophobicContact CD1-CG2 4.15Å; I3093-V3098 HydrophobicContact CG1-CG1 3.82Å; I3093-V3098 HydrophobicContact CG1-CG2 3.93Å; I3093-R3167 HydrophobicContact CD1-CB 4.16Å; I3093-R3167 HydrophobicContact CG2-CB 3.57Å; I3093-R3167 HydrophobicContact CG2-CG 4.28Å; I3093-V3169 HydrophobicContact CD1-CG2 4.32Å; I3093-V3169 HydrophobicContact CG1-CG2 4.11Å
3094	D	80.7	Confident	84.7	Confident	78 Å²	78	36 Å²	36	42%	0.417	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	45.3	47.3	174.7	-54.4	-49.6	0	0	0	113.3	R3067 E3096 N3170	R3067-D3094 IonicContact CZ-OD1 3.36Å; R3067-D3094 IonicContact NH2-OD1 3.64Å; R3067-D3094 PolarHBondContact NH2-OD1 3.01Å; R3067-D3094 IonicContact NH2-OD2 3.82Å; D3094-E3096 VanDerWaalsContact C-N 3.31Å; D3094-E3096 PolarHBondContact O-N 3.31Å; D3094-N3170 PolarHBondContact N-ND2 3.32Å; D3094-N3170 PolarHBondContact OD1-ND2 3.47Å
3095	N	77.7	Confident	85.3	Confident	147 Å²	147	36 Å²	36	79%	0.786	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.2	-5.8	-173.4	-64.3	-14.3	0	0	0	118.1	M3092 I3093	M3092-N3095 WeakPolarHBondContact CE-O 3.49Å; I3093-N3095 PolarHBondContact O-N 3.24Å; I3093-N3095 VanDerWaalsContact O-N 3.1Å
3096	E	81.4	Confident	85.2	Confident	105 Å²	105	36.4 Å²	36.4	49%	0.491	19%	0.192	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	142	168.3	-64.7	-178.2	178.8	0	0	112.4	M3092 I3093 D3094	M3092-E3096 CarbonylContact C-O 3.59Å; M3092-E3096 VanDerWaalsContact CA-O 3.3Å; M3092-E3096 WeakPolarHBondContact CA-O 3.34Å; I3093-E3096 PolarHBondContact N-O 3.25Å; I3093-E3096 WeakPolarHBondContact O-CA 3.41Å; I3093-E3096 WeakPolarHBondContact O-CB 3.15Å; I3093-E3096 PolarHBondContact O-N 2.97Å; D3094-E3096 VanDerWaalsContact C-N 3.31Å; D3094-E3096 PolarHBondContact O-N 3.31Å
3097	M	84.1	Confident	83.9	Confident	54 Å²	54	39.3 Å²	39.3	27%	0.266	20%	0.199	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	122.2	172.9	-177.9	-80.4	-68.5	0	0	110.6	D3090 M3092 R3100 R3124	D3090-M3097 HydrophobicContact CB-CG 3.94Å; M3092-M3097 HydrophobicContact CE-CB 4.14Å; M3092-M3097 HydrophobicContact SD-CB 3.94Å; M3092-M3097 HydrophobicContact SD-CG 4.32Å; M3097-R3100 HydrophobicContact CE-CB 4.24Å; M3097-R3100 HydrophobicContact SD-CB 3.9Å; M3097-R3124 HydrophobicContact CE-CB 4.49Å; M3097-R3124 PolarHBondContact O-NH1 2.66Å; M3097-R3124 HydrophobicContact SD-CB 4.35Å
3098	V	84	Confident	81.5	Confident	29 Å²	29	47 Å²	47	18%	0.176	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	-22.2	-178.9	-62.3	0	0	0	0	114.2	F3091 I3093 V3162 V3169	F3091-V3098 HydrophobicContact CB-CG2 4.35Å; F3091-V3098 WeakPolarHBondContact O-CG2 3.32Å; F3091-V3098 PolarHBondContact O-N 2.81Å; I3093-V3098 HydrophobicContact CB-CG1 4.02Å; I3093-V3098 HydrophobicContact CD1-CG1 3.88Å; I3093-V3098 HydrophobicContact CD1-CG2 4.15Å; I3093-V3098 HydrophobicContact CG1-CG1 3.82Å; I3093-V3098 HydrophobicContact CG1-CG2 3.93Å; V3098-V3162 HydrophobicContact CG2-CG1 4.46Å; V3098-V3169 HydrophobicContact CG2-CG2 4.2Å
3099	L	86	Confident	79	Confident	3 Å²	3	50.4 Å²	50.4	2%	0.016	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	133	171.7	173.8	65.9	0	0	0	109	D3090 F3091 V3101 L3120 I3149 Y3160	D3090-L3099 CarbonylContact C-O 3.53Å; D3090-L3099 WeakPolarHBondContact CA-O 3.04Å; F3091-L3099 HydrophobicContact CB-CB 4.25Å; F3091-L3099 HydrophobicContact CD2-CB 4.21Å; F3091-L3099 HydrophobicContact CD2-CD2 4.09Å; F3091-L3099 HydrophobicContact CD2-CG 4.17Å; F3091-L3099 HydrophobicContact CE2-CD2 4.39Å; F3091-L3099 PolarHBondContact N-O 2.83Å; L3099-V3101 HydrophobicContact CD1-CG2 4.34Å; L3099-V3101 HydrophobicContact CD2-CG2 4Å; L3099-V3101 HydrophobicContact CG-CG2 3.98Å; L3099-L3120 HydrophobicContact CD1-CD1 3.85Å; L3099-L3120 HydrophobicContact CD1-CD2 4.47Å; L3099-I3149 HydrophobicContact CD2-CD1 3.87Å; L3099-Y3160 HydrophobicContact CD1-CD1 4.33Å; L3099-Y3160 HydrophobicContact CD2-CD1 3.84Å; L3099-Y3160 HydrophobicContact CD2-CD2 3.82Å; L3099-Y3160 HydrophobicContact CD2-CE1 4.36Å; L3099-Y3160 HydrophobicContact CD2-CE2 4.36Å; L3099-Y3160 HydrophobicContact CD2-CG 3.53Å
3100	R	88.3	Confident	76.3	Confident	83 Å²	83	58.2 Å²	58.2	31%	0.313	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	126.7	168.9	167.9	169.6	-69.7	164.8	1	109	D3090 M3097 Q3102 R3124 V3125 D3126	D3090-R3100 VanDerWaalsContact OD1-CG 3.3Å; D3090-R3100 WeakPolarHBondContact OD1-CG 3.2Å; D3090-R3100 IonicContact OD1-CZ 2.8Å; D3090-R3100 IonicContact OD1-NE 3.47Å; D3090-R3100 PolarHBondContact OD1-NE 2.86Å; D3090-R3100 IonicContact OD1-NH2 2.8Å; D3090-R3100 IonicContact OD2-CZ 3.68Å; D3090-R3100 IonicContact OD2-NE 2.97Å; D3090-R3100 PolarHBondContact OD2-NE 2.86Å; D3090-R3100 IonicContact OD2-NH2 3.76Å; D3090-R3100 PolarHBondContact OD2-NH2 2.86Å; M3097-R3100 HydrophobicContact CE-CB 4.24Å; M3097-R3100 HydrophobicContact SD-CB 3.9Å; R3100-Q3102 HydrophobicContact CG-CG 4.09Å; R3100-R3124 PolarHBondContact N-O 3.38Å; R3100-V3125 HydrophobicContact CB-CG2 4.18Å; R3100-V3125 HydrophobicContact CG-CG1 4.35Å; R3100-V3125 HydrophobicContact CG-CG2 4.46Å; R3100-V3125 CarbonylContact O-C 3.47Å; R3100-V3125 WeakPolarHBondContact O-CA 3.16Å; R3100-D3126 PolarHBondContact O-N 3Å
3101	V	89	Confident	73.6	Confident	1 Å²	1	65 Å²	65	1%	0.006	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	106.2	171.1	-175.8	0	0	0	0	108.5	S3088 I3089 F3091 L3099 D3126 I3151 Y3160	S3088-V3101 WeakPolarHBondContact CA-O 3.2Å; I3089-V3101 PolarHBondContact N-O 3.26Å; I3089-V3101 PolarHBondContact O-N 3.19Å; F3091-V3101 HydrophobicContact CE2-CG2 4.19Å; L3099-V3101 HydrophobicContact CD1-CG2 4.34Å; L3099-V3101 HydrophobicContact CD2-CG2 4Å; L3099-V3101 HydrophobicContact CG-CG2 3.98Å; V3101-D3126 CarbonylContact C-O 3.52Å; V3101-D3126 WeakPolarHBondContact CA-O 3.47Å; V3101-I3151 HydrophobicContact CB-CD1 4.01Å; V3101-I3151 HydrophobicContact CG1-CD1 4.11Å; V3101-I3151 HydrophobicContact CG2-CD1 3.69Å; V3101-Y3160 HydrophobicContact CG2-CE1 4.4Å; V3101-Y3160 HydrophobicContact CG2-CE2 4.16Å
3102	Q	86.5	Confident	70.7	Confident	64 Å²	64	68 Å²	68	30%	0.299	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	135.7	176.6	-73.6	173.4	-46.9	0	0	110.5	F3087 R3100 D3126 T3127 M3128	F3087-Q3102 CarbonylContact O-C 3.6Å; F3087-Q3102 WeakPolarHBondContact O-CA 3.12Å; R3100-Q3102 HydrophobicContact CG-CG 4.09Å; Q3102-D3126 PolarHBondContact N-O 3.42Å; Q3102-T3127 HydrophobicContact CB-CG2 4.37Å; Q3102-T3127 CarbonylContact O-C 3.53Å; Q3102-T3127 WeakPolarHBondContact O-CA 3.42Å; Q3102-M3128 PolarHBondContact O-N 3.28Å
3103	G	87.2	Confident	68.1	Low	0 Å²	0	75.6 Å²	75.6	0%	0	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	126.4	167.7	0	0	0	0	0	110.1	T3086 F3087 M3128	T3086-G3103 CarbonylContact C-O 3.57Å; T3086-G3103 WeakPolarHBondContact CA-O 3.41Å; F3087-G3103 WeakPolarHBondContact CD1-O 3.35Å; F3087-G3103 PolarHBondContact N-O 2.89Å; F3087-G3103 PolarHBondContact O-N 3.48Å; G3103-M3128 CarbonylContact C-O 3.53Å; G3103-M3128 WeakPolarHBondContact CA-O 3.36Å
3104	T	82.3	Confident	65.5	Low	36 Å²	36	82.4 Å²	82.4	22%	0.221	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	131.7	-174.8	-52.7	0	0	0	0	110.4	G3085 T3086 A3106 T3127 M3128 L3129 I3130	G3085-T3104 WeakPolarHBondContact O-CA 3.11Å; T3086-T3104 HydrophobicContact CG2-CG2 4.01Å; T3104-A3106 PolarHBondContact O-N 2.86Å; T3104-T3127 WeakPolarHBondContact OG1-CG2 3.44Å; T3104-M3128 PolarHBondContact N-O 2.87Å; T3104-L3129 WeakPolarHBondContact O-CA 3.2Å; T3104-I3130 PolarHBondContact O-N 3.41Å
3105	L	78.6	Confident	63.1	Low	15 Å²	15	88 Å²	88	8%	0.079	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	123.8	178.5	-175.3	59.3	0	0	0	110.8	F3080 G3085 K3107 E3132 E3134	F3080-L3105 HydrophobicContact CB-CD2 4.33Å; F3080-L3105 HydrophobicContact CD1-CB 4.15Å; F3080-L3105 HydrophobicContact CD2-CB 4.21Å; F3080-L3105 HydrophobicContact CD2-CD1 3.84Å; F3080-L3105 HydrophobicContact CD2-CD2 4.5Å; F3080-L3105 HydrophobicContact CD2-CG 4.41Å; F3080-L3105 HydrophobicContact CE1-CB 3.99Å; F3080-L3105 HydrophobicContact CE2-CB 4.06Å; F3080-L3105 HydrophobicContact CE2-CD1 4.04Å; F3080-L3105 HydrophobicContact CG-CB 4.25Å; F3080-L3105 HydrophobicContact CG-CD1 4.4Å; F3080-L3105 HydrophobicContact CG-CD2 4.25Å; F3080-L3105 HydrophobicContact CZ-CB 3.94Å; G3085-L3105 PolarHBondContact O-N 2.79Å; L3105-K3107 VanDerWaalsContact C-N 3.27Å; L3105-K3107 HydrophobicContact CD2-CG 4.49Å; L3105-K3107 HydrophobicContact CG-CG 4.38Å; L3105-K3107 PolarHBondContact O-N 2.87Å; L3105-E3132 WeakPolarHBondContact CD1-O 3.15Å; L3105-E3134 HydrophobicContact CD2-CG 3.74Å
3106	A	73.4	Confident	61	Low	39 Å²	39	89.5 Å²	89.5	32%	0.322	46%	0.461	S	S	.	.			trans	-79.3	62.9	-172.1	0	0	0	0	0	114	T3104 N3108 L3129 I3130 K3131	T3104-A3106 PolarHBondContact O-N 2.86Å; A3106-N3108 PolarHBondContact O-N 2.76Å; A3106-L3129 HydrophobicContact CB-CD2 4.45Å; A3106-I3130 VanDerWaalsContact CB-O 3.26Å; A3106-I3130 WeakPolarHBondContact CB-O 3.35Å; A3106-I3130 PolarHBondContact N-O 2.87Å; A3106-K3131 HydrophobicContact CB-CG 4.38Å
3107	K	57.9	Low	58.5	Low	119 Å²	119	89.2 Å²	89.2	52%	0.517	48%	0.476	S	S	.	.			trans	-70	124.9	170.2	-68.1	-178.7	176.6	176.3	0	110.3	L3105 S3109 E3134	L3105-K3107 VanDerWaalsContact C-N 3.27Å; L3105-K3107 HydrophobicContact CD2-CG 4.49Å; L3105-K3107 HydrophobicContact CG-CG 4.38Å; L3105-K3107 PolarHBondContact O-N 2.87Å; K3107-S3109 VanDerWaalsContact C-N 3.29Å; K3107-S3109 PolarHBondContact O-N 2.85Å; K3107-E3134 WeakPolarHBondContact CE-OE1 3.15Å; K3107-E3134 IonicContact NZ-OE1 3.23Å; K3107-E3134 PolarHBondContact NZ-OE1 2.93Å
3108	N	41.9	Very low	56.1	Low	166 Å²	166	94 Å²	94	89%	0.888	50%	0.502	S	S	*	.	S	Bend	trans	57.3	-2.5	165.8	-61	1	0	0	0	120.9	A3106 L3110	A3106-N3108 PolarHBondContact O-N 2.76Å; N3108-L3110 PolarHBondContact O-N 3.49Å
3109	S	37.4	Very low	53.6	Low	81 Å²	81	104 Å²	104	57%	0.566	54%	0.537	S	S	*	.			trans	-78.7	103.4	173.4	-173.5	0	0	0	0	112.4	K3107	K3107-S3109 VanDerWaalsContact C-N 3.29Å; K3107-S3109 PolarHBondContact O-N 2.85Å
3110	L	35.3	Very low	51.1	Low	165 Å²	165	107.1 Å²	107.1	86%	0.864	55%	0.553	S	S	*	*			trans	-84.7	-15.6	-177.8	-147.3	127.9	0	0	0	113.7	N3108	N3108-L3110 PolarHBondContact O-N 3.49Å
3111	N	33.3	Very low	48.9	Very low	151 Å²	151	112.4 Å²	112.4	81%	0.807	58%	0.578	S	S	*	*			trans	-127.8	89	-175.8	-80.2	-39.9	0	0	0	112.1
3112	A	29.2	Very low	47.1	Very low	61 Å²	61	120.4 Å²	120.4	50%	0.504	62%	0.615	S	S	.	*			trans	-141.8	89.1	174.4	0	0	0	0	0	111.6	L3129	A3112-L3129 HydrophobicContact CB-CD1 4.21Å
3113	E	30.8	Very low	45.4	Very low	180 Å²	180	123.7 Å²	123.7	84%	0.841	64%	0.635	S	S	*	*			trans	-74.2	138.7	172.2	-73	-160.8	125.7	0	0	112.2	K3115	E3113-K3115 PolarHBondContact O-N 2.87Å
3114	N	30.8	Very low	44.6	Very low	154 Å²	154	129.7 Å²	129.7	82%	0.824	66%	0.658	S	S	*	*			trans	-69.6	93.3	179.5	-67.6	-73.4	0	0	0	112
3115	K	30.6	Very low	44.4	Very low	196 Å²	196	131 Å²	131	85%	0.852	67%	0.666	S	S	*	*			trans	-78.2	152	169.9	-80.2	177.4	178.7	168.2	0	112.2	E3113	E3113-K3115 PolarHBondContact O-N 2.87Å
3116	H	32.4	Very low	44.5	Very low	178 Å²	178	132.1 Å²	132.1	82%	0.824	67%	0.672	S	S	*	*			trans	-81.6	139.7	-163.2	-76.2	-92.2	0	0	0	114.9	L3118	H3116-L3118 PolarHBondContact O-N 2.82Å
3117	A	30.5	Very low	44.7	Very low	99 Å²	99	133.4 Å²	133.4	82%	0.818	68%	0.675	S	S	*	*			trans	30.5	76.5	140.5	0	0	0	0	0	116.8	R3119	A3117-R3119 PolarHBondContact O-N 2.82Å
3118	L	32.3	Very low	45.8	Very low	154 Å²	154	128.2 Å²	128.2	81%	0.806	65%	0.653	S	S	*	*			trans	-62	133.2	164.8	-83	123.1	0	0	0	110.7	H3116 L3120	H3116-L3118 PolarHBondContact O-N 2.82Å; L3118-L3120 PolarHBondContact O-N 3.34Å
3119	R	32.1	Very low	47.5	Very low	239 Å²	239	124.4 Å²	124.4	90%	0.902	63%	0.632	S	S	*	*			trans	-75	105.3	158.8	-86.7	178.6	160.6	176.1	-8.3	107.4	A3117 K3121	A3117-R3119 PolarHBondContact O-N 2.82Å; R3119-K3121 PolarHBondContact O-N 3.04Å
3120	L	34.5	Very low	49.5	Very low	69 Å²	69	120.5 Å²	120.5	36%	0.361	61%	0.605	S	S	.	*			trans	-55.8	119.2	169.5	-64	164.5	0	0	0	109	L3099 L3118 N3123 Y3160	L3099-L3120 HydrophobicContact CD1-CD1 3.85Å; L3099-L3120 HydrophobicContact CD1-CD2 4.47Å; L3118-L3120 PolarHBondContact O-N 3.34Å; L3120-N3123 VanDerWaalsContact CD2-O 3.23Å; L3120-N3123 WeakPolarHBondContact CD2-O 3.29Å; L3120-Y3160 HydrophobicContact CD1-CD1 4.25Å
3121	K	41.6	Very low	51.3	Low	194 Å²	194	121.1 Å²	121.1	84%	0.843	60%	0.601	S	S	*	*	S	Bend	trans	-136.5	-33.6	169.7	-106.1	-154.2	167.7	-156.1	0	113.8	R3119	R3119-K3121 PolarHBondContact O-N 3.04Å
3122	E	49.8	Very low	52.9	Low	168 Å²	168	116.8 Å²	116.8	79%	0.785	58%	0.576	S	S	*	*	S	Bend	trans	-114.9	-68.5	175.7	-74.1	126.6	-139.6	0	0	111.4	R3124	E3122-R3124 PolarHBondContact O-N 2.97Å
3123	N	52.7	Low	54.5	Low	133 Å²	133	118.1 Å²	118.1	71%	0.711	58%	0.578	S	S	*	*			trans	-74.4	109.9	-178.2	-69.3	-11	0	0	0	112.1	L3120 V3125	L3120-N3123 VanDerWaalsContact CD2-O 3.23Å; L3120-N3123 WeakPolarHBondContact CD2-O 3.29Å; N3123-V3125 PolarHBondContact O-N 2.82Å
3124	R	69.3	Low	56.4	Low	127 Å²	127	112 Å²	112	48%	0.479	55%	0.549	S	S	.	.			trans	-72	23	173.1	-62.8	-175	-179	-174.9	2.5	113.8	M3097 R3100 E3122	M3097-R3124 HydrophobicContact CE-CB 4.49Å; M3097-R3124 PolarHBondContact O-NH1 2.66Å; M3097-R3124 HydrophobicContact SD-CB 4.35Å; R3100-R3124 PolarHBondContact N-O 3.38Å; E3122-R3124 PolarHBondContact O-N 2.97Å
3125	V	77.4	Confident	58.4	Low	64 Å²	64	108.4 Å²	108.4	39%	0.388	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	131.7	-170.3	-178.2	0	0	0	0	110.2	R3100 N3123	R3100-V3125 HydrophobicContact CB-CG2 4.18Å; R3100-V3125 HydrophobicContact CG-CG1 4.35Å; R3100-V3125 HydrophobicContact CG-CG2 4.46Å; R3100-V3125 CarbonylContact O-C 3.47Å; R3100-V3125 WeakPolarHBondContact O-CA 3.16Å; N3123-V3125 PolarHBondContact O-N 2.82Å
3126	D	80.8	Confident	60.6	Low	38 Å²	38	103.8 Å²	103.8	20%	0.203	51%	0.51	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	156.1	170.9	179.2	29.5	0	0	0	110.2	R3100 V3101 Q3102 R3158 Y3160	R3100-D3126 PolarHBondContact O-N 3Å; V3101-D3126 CarbonylContact C-O 3.52Å; V3101-D3126 WeakPolarHBondContact CA-O 3.47Å; Q3102-D3126 PolarHBondContact N-O 3.42Å; D3126-R3158 IonicContact OD1-NH1 2.75Å; D3126-R3158 PolarHBondContact OD1-NH1 3Å; D3126-R3158 IonicContact OD2-CZ 3.6Å; D3126-R3158 IonicContact OD2-NH1 3.42Å; D3126-R3158 PolarHBondContact OD2-NH1 2.58Å; D3126-Y3160 HydrophobicContact CB-CE1 4.06Å; D3126-Y3160 WeakPolarHBondContact OD2-CE1 3.35Å; D3126-Y3160 PolarHBondContact OD2-OH 2.93Å
3127	T	77.9	Confident	62.9	Low	65 Å²	65	98.5 Å²	98.5	40%	0.399	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	129.6	-172.2	-45.2	0	0	0	0	111.9	Q3102 T3104 R3158	Q3102-T3127 HydrophobicContact CB-CG2 4.37Å; Q3102-T3127 CarbonylContact O-C 3.53Å; Q3102-T3127 WeakPolarHBondContact O-CA 3.42Å; T3104-T3127 WeakPolarHBondContact OG1-CG2 3.44Å; T3127-R3158 VanDerWaalsContact O-CZ 3.32Å; T3127-R3158 PolarHBondContact O-NH1 3.26Å; T3127-R3158 PolarHBondContact O-NH2 2.72Å
3128	M	82.1	Confident	65.4	Low	11 Å²	11	94 Å²	94	5%	0.054	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	111.8	-175.2	-176.4	164.2	72.6	0	0	111	Q3102 G3103 T3104 I3130 V3140 I3151	Q3102-M3128 PolarHBondContact O-N 3.28Å; G3103-M3128 CarbonylContact C-O 3.53Å; G3103-M3128 WeakPolarHBondContact CA-O 3.36Å; T3104-M3128 PolarHBondContact N-O 2.87Å; M3128-I3130 HydrophobicContact CE-CD1 3.92Å; M3128-I3130 HydrophobicContact CG-CD1 4.1Å; M3128-I3130 PolarHBondContact O-N 3.15Å; M3128-V3140 HydrophobicContact CE-CG1 4.33Å; M3128-I3151 HydrophobicContact CE-CG2 4.37Å
3129	L	77.3	Confident	67.9	Low	85 Å²	85	89.2 Å²	89.2	45%	0.445	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	122.8	175.6	-69.4	169.9	0	0	0	110.8	T3104 A3106 A3112	T3104-L3129 WeakPolarHBondContact O-CA 3.2Å; A3106-L3129 HydrophobicContact CB-CD2 4.45Å; A3112-L3129 HydrophobicContact CB-CD1 4.21Å
3130	I	79.1	Confident	70.6	Confident	0 Å²	0	77.9 Å²	77.9	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	127.3	177.6	-51.6	-58	0	0	0	109	F3080 F3087 T3104 A3106 M3128 E3132 F3138 Y3153	F3080-I3130 HydrophobicContact CE2-CB 3.82Å; F3080-I3130 HydrophobicContact CE2-CG1 3.94Å; F3080-I3130 HydrophobicContact CE2-CG2 3.91Å; F3080-I3130 HydrophobicContact CZ-CB 4.28Å; F3080-I3130 HydrophobicContact CZ-CG1 4.04Å; F3087-I3130 HydrophobicContact CE1-CG1 4.2Å; T3104-I3130 PolarHBondContact O-N 3.41Å; A3106-I3130 VanDerWaalsContact CB-O 3.26Å; A3106-I3130 WeakPolarHBondContact CB-O 3.35Å; A3106-I3130 PolarHBondContact N-O 2.87Å; M3128-I3130 HydrophobicContact CE-CD1 3.92Å; M3128-I3130 HydrophobicContact CG-CD1 4.1Å; M3128-I3130 PolarHBondContact O-N 3.15Å; I3130-E3132 HydrophobicContact CG2-CB 4.18Å; I3130-E3132 HydrophobicContact CG2-CG 4.3Å; I3130-F3138 HydrophobicContact CD1-CE2 4.34Å; I3130-F3138 HydrophobicContact CG1-CE2 4.46Å; I3130-F3138 HydrophobicContact CG1-CZ 4.46Å; I3130-F3138 HydrophobicContact CG2-CD1 4.34Å; I3130-F3138 HydrophobicContact CG2-CD2 4.34Å; I3130-F3138 HydrophobicContact CG2-CE1 4.16Å; I3130-F3138 HydrophobicContact CG2-CE2 4.16Å; I3130-F3138 HydrophobicContact CG2-CG 4.44Å; I3130-F3138 HydrophobicContact CG2-CZ 4.07Å; I3130-Y3153 HydrophobicContact CD1-CD1 3.96Å; I3130-Y3153 HydrophobicContact CD1-CD2 4.29Å; I3130-Y3153 HydrophobicContact CD1-CE1 4.06Å; I3130-Y3153 HydrophobicContact CD1-CE2 4.38Å; I3130-Y3153 HydrophobicContact CD1-CG 4.09Å; I3130-Y3153 HydrophobicContact CG2-CE1 4.3Å; I3130-Y3153 HydrophobicContact CG2-CE2 3.98Å; I3130-Y3153 WeakPolarHBondContact CG2-OH 3.38Å
3131	K	72.9	Confident	73.1	Confident	177 Å²	177	75 Å²	75	77%	0.77	37%	0.371	S	S	*	.			trans	-103.4	67.3	179.2	-69.2	-165.9	174.2	-166.1	0	110.5	A3106 Y3153	A3106-K3131 HydrophobicContact CB-CG 4.38Å; K3131-Y3153 PolarHBondContact N-OH 3.21Å; K3131-Y3153 VanDerWaalsContact N-OH 3.13Å
3132	E	67.3	Low	75.3	Confident	61 Å²	61	65.8 Å²	65.8	29%	0.285	33%	0.331	S	S	.	.			trans	-134.4	177	173.9	-73.5	-65.8	-178.3	0	0	110.5	L3105 I3130 K3136 F3138	L3105-E3132 WeakPolarHBondContact CD1-O 3.15Å; I3130-E3132 HydrophobicContact CG2-CB 4.18Å; I3130-E3132 HydrophobicContact CG2-CG 4.3Å; E3132-K3136 IonicContact OE1-NZ 3.7Å; E3132-K3136 VanDerWaalsContact OE2-CD 3.3Å; E3132-K3136 WeakPolarHBondContact OE2-CD 3.21Å; E3132-K3136 VanDerWaalsContact OE2-CE 3.26Å; E3132-K3136 WeakPolarHBondContact OE2-CE 3.28Å; E3132-K3136 IonicContact OE2-NZ 2.68Å; E3132-K3136 PolarHBondContact OE2-NZ 3.16Å; E3132-F3138 HydrophobicContact CG-CB 4.14Å; E3132-F3138 HydrophobicContact CG-CD1 4.43Å; E3132-F3138 HydrophobicContact CG-CG 4.49Å
3133	T	63.6	Low	77	Confident	88 Å²	88	58 Å²	58	54%	0.54	29%	0.294	S	S	.	.			trans	-97.6	162.1	173.3	57.3	0	0	0	0	111.3	K3136	T3133-K3136 PolarHBondContact O-N 3.1Å; T3133-K3136 WeakPolarHBondContact OG1-CB 3.13Å
3134	E	69.9	Low	78.6	Confident	51 Å²	51	52 Å²	52	24%	0.238	26%	0.262	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.1	151.8	171	-65.4	-177.8	-165.7	0	0	111.8	Q3082 N3083 L3105 K3107 K3136	Q3082-E3134 VanDerWaalsContact CA-OE2 3.3Å; Q3082-E3134 WeakPolarHBondContact CA-OE2 3.47Å; N3083-E3134 PolarHBondContact N-OE2 2.67Å; L3105-E3134 HydrophobicContact CD2-CG 3.74Å; K3107-E3134 WeakPolarHBondContact CE-OE1 3.15Å; K3107-E3134 IonicContact NZ-OE1 3.23Å; K3107-E3134 PolarHBondContact NZ-OE1 2.93Å; E3134-K3136 PolarHBondContact O-N 3.16Å
3135	N	72	Confident	79.2	Confident	80 Å²	80	46.8 Å²	46.8	43%	0.428	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	-2	-176.9	-64.9	-24	0	0	0	116.8	F3080	F3080-N3135 PolarHBondContact O-N 3.16Å; F3080-N3135 PolarHBondContact O-OD1 3.38Å
3136	K	77.8	Confident	79.2	Confident	98 Å²	98	51.8 Å²	51.8	43%	0.426	26%	0.255	S	S	.	.			trans	-87.8	123.2	178.2	-173.3	177.8	167.6	-153.3	0	111.1	E3132 T3133 E3134	E3132-K3136 IonicContact OE1-NZ 3.7Å; E3132-K3136 VanDerWaalsContact OE2-CD 3.3Å; E3132-K3136 WeakPolarHBondContact OE2-CD 3.21Å; E3132-K3136 VanDerWaalsContact OE2-CE 3.26Å; E3132-K3136 WeakPolarHBondContact OE2-CE 3.28Å; E3132-K3136 IonicContact OE2-NZ 2.68Å; E3132-K3136 PolarHBondContact OE2-NZ 3.16Å; T3133-K3136 PolarHBondContact O-N 3.1Å; T3133-K3136 WeakPolarHBondContact OG1-CB 3.13Å; E3134-K3136 PolarHBondContact O-N 3.16Å
3137	P	81.2	Confident	78.9	Confident	67 Å²	67	52.6 Å²	52.6	44%	0.435	26%	0.263	S	S	.	.			trans	-75.1	139.5	-177.6	29	-34.3	0	0	0	112.8	L3078	L3078-P3137 CarbonylContact O-C 3.58Å; L3078-P3137 VanDerWaalsContact O-CA 3.26Å; L3078-P3137 WeakPolarHBondContact O-CA 3.2Å
3138	F	83.2	Confident	79.1	Confident	6 Å²	6	51.8 Å²	51.8	3%	0.026	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	152.8	177	63.1	-89.4	0	0	0	111	L3078 F3080 F3087 I3130 E3132 V3140 Y3153	L3078-F3138 HydrophobicContact CB-CD2 4.36Å; L3078-F3138 HydrophobicContact CB-CE1 4.14Å; L3078-F3138 HydrophobicContact CB-CE2 3.83Å; L3078-F3138 HydrophobicContact CB-CZ 3.69Å; L3078-F3138 HydrophobicContact CD1-CE2 4.06Å; L3078-F3138 HydrophobicContact CD1-CZ 4.37Å; L3078-F3138 PolarHBondContact N-O 2.86Å; L3078-F3138 WeakPolarHBondContact O-CD1 3.48Å; L3078-F3138 PolarHBondContact O-N 3.38Å; F3080-F3138 AromaticContact CD2-CE1 3.72Å; F3080-F3138 HydrophobicContact CD2-CE1 3.72Å; F3080-F3138 HydrophobicContact CD2-CZ 4.15Å; F3080-F3138 AromaticContact CE2-CE1 3.78Å; F3080-F3138 HydrophobicContact CE2-CE1 3.78Å; F3080-F3138 AromaticContact CE2-CZ 3.78Å; F3080-F3138 HydrophobicContact CE2-CZ 3.78Å; F3087-F3138 HydrophobicContact CE1-CE2 4.22Å; F3087-F3138 AromaticContact CE1-CZ 3.83Å; F3087-F3138 HydrophobicContact CE1-CZ 3.83Å; F3087-F3138 HydrophobicContact CZ-CE2 4.21Å; F3087-F3138 HydrophobicContact CZ-CZ 4.27Å; I3130-F3138 HydrophobicContact CD1-CE2 4.34Å; I3130-F3138 HydrophobicContact CG1-CE2 4.46Å; I3130-F3138 HydrophobicContact CG1-CZ 4.46Å; I3130-F3138 HydrophobicContact CG2-CD1 4.34Å; I3130-F3138 HydrophobicContact CG2-CD2 4.34Å; I3130-F3138 HydrophobicContact CG2-CE1 4.16Å; I3130-F3138 HydrophobicContact CG2-CE2 4.16Å; I3130-F3138 HydrophobicContact CG2-CG 4.44Å; I3130-F3138 HydrophobicContact CG2-CZ 4.07Å; E3132-F3138 HydrophobicContact CG-CB 4.14Å; E3132-F3138 HydrophobicContact CG-CD1 4.43Å; E3132-F3138 HydrophobicContact CG-CG 4.49Å; F3138-V3140 HydrophobicContact CD2-CG2 3.91Å; F3138-V3140 HydrophobicContact CE2-CG2 3.79Å; F3138-Y3153 HydrophobicContact CB-CE2 4.18Å; F3138-Y3153 HydrophobicContact CD2-CD2 4.01Å; F3138-Y3153 AromaticContact CD2-CE2 3.88Å; F3138-Y3153 HydrophobicContact CD2-CE2 3.88Å; F3138-Y3153 HydrophobicContact CG-CE2 4.24Å
3139	D	84.9	Confident	79.2	Confident	53 Å²	53	51.3 Å²	51.3	28%	0.283	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	135.6	-174.8	-46.7	-84.6	0	0	0	111.4	M3075 L3076 K3077	M3075-D3139 HydrophobicContact CE-CB 3.66Å; M3075-D3139 HydrophobicContact SD-CB 4.05Å; L3076-D3139 CarbonylContact O-C 3.55Å; L3076-D3139 WeakPolarHBondContact O-CA 3.04Å; K3077-D3139 WeakPolarHBondContact CE-OD1 3.4Å; K3077-D3139 WeakPolarHBondContact CG-OD1 3.3Å; K3077-D3139 IonicContact NZ-OD1 3.78Å; K3077-D3139 PolarHBondContact NZ-OD1 2.81Å; K3077-D3139 IonicContact NZ-OD2 3.73Å
3140	V	87.2	Confident	79.6	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	121	177.1	-179.6	0	0	0	0	109.2	L3076 L3078 I3089 M3128 F3138 I3151 Y3153	L3076-V3140 HydrophobicContact CB-CB 4.5Å; L3076-V3140 PolarHBondContact N-O 3.24Å; L3076-V3140 PolarHBondContact O-N 3.21Å; L3078-V3140 HydrophobicContact CD1-CG2 4.05Å; I3089-V3140 HydrophobicContact CD1-CG1 4.2Å; M3128-V3140 HydrophobicContact CE-CG1 4.33Å; F3138-V3140 HydrophobicContact CD2-CG2 3.91Å; F3138-V3140 HydrophobicContact CE2-CG2 3.79Å; V3140-I3151 HydrophobicContact CG1-CG2 3.87Å; V3140-Y3153 HydrophobicContact CG2-CD2 4.38Å
3141	L	87.1	Confident	79.9	Confident	10 Å²	10	47.4 Å²	47.4	5%	0.052	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	119	179.3	179.1	60	0	0	0	110.5	I3040 V3043 F3073 M3075 I3143 I3151 T3152	I3040-L3141 HydrophobicContact CG1-CD2 4.05Å; V3043-L3141 HydrophobicContact CG2-CD1 4.26Å; F3073-L3141 HydrophobicContact CB-CD1 4.47Å; F3073-L3141 HydrophobicContact CD2-CD1 4.34Å; M3075-L3141 HydrophobicContact CB-CD1 4.28Å; M3075-L3141 HydrophobicContact CE-CB 4.38Å; M3075-L3141 HydrophobicContact SD-CB 3.68Å; M3075-L3141 HydrophobicContact SD-CD1 4.21Å; M3075-L3141 HydrophobicContact SD-CG 4.48Å; L3141-I3143 HydrophobicContact CD1-CG1 4.34Å; L3141-I3143 HydrophobicContact CD2-CD1 4.18Å; L3141-I3143 HydrophobicContact CD2-CG1 4.45Å; L3141-I3143 HydrophobicContact CG-CD1 4.33Å; L3141-I3143 HydrophobicContact CG-CG1 4.08Å; L3141-I3151 WeakPolarHBondContact O-CA 3.19Å; L3141-T3152 HydrophobicContact CB-CG2 3.82Å; L3141-T3152 HydrophobicContact CD2-CG2 4.32Å; L3141-T3152 HydrophobicContact CG-CG2 4.4Å; L3141-T3152 PolarHBondContact N-O 2.95Å; L3141-T3152 PolarHBondContact O-N 3.39Å
3142	V	88.6	Confident	80.2	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	133.9	172.6	-179.6	0	0	0	0	109.2	F3065 F3073 A3074 L3076 I3089 F3091 Y3150 I3151 I3172	F3065-V3142 HydrophobicContact CZ-CG1 4.33Å; F3073-V3142 CarbonylContact C-O 3.52Å; F3073-V3142 WeakPolarHBondContact CA-O 3.18Å; F3073-V3142 WeakPolarHBondContact CB-O 3.36Å; A3074-V3142 PolarHBondContact N-O 3.04Å; A3074-V3142 PolarHBondContact O-N 2.96Å; L3076-V3142 HydrophobicContact CD1-CG2 4.18Å; I3089-V3142 HydrophobicContact CD1-CG2 4.33Å; F3091-V3142 HydrophobicContact CE1-CG1 3.55Å; F3091-V3142 HydrophobicContact CZ-CG1 3.66Å; V3142-Y3150 CarbonylContact C-O 3.49Å; V3142-Y3150 WeakPolarHBondContact CA-O 3.45Å; V3142-I3151 HydrophobicContact CG2-CG1 4.41Å; V3142-I3172 HydrophobicContact CB-CD1 4.38Å; V3142-I3172 HydrophobicContact CG1-CD1 4.39Å; V3142-I3172 HydrophobicContact CG2-CD1 4.25Å
3143	I	85.8	Confident	80.6	Confident	3 Å²	3	38.1 Å²	38.1	2%	0.015	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	124	174.6	-48.6	170	0	0	0	109.5	L3036 I3039 I3040 N3072 F3073 L3141 Y3150	L3036-I3143 HydrophobicContact CD2-CB 4.18Å; L3036-I3143 HydrophobicContact CD2-CD1 3.86Å; L3036-I3143 HydrophobicContact CD2-CG2 3.84Å; I3039-I3143 HydrophobicContact CB-CD1 4.12Å; I3039-I3143 HydrophobicContact CD1-CD1 4.44Å; I3039-I3143 HydrophobicContact CD1-CG2 3.6Å; I3039-I3143 HydrophobicContact CG2-CD1 3.69Å; I3039-I3143 HydrophobicContact CG2-CG1 4.05Å; I3040-I3143 HydrophobicContact CG1-CD1 4.37Å; N3072-I3143 CarbonylContact O-C 3.55Å; N3072-I3143 WeakPolarHBondContact O-CA 3.33Å; N3072-I3143 WeakPolarHBondContact O-CG2 3.2Å; F3073-I3143 HydrophobicContact CB-CB 4.31Å; F3073-I3143 HydrophobicContact CB-CG1 3.93Å; F3073-I3143 HydrophobicContact CB-CG2 4.26Å; L3141-I3143 HydrophobicContact CD1-CG1 4.34Å; L3141-I3143 HydrophobicContact CD2-CD1 4.18Å; L3141-I3143 HydrophobicContact CD2-CG1 4.45Å; L3141-I3143 HydrophobicContact CG-CD1 4.33Å; L3141-I3143 HydrophobicContact CG-CG1 4.08Å; I3143-Y3150 PolarHBondContact N-O 3.25Å; I3143-Y3150 PolarHBondContact O-N 3.17Å
3144	L	85.3	Confident	80.9	Confident	8 Å²	8	35.3 Å²	35.3	4%	0.042	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	106.7	170.1	178	71.4	0	0	0	109	F3065 A3071 N3072 R3146 R3148 I3149 V3169	F3065-L3144 HydrophobicContact CD2-CB 4.22Å; F3065-L3144 HydrophobicContact CD2-CD2 3.66Å; F3065-L3144 HydrophobicContact CE2-CB 3.99Å; F3065-L3144 HydrophobicContact CE2-CD2 4.18Å; F3065-L3144 HydrophobicContact CG-CD2 4.48Å; A3071-L3144 CarbonylContact C-O 3.59Å; A3071-L3144 VanDerWaalsContact CA-O 3.25Å; A3071-L3144 WeakPolarHBondContact CA-O 3.35Å; N3072-L3144 HydrophobicContact CB-CB 4.42Å; N3072-L3144 PolarHBondContact N-O 2.66Å; N3072-L3144 PolarHBondContact O-N 3.33Å; L3144-R3146 WeakPolarHBondContact CD1-O 3.32Å; L3144-R3148 WeakPolarHBondContact CA-O 3.32Å; L3144-I3149 HydrophobicContact CD1-CG1 3.9Å; L3144-V3169 HydrophobicContact CD1-CB 4.13Å; L3144-V3169 HydrophobicContact CD1-CG2 4.4Å; L3144-V3169 HydrophobicContact CD2-CB 3.85Å; L3144-V3169 HydrophobicContact CD2-CG1 4.24Å; L3144-V3169 WeakPolarHBondContact CD2-O 3.18Å
3145	Y	81.8	Confident	80.6	Confident	18 Å²	18	38 Å²	38	7%	0.071	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	104.1	172.6	-176.1	-87	0	0	0	109.1	E3032 T3035 V3070 A3071 S3147 R3148	E3032-Y3145 HydrophobicContact CB-CD1 4.11Å; E3032-Y3145 HydrophobicContact CB-CE1 3.58Å; E3032-Y3145 HydrophobicContact CG-CD1 3.55Å; E3032-Y3145 HydrophobicContact CG-CE1 3.58Å; E3032-Y3145 HydrophobicContact CG-CG 4.12Å; T3035-Y3145 HydrophobicContact CG2-CD2 4.11Å; T3035-Y3145 HydrophobicContact CG2-CE2 3.98Å; V3070-Y3145 HydrophobicContact CG1-CE2 3.85Å; A3071-Y3145 HydrophobicContact CB-CD2 4.09Å; Y3145-S3147 PolarHBondContact O-N 3.34Å; Y3145-S3147 VanDerWaalsContact O-N 3.16Å; Y3145-R3148 PolarHBondContact N-O 2.99Å; Y3145-R3148 PolarHBondContact O-N 3.2Å
3146	R	77.9	Confident	80.4	Confident	168 Å²	168	37 Å²	37	63%	0.634	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.1	-111.5	-172	-50.1	-178	-170.2	-165.7	2.6	111.8	L3144	L3144-R3146 WeakPolarHBondContact CD1-O 3.32Å
3147	S	74.6	Confident	80.3	Confident	55 Å²	55	33.9 Å²	33.9	39%	0.385	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	11.2	178.6	55.8	0	0	0	0	114	Y3145 V3162	Y3145-S3147 PolarHBondContact O-N 3.34Å; Y3145-S3147 VanDerWaalsContact O-N 3.16Å; S3147-V3162 PolarHBondContact O-N 2.96Å
3148	R	81.7	Confident	80.2	Confident	49 Å²	49	33.7 Å²	33.7	19%	0.185	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	131.7	-176.5	-69	167.5	170.6	-146.2	-22	111.6	E3032 L3144 Y3145 Y3150 Y3160 E3161	E3032-R3148 WeakPolarHBondContact OE1-CD 3.47Å; E3032-R3148 IonicContact OE1-CZ 3.72Å; E3032-R3148 IonicContact OE1-NE 3.12Å; E3032-R3148 IonicContact OE1-NH1 2.85Å; E3032-R3148 PolarHBondContact OE1-NH1 3.4Å; E3032-R3148 IonicContact OE2-CZ 2.58Å; E3032-R3148 IonicContact OE2-NH1 3.2Å; E3032-R3148 PolarHBondContact OE2-NH1 3.5Å; L3144-R3148 WeakPolarHBondContact CA-O 3.32Å; Y3145-R3148 PolarHBondContact N-O 2.99Å; Y3145-R3148 PolarHBondContact O-N 3.2Å; R3148-Y3150 HydrophobicContact CB-CD2 4.46Å; R3148-Y3150 HydrophobicContact CB-CE2 3.74Å; R3148-Y3160 WeakPolarHBondContact CA-O 3.05Å; R3148-E3161 HydrophobicContact CG-CB 4.31Å; R3148-E3161 HydrophobicContact CG-CG 4.05Å; R3148-E3161 IonicContact CZ-OE1 3.52Å; R3148-E3161 IonicContact CZ-OE2 2.65Å; R3148-E3161 IonicContact NE-OE1 2.74Å; R3148-E3161 PolarHBondContact NE-OE1 3.2Å; R3148-E3161 IonicContact NE-OE2 2.77Å; R3148-E3161 VanDerWaalsContact NH2-CD 3.32Å; R3148-E3161 IonicContact NH2-OE1 3.2Å; R3148-E3161 PolarHBondContact NH2-OE1 3.42Å; R3148-E3161 IonicContact NH2-OE2 3.72Å; R3148-E3161 PolarHBondContact NH2-OE2 3.19Å
3149	I	84.4	Confident	80	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	128.8	178.8	-63.1	160.7	0	0	0	107.8	F3091 L3099 L3144 I3151 V3159 Y3160 V3162 V3169	F3091-I3149 HydrophobicContact CB-CD1 4.06Å; F3091-I3149 HydrophobicContact CD1-CD1 3.49Å; F3091-I3149 VanDerWaalsContact CD1-CD1 3.49Å; F3091-I3149 HydrophobicContact CD1-CG1 3.86Å; F3091-I3149 HydrophobicContact CD1-CG2 4.01Å; F3091-I3149 HydrophobicContact CD2-CD1 4.29Å; F3091-I3149 HydrophobicContact CE1-CB 4.3Å; F3091-I3149 HydrophobicContact CE1-CD1 4.01Å; F3091-I3149 HydrophobicContact CE1-CG1 3.99Å; F3091-I3149 HydrophobicContact CE1-CG2 3.33Å; F3091-I3149 HydrophobicContact CE2-CG2 4.09Å; F3091-I3149 HydrophobicContact CG-CD1 3.67Å; F3091-I3149 HydrophobicContact CZ-CG2 3.4Å; L3099-I3149 HydrophobicContact CD2-CD1 3.87Å; L3144-I3149 HydrophobicContact CD1-CG1 3.9Å; I3149-I3151 HydrophobicContact CG2-CD1 4.27Å; I3149-I3151 HydrophobicContact CG2-CG1 3.95Å; I3149-V3159 WeakPolarHBondContact O-CA 3.18Å; I3149-Y3160 HydrophobicContact CB-CD2 4.15Å; I3149-Y3160 HydrophobicContact CG2-CD2 3.9Å; I3149-Y3160 PolarHBondContact N-O 3.33Å; I3149-Y3160 PolarHBondContact O-N 3.36Å; I3149-V3162 HydrophobicContact CD1-CG2 3.64Å; I3149-V3162 HydrophobicContact CG1-CG2 4.36Å; I3149-V3169 HydrophobicContact CD1-CG2 4.47Å
3150	Y	85.4	Confident	79.7	Confident	3 Å²	3	35.5 Å²	35.5	1%	0.012	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	131.6	173.2	-66.7	-86	0	0	0	108.1	M3027 E3032 L3036 V3142 I3143 R3148 L3157 R3158 V3159	M3027-Y3150 HydrophobicContact CE-CD1 4.26Å; M3027-Y3150 HydrophobicContact CE-CE1 3.43Å; M3027-Y3150 VanDerWaalsContact CE-CE1 3.43Å; E3032-Y3150 PolarHBondContact OE1-OH 3.31Å; L3036-Y3150 HydrophobicContact CD1-CD1 4.12Å; L3036-Y3150 HydrophobicContact CD1-CD2 4.14Å; L3036-Y3150 HydrophobicContact CD1-CE1 3.82Å; L3036-Y3150 HydrophobicContact CD1-CE2 3.82Å; L3036-Y3150 HydrophobicContact CD1-CG 4.28Å; L3036-Y3150 HydrophobicContact CD2-CD1 4.45Å; L3036-Y3150 HydrophobicContact CD2-CD2 3.69Å; L3036-Y3150 HydrophobicContact CD2-CE2 4.12Å; L3036-Y3150 HydrophobicContact CD2-CG 3.88Å; V3142-Y3150 CarbonylContact C-O 3.49Å; V3142-Y3150 WeakPolarHBondContact CA-O 3.45Å; I3143-Y3150 PolarHBondContact N-O 3.25Å; I3143-Y3150 PolarHBondContact O-N 3.17Å; R3148-Y3150 HydrophobicContact CB-CD2 4.46Å; R3148-Y3150 HydrophobicContact CB-CE2 3.74Å; Y3150-L3157 HydrophobicContact CD1-CD1 4.29Å; Y3150-L3157 HydrophobicContact CD1-CD2 4.44Å; Y3150-L3157 HydrophobicContact CD1-CG 4.46Å; Y3150-R3158 WeakPolarHBondContact CA-O 3.43Å; Y3150-V3159 HydrophobicContact CD1-CB 4.25Å; Y3150-V3159 HydrophobicContact CD1-CG1 3.94Å; Y3150-V3159 HydrophobicContact CD1-CG2 3.7Å; Y3150-V3159 HydrophobicContact CE1-CB 4.05Å; Y3150-V3159 HydrophobicContact CE1-CG1 3.38Å; Y3150-V3159 HydrophobicContact CE1-CG2 3.57Å
3151	I	85.5	Confident	79	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	133	175.9	-53.9	-179.3	0	0	0	107.8	F3091 V3101 M3128 V3140 L3141 V3142 I3149 R3158 Y3160	F3091-I3151 HydrophobicContact CE2-CD1 3.74Å; F3091-I3151 HydrophobicContact CZ-CD1 3.64Å; F3091-I3151 HydrophobicContact CZ-CG1 4.12Å; V3101-I3151 HydrophobicContact CB-CD1 4.01Å; V3101-I3151 HydrophobicContact CG1-CD1 4.11Å; V3101-I3151 HydrophobicContact CG2-CD1 3.69Å; M3128-I3151 HydrophobicContact CE-CG2 4.37Å; V3140-I3151 HydrophobicContact CG1-CG2 3.87Å; L3141-I3151 WeakPolarHBondContact O-CA 3.19Å; V3142-I3151 HydrophobicContact CG2-CG1 4.41Å; I3149-I3151 HydrophobicContact CG2-CD1 4.27Å; I3149-I3151 HydrophobicContact CG2-CG1 3.95Å; I3151-R3158 PolarHBondContact N-O 3.2Å; I3151-R3158 PolarHBondContact O-N 2.92Å; I3151-Y3160 HydrophobicContact CB-CE2 4.45Å; I3151-Y3160 HydrophobicContact CD1-CE2 3.74Å; I3151-Y3160 HydrophobicContact CG1-CE2 3.98Å
3152	T	79.3	Confident	78	Confident	5 Å²	5	40.3 Å²	40.3	3%	0.031	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	139.8	172.8	-171.8	0	0	0	0	113.6	Y3020 L3141 A3156	Y3020-T3152 HydrophobicContact CE1-CG2 4.18Å; Y3020-T3152 WeakPolarHBondContact CE1-OG1 3.32Å; Y3020-T3152 PolarHBondContact OH-OG1 3.23Å; L3141-T3152 HydrophobicContact CB-CG2 3.82Å; L3141-T3152 HydrophobicContact CD2-CG2 4.32Å; L3141-T3152 HydrophobicContact CG-CG2 4.4Å; L3141-T3152 PolarHBondContact N-O 2.95Å; L3141-T3152 PolarHBondContact O-N 3.39Å; T3152-A3156 VanDerWaalsContact CA-O 3.23Å; T3152-A3156 WeakPolarHBondContact CA-O 3.5Å; T3152-A3156 VanDerWaalsContact CB-O 3.26Å; T3152-A3156 WeakPolarHBondContact CB-O 3.32Å; T3152-A3156 PolarHBondContact OG1-O 2.85Å
3153	Y	74.9	Confident	76.6	Confident	38 Å²	38	48.5 Å²	48.5	15%	0.149	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	137.2	173.6	161.3	-100	0	0	0	107.5	I3130 K3131 F3138 V3140 E3155 A3156	I3130-Y3153 HydrophobicContact CD1-CD1 3.96Å; I3130-Y3153 HydrophobicContact CD1-CD2 4.29Å; I3130-Y3153 HydrophobicContact CD1-CE1 4.06Å; I3130-Y3153 HydrophobicContact CD1-CE2 4.38Å; I3130-Y3153 HydrophobicContact CD1-CG 4.09Å; I3130-Y3153 HydrophobicContact CG2-CE1 4.3Å; I3130-Y3153 HydrophobicContact CG2-CE2 3.98Å; I3130-Y3153 WeakPolarHBondContact CG2-OH 3.38Å; K3131-Y3153 PolarHBondContact N-OH 3.21Å; K3131-Y3153 VanDerWaalsContact N-OH 3.13Å; F3138-Y3153 HydrophobicContact CB-CE2 4.18Å; F3138-Y3153 HydrophobicContact CD2-CD2 4.01Å; F3138-Y3153 AromaticContact CD2-CE2 3.88Å; F3138-Y3153 HydrophobicContact CD2-CE2 3.88Å; F3138-Y3153 HydrophobicContact CG-CE2 4.24Å; V3140-Y3153 HydrophobicContact CG2-CD2 4.38Å; Y3153-E3155 PolarHBondContact O-N 3.16Å; Y3153-A3156 PolarHBondContact N-O 2.85Å; Y3153-A3156 PolarHBondContact O-N 2.96Å; Y3153-A3156 VanDerWaalsContact O-N 3.09Å
3154	G	71.3	Confident	75.1	Confident	30 Å²	30	51.4 Å²	51.4	31%	0.309	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	66	-97.3	-179	0	0	0	0	0	113.5	K3016	K3016-G3154 WeakPolarHBondContact CE-O 3.41Å; K3016-G3154 PolarHBondContact NZ-O 2.92Å
3155	E	63.4	Low	73.2	Confident	106 Å²	106	59.6 Å²	59.6	50%	0.495	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.1	0.1	177.2	-58.6	-170.5	158.4	0	0	112.9	L3019 Q3023 Y3153	L3019-E3155 HydrophobicContact CD1-CG 4.38Å; Q3023-E3155 PolarHBondContact NE2-O 3.44Å; Y3153-E3155 PolarHBondContact O-N 3.16Å
3156	A	67.5	Low	72	Confident	59 Å²	59	70.7 Å²	70.7	49%	0.488	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	131.1	-176.3	0	0	0	0	0	111	T3152 Y3153	T3152-A3156 VanDerWaalsContact CA-O 3.23Å; T3152-A3156 WeakPolarHBondContact CA-O 3.5Å; T3152-A3156 VanDerWaalsContact CB-O 3.26Å; T3152-A3156 WeakPolarHBondContact CB-O 3.32Å; T3152-A3156 PolarHBondContact OG1-O 2.85Å; Y3153-A3156 PolarHBondContact N-O 2.85Å; Y3153-A3156 PolarHBondContact O-N 2.96Å; Y3153-A3156 VanDerWaalsContact O-N 3.09Å
3157	L	74.4	Confident	71.2	Confident	33 Å²	33	69.9 Å²	69.9	17%	0.173	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	112	172.6	-177.8	67.6	0	0	0	109.6	L3024 M3027 Y3150	L3024-L3157 HydrophobicContact CD2-CD2 3.78Å; M3027-L3157 HydrophobicContact CE-CD2 4.24Å; Y3150-L3157 HydrophobicContact CD1-CD1 4.29Å; Y3150-L3157 HydrophobicContact CD1-CD2 4.44Å; Y3150-L3157 HydrophobicContact CD1-CG 4.46Å
3158	R	79	Confident	71.1	Confident	63 Å²	63	70.6 Å²	70.6	24%	0.238	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	148.8	169.9	-63	-168.8	177.6	-157.3	1.2	110.1	D3126 T3127 Y3150 I3151 Y3160	D3126-R3158 IonicContact OD1-NH1 2.75Å; D3126-R3158 PolarHBondContact OD1-NH1 3Å; D3126-R3158 IonicContact OD2-CZ 3.6Å; D3126-R3158 IonicContact OD2-NH1 3.42Å; D3126-R3158 PolarHBondContact OD2-NH1 2.58Å; T3127-R3158 VanDerWaalsContact O-CZ 3.32Å; T3127-R3158 PolarHBondContact O-NH1 3.26Å; T3127-R3158 PolarHBondContact O-NH2 2.72Å; Y3150-R3158 WeakPolarHBondContact CA-O 3.43Å; I3151-R3158 PolarHBondContact N-O 3.2Å; I3151-R3158 PolarHBondContact O-N 2.92Å; R3158-Y3160 HydrophobicContact CB-CE2 3.88Å; R3158-Y3160 WeakPolarHBondContact CD-OH 3.29Å
3159	V	79.1	Confident	71	Confident	78 Å²	78	68.7 Å²	68.7	47%	0.473	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	128.2	-175.9	-170.4	0	0	0	0	109.4	I3149 Y3150	I3149-V3159 WeakPolarHBondContact O-CA 3.18Å; Y3150-V3159 HydrophobicContact CD1-CB 4.25Å; Y3150-V3159 HydrophobicContact CD1-CG1 3.94Å; Y3150-V3159 HydrophobicContact CD1-CG2 3.7Å; Y3150-V3159 HydrophobicContact CE1-CB 4.05Å; Y3150-V3159 HydrophobicContact CE1-CG1 3.38Å; Y3150-V3159 HydrophobicContact CE1-CG2 3.57Å
3160	Y	80.1	Confident	71.1	Confident	20 Å²	20	69.8 Å²	69.8	8%	0.078	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	142.4	176.6	-40.9	-94.1	0	0	0	109.1	L3099 V3101 L3120 D3126 R3148 I3149 I3151 R3158	L3099-Y3160 HydrophobicContact CD1-CD1 4.33Å; L3099-Y3160 HydrophobicContact CD2-CD1 3.84Å; L3099-Y3160 HydrophobicContact CD2-CD2 3.82Å; L3099-Y3160 HydrophobicContact CD2-CE1 4.36Å; L3099-Y3160 HydrophobicContact CD2-CE2 4.36Å; L3099-Y3160 HydrophobicContact CD2-CG 3.53Å; V3101-Y3160 HydrophobicContact CG2-CE1 4.4Å; V3101-Y3160 HydrophobicContact CG2-CE2 4.16Å; L3120-Y3160 HydrophobicContact CD1-CD1 4.25Å; D3126-Y3160 HydrophobicContact CB-CE1 4.06Å; D3126-Y3160 WeakPolarHBondContact OD2-CE1 3.35Å; D3126-Y3160 PolarHBondContact OD2-OH 2.93Å; R3148-Y3160 WeakPolarHBondContact CA-O 3.05Å; I3149-Y3160 HydrophobicContact CB-CD2 4.15Å; I3149-Y3160 HydrophobicContact CG2-CD2 3.9Å; I3149-Y3160 PolarHBondContact N-O 3.33Å; I3149-Y3160 PolarHBondContact O-N 3.36Å; I3151-Y3160 HydrophobicContact CB-CE2 4.45Å; I3151-Y3160 HydrophobicContact CD1-CE2 3.74Å; I3151-Y3160 HydrophobicContact CG1-CE2 3.98Å; R3158-Y3160 HydrophobicContact CB-CE2 3.88Å; R3158-Y3160 WeakPolarHBondContact CD-OH 3.29Å
3161	E	72	Confident	71.3	Confident	73 Å²	73	69.7 Å²	69.7	34%	0.341	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	114.4	179.3	-173.2	155	-139.5	0	0	107.5	R3148 F3163	R3148-E3161 HydrophobicContact CG-CB 4.31Å; R3148-E3161 HydrophobicContact CG-CG 4.05Å; R3148-E3161 IonicContact CZ-OE1 3.52Å; R3148-E3161 IonicContact CZ-OE2 2.65Å; R3148-E3161 IonicContact NE-OE1 2.74Å; R3148-E3161 PolarHBondContact NE-OE1 3.2Å; R3148-E3161 IonicContact NE-OE2 2.77Å; R3148-E3161 VanDerWaalsContact NH2-CD 3.32Å; R3148-E3161 IonicContact NH2-OE1 3.2Å; R3148-E3161 PolarHBondContact NH2-OE1 3.42Å; R3148-E3161 IonicContact NH2-OE2 3.72Å; R3148-E3161 PolarHBondContact NH2-OE2 3.19Å; E3161-F3163 HydrophobicContact CB-CE2 3.86Å; E3161-F3163 HydrophobicContact CB-CZ 4.19Å; E3161-F3163 HydrophobicContact CG-CD2 4.49Å; E3161-F3163 HydrophobicContact CG-CE1 4.3Å; E3161-F3163 HydrophobicContact CG-CE2 3.81Å; E3161-F3163 HydrophobicContact CG-CZ 3.7Å; E3161-F3163 VanDerWaalsContact O-CD2 3.23Å; E3161-F3163 WeakPolarHBondContact O-CD2 3.34Å; E3161-F3163 PolarHBondContact O-N 3Å
3162	V	67	Low	71.6	Confident	37 Å²	37	69.7 Å²	69.7	22%	0.224	35%	0.349	C	S	.	.			trans	-82.6	108.6	-176.6	-176.4	0	0	0	0	108	V3098 S3147 I3149 V3169	V3098-V3162 HydrophobicContact CG2-CG1 4.46Å; S3147-V3162 PolarHBondContact O-N 2.96Å; I3149-V3162 HydrophobicContact CD1-CG2 3.64Å; I3149-V3162 HydrophobicContact CG1-CG2 4.36Å; V3162-V3169 HydrophobicContact CG2-CG2 4.44Å
3163	F	57.6	Low	72.2	Confident	172 Å²	172	73.5 Å²	73.5	75%	0.754	37%	0.365	S	S	*	.			trans	-91.4	117.6	174.6	-65.8	-84.8	0	0	0	109.4	E3161	E3161-F3163 HydrophobicContact CB-CE2 3.86Å; E3161-F3163 HydrophobicContact CB-CZ 4.19Å; E3161-F3163 HydrophobicContact CG-CD2 4.49Å; E3161-F3163 HydrophobicContact CG-CE1 4.3Å; E3161-F3163 HydrophobicContact CG-CE2 3.81Å; E3161-F3163 HydrophobicContact CG-CZ 3.7Å; E3161-F3163 VanDerWaalsContact O-CD2 3.23Å; E3161-F3163 WeakPolarHBondContact O-CD2 3.34Å; E3161-F3163 PolarHBondContact O-N 3Å
3164	G	55.4	Low	73	Confident	64 Å²	64	71.7 Å²	71.7	66%	0.66	36%	0.358	S	S	*	.	S	Bend	trans	177.1	154.8	-179.7	0	0	0	0	0	110.6	R3166	G3164-R3166 PolarHBondContact O-N 3.21Å
3165	E	45.9	Very low	74	Confident	181 Å²	181	71.5 Å²	71.5	85%	0.846	35%	0.352	S	S	*	.	S	Bend	trans	-76.8	113.5	-172.4	-62.3	-165.5	129.8	0	0	112.6	R3167	E3165-R3167 PolarHBondContact O-N 3.32Å
3166	R	55	Low	75.3	Confident	251 Å²	251	68.1 Å²	68.1	95%	0.947	35%	0.345	S	S	*	.	S	Bend	trans	57.6	-20.4	166.2	-62.6	-176.5	177.2	-174.9	0.5	118.5	G3164	G3164-R3166 PolarHBondContact O-N 3.21Å
3167	R	61.2	Low	76.2	Confident	151 Å²	151	68.6 Å²	68.6	57%	0.57	34%	0.34	S	S	*	.			trans	-71.2	139.9	177.2	-56.8	-170.1	-174.8	177	-0.1	110.6	I3093 E3165	I3093-R3167 HydrophobicContact CD1-CB 4.16Å; I3093-R3167 HydrophobicContact CG2-CB 3.57Å; I3093-R3167 HydrophobicContact CG2-CG 4.28Å; E3165-R3167 PolarHBondContact O-N 3.32Å
3168	L	72.4	Confident	76.9	Confident	69 Å²	69	67.1 Å²	67.1	36%	0.361	33%	0.332	S	S	.	.			trans	-112.1	149.9	-179	-69.2	173.6	0	0	0	110.6	N3170	L3168-N3170 PolarHBondContact O-N 2.96Å; L3168-N3170 PolarHBondContact O-OD1 3.36Å
3169	V	80.6	Confident	77.3	Confident	10 Å²	10	65.8 Å²	65.8	6%	0.061	33%	0.33	C	S	.	.			trans	-64.5	117.6	173	176.2	0	0	0	0	109.8	F3065 F3091 M3092 I3093 V3098 L3144 I3149 V3162 G3171	F3065-V3169 HydrophobicContact CD2-CG1 4.23Å; F3065-V3169 HydrophobicContact CE2-CG1 4.43Å; F3091-V3169 HydrophobicContact CB-CG1 4.22Å; F3091-V3169 HydrophobicContact CD1-CG1 4.2Å; M3092-V3169 CarbonylContact O-C 3.59Å; M3092-V3169 WeakPolarHBondContact O-CA 3.49Å; I3093-V3169 HydrophobicContact CD1-CG2 4.32Å; I3093-V3169 HydrophobicContact CG1-CG2 4.11Å; V3098-V3169 HydrophobicContact CG2-CG2 4.2Å; L3144-V3169 HydrophobicContact CD1-CB 4.13Å; L3144-V3169 HydrophobicContact CD1-CG2 4.4Å; L3144-V3169 HydrophobicContact CD2-CB 3.85Å; L3144-V3169 HydrophobicContact CD2-CG1 4.24Å; L3144-V3169 WeakPolarHBondContact CD2-O 3.18Å; I3149-V3169 HydrophobicContact CD1-CG2 4.47Å; V3162-V3169 HydrophobicContact CG2-CG2 4.44Å; V3169-G3171 WeakPolarHBondContact CG1-O 3.47Å
3170	N	86	Confident	77.7	Confident	23 Å²	23	62.1 Å²	62.1	12%	0.123	31%	0.307	C	S	.	.			trans	-85.8	-13.1	-176.4	-69.7	-22.7	0	0	0	113.4	Y3062 F3065 R3067 M3092 D3094 L3168	Y3062-N3170 VanDerWaalsContact OH-C 3.29Å; Y3062-N3170 PolarHBondContact OH-O 3.11Å; F3065-N3170 PolarHBondContact N-O 3.41Å; R3067-N3170 VanDerWaalsContact CZ-OD1 3.29Å; R3067-N3170 PolarHBondContact NE-OD1 3.27Å; R3067-N3170 VanDerWaalsContact NH2-CG 3.31Å; R3067-N3170 PolarHBondContact NH2-ND2 2.58Å; R3067-N3170 VanDerWaalsContact NH2-ND2 3.12Å; R3067-N3170 PolarHBondContact NH2-OD1 3.45Å; M3092-N3170 PolarHBondContact O-N 2.73Å; D3094-N3170 PolarHBondContact N-ND2 3.32Å; D3094-N3170 PolarHBondContact OD1-ND2 3.47Å; L3168-N3170 PolarHBondContact O-N 2.96Å; L3168-N3170 PolarHBondContact O-OD1 3.36Å
3171	G	89.2	Confident	77.9	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	163.9	-173.8	-176.2	0	0	0	0	0	112.9	Y3062 V3063 M3092 V3169	Y3062-G3171 WeakPolarHBondContact OH-CA 3.5Å; Y3062-G3171 PolarHBondContact OH-N 3.41Å; V3063-G3171 CarbonylContact O-C 3.58Å; V3063-G3171 WeakPolarHBondContact O-CA 3.42Å; M3092-G3171 PolarHBondContact N-O 2.97Å; V3169-G3171 WeakPolarHBondContact CG1-O 3.47Å
3172	I	92.1	Very high	78.4	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	138.4	175.2	55.7	177.1	0	0	0	111.2	Y3062 V3063 F3065 A3074 L3076 I3089 D3090 F3091 V3142	Y3062-I3172 CarbonylContact C-O 3.55Å; Y3062-I3172 WeakPolarHBondContact CA-O 3.41Å; Y3062-I3172 WeakPolarHBondContact CD2-O 3.17Å; V3063-I3172 HydrophobicContact CB-CD1 4.42Å; V3063-I3172 HydrophobicContact CB-CG1 3.78Å; V3063-I3172 HydrophobicContact CG2-CG1 4.2Å; V3063-I3172 PolarHBondContact N-O 2.98Å; V3063-I3172 PolarHBondContact O-N 3.45Å; F3065-I3172 HydrophobicContact CE2-CG2 3.98Å; F3065-I3172 HydrophobicContact CZ-CD1 4.31Å; F3065-I3172 HydrophobicContact CZ-CG1 4.26Å; F3065-I3172 HydrophobicContact CZ-CG2 4.09Å; A3074-I3172 HydrophobicContact CB-CD1 4.24Å; L3076-I3172 HydrophobicContact CD1-CD1 4.1Å; L3076-I3172 HydrophobicContact CD2-CD1 4.41Å; I3089-I3172 HydrophobicContact CG2-CB 4.05Å; I3089-I3172 HydrophobicContact CG2-CD1 4.14Å; I3089-I3172 HydrophobicContact CG2-CG2 4.12Å; D3090-I3172 CarbonylContact O-C 3.53Å; D3090-I3172 VanDerWaalsContact O-CA 3.28Å; D3090-I3172 WeakPolarHBondContact O-CA 3.41Å; F3091-I3172 HydrophobicContact CD1-CG2 3.32Å; F3091-I3172 HydrophobicContact CD2-CG2 4.4Å; F3091-I3172 HydrophobicContact CE1-CG2 3.36Å; F3091-I3172 HydrophobicContact CE2-CG2 4.41Å; F3091-I3172 HydrophobicContact CG-CG2 3.87Å; F3091-I3172 HydrophobicContact CZ-CG2 3.92Å; V3142-I3172 HydrophobicContact CB-CD1 4.38Å; V3142-I3172 HydrophobicContact CG1-CD1 4.39Å; V3142-I3172 HydrophobicContact CG2-CD1 4.25Å
3173	K	92.1	Very high	78.9	Confident	86 Å²	86	63.1 Å²	63.1	37%	0.374	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	131	170.6	-175.6	178.5	-179.3	178.6	0	108.9	P3060 Y3061 Y3062 D3090 M3092	P3060-K3173 HydrophobicContact CB-CG 4.35Å; Y3061-K3173 CarbonylContact O-C 3.6Å; Y3061-K3173 WeakPolarHBondContact O-CA 3.29Å; Y3062-K3173 HydrophobicContact CD2-CB 4.2Å; D3090-K3173 HydrophobicContact CB-CB 4.3Å; D3090-K3173 PolarHBondContact N-O 3Å; D3090-K3173 PolarHBondContact O-N 3.32Å; M3092-K3173 HydrophobicContact CG-CB 4.19Å; M3092-K3173 HydrophobicContact SD-CB 4.36Å
3174	I	92.8	Very high	79.9	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	129.8	-178.9	-57	163	0	0	0	107.7	L3059 P3060 Y3061 V3063 L3076 S3088 L3180 T3183	L3059-I3174 HydrophobicContact CD1-CG2 4.44Å; L3059-I3174 HydrophobicContact CD2-CB 4.28Å; L3059-I3174 HydrophobicContact CD2-CG2 4.04Å; P3060-I3174 CarbonylContact C-O 3.55Å; P3060-I3174 WeakPolarHBondContact CA-O 3.39Å; Y3061-I3174 PolarHBondContact N-O 3.35Å; Y3061-I3174 PolarHBondContact O-N 2.74Å; V3063-I3174 HydrophobicContact CG2-CD1 4.17Å; L3076-I3174 HydrophobicContact CD1-CD1 3.78Å; L3076-I3174 HydrophobicContact CD1-CG1 4.3Å; L3076-I3174 HydrophobicContact CD2-CD1 3.65Å; L3076-I3174 HydrophobicContact CG-CD1 4.3Å; S3088-I3174 WeakPolarHBondContact O-CA 3.25Å; I3174-L3180 HydrophobicContact CD1-CD1 4.34Å; I3174-L3180 HydrophobicContact CD1-CD2 3.85Å; I3174-T3183 HydrophobicContact CD1-CG2 4.47Å
3175	S	91.6	Very high	81.1	Confident	26 Å²	26	56.4 Å²	56.4	18%	0.182	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	165.5	-176	37.3	0	0	0	0	113.1	F3087 S3088	F3087-S3175 CarbonylContact C-O 3.58Å; F3087-S3175 VanDerWaalsContact CA-O 3.31Å; F3087-S3175 WeakPolarHBondContact CA-O 3.46Å; F3087-S3175 WeakPolarHBondContact CB-O 3.33Å; S3088-S3175 PolarHBondContact N-O 3.35Å; S3088-S3175 PolarHBondContact O-N 3.44Å; S3088-S3175 PolarHBondContact OG-OG 3.03Å
3176	G	89.3	Confident	82.7	Confident	35 Å²	35	48.5 Å²	48.5	36%	0.361	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	93.5	-162.3	-178.2	0	0	0	0	0	113.4	L3059 V3178	L3059-G3176 WeakPolarHBondContact CD1-O 3.49Å; G3176-V3178 VanDerWaalsContact C-N 3.3Å; G3176-V3178 PolarHBondContact O-N 3.17Å
3177	D	87.4	Confident	83.9	Confident	69 Å²	69	39 Å²	39	37%	0.369	21%	0.209	S	C	.	.	S	Bend	trans	-95.3	51.7	-153.1	-47.8	-48.3	0	0	0	113.6	K3081 A3084 T3086	K3081-D3177 WeakPolarHBondContact CB-O 3.47Å; K3081-D3177 PolarHBondContact N-O 3.14Å; A3084-D3177 HydrophobicContact CB-CB 3.29Å; T3086-D3177 PolarHBondContact O-N 3.23Å
3178	V	89.1	Confident	84.3	Confident	1 Å²	1	34 Å²	34	1%	0.006	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	151.9	176.8	-73.1	0	0	0	0	111.3	L3059 L3078 A3079 F3080 K3081 F3087 G3176	L3059-V3178 HydrophobicContact CD1-CG2 3.8Å; L3059-V3178 VanDerWaalsContact CD1-O 3.22Å; L3059-V3178 WeakPolarHBondContact CD1-O 3.48Å; L3078-V3178 HydrophobicContact CD2-CB 4.39Å; L3078-V3178 HydrophobicContact CD2-CG2 3.93Å; A3079-V3178 CarbonylContact O-C 3.54Å; A3079-V3178 WeakPolarHBondContact O-CA 3.47Å; A3079-V3178 VanDerWaalsContact O-CB 3.31Å; A3079-V3178 WeakPolarHBondContact O-CB 3.32Å; F3080-V3178 HydrophobicContact CD1-CG1 3.97Å; F3080-V3178 HydrophobicContact CE1-CG1 4.21Å; F3080-V3178 HydrophobicContact CG-CG1 4.25Å; K3081-V3178 WeakPolarHBondContact CE-O 3.31Å; F3087-V3178 HydrophobicContact CB-CB 4.28Å; F3087-V3178 HydrophobicContact CB-CG1 3.75Å; F3087-V3178 HydrophobicContact CB-CG2 3.54Å; F3087-V3178 HydrophobicContact CD1-CG1 3.51Å; F3087-V3178 HydrophobicContact CD1-CG2 4.5Å; F3087-V3178 HydrophobicContact CD2-CG2 4.5Å; F3087-V3178 HydrophobicContact CE1-CG1 4.3Å; F3087-V3178 HydrophobicContact CG-CG1 3.83Å; F3087-V3178 HydrophobicContact CG-CG2 3.98Å; G3176-V3178 VanDerWaalsContact C-N 3.3Å; G3176-V3178 PolarHBondContact O-N 3.17Å
3179	N	87	Confident	84.2	Confident	36 Å²	36	35.9 Å²	35.9	19%	0.193	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	124.1	163.5	-70.2	-11.8	0	0	0	108	P3056 L3078 A3079 K3081 Y3181	P3056-N3179 HydrophobicContact CB-CB 3.98Å; L3078-N3179 CarbonylContact C-O 3.52Å; L3078-N3179 VanDerWaalsContact CA-O 3.32Å; L3078-N3179 WeakPolarHBondContact CA-O 3.38Å; A3079-N3179 PolarHBondContact N-O 3.35Å; A3079-N3179 PolarHBondContact O-N 3.16Å; K3081-N3179 WeakPolarHBondContact CE-OD1 3.49Å; K3081-N3179 WeakPolarHBondContact CG-OD1 3.46Å; N3179-Y3181 HydrophobicContact CB-CE1 4.24Å; N3179-Y3181 HydrophobicContact CB-CE2 3.75Å; N3179-Y3181 WeakPolarHBondContact CB-OH 3.39Å; N3179-Y3181 PolarHBondContact ND2-OH 3.4Å
3180	L	87.9	Confident	83	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	108.4	177.6	172.9	64.8	0	0	0	108.9	I3057 L3059 Y3061 L3076 K3077 L3078 I3174 T3183	I3057-L3180 HydrophobicContact CB-CB 4.42Å; I3057-L3180 HydrophobicContact CB-CD2 4.36Å; I3057-L3180 HydrophobicContact CB-CG 4.3Å; I3057-L3180 VanDerWaalsContact CB-O 3.26Å; I3057-L3180 WeakPolarHBondContact CB-O 3.09Å; I3057-L3180 HydrophobicContact CD1-CG 4.35Å; I3057-L3180 WeakPolarHBondContact CG1-O 3.13Å; I3057-L3180 HydrophobicContact CG2-CD2 4.45Å; I3057-L3180 PolarHBondContact N-O 3.45Å; L3059-L3180 HydrophobicContact CD2-CB 4.02Å; L3059-L3180 HydrophobicContact CD2-CD2 3.8Å; Y3061-L3180 HydrophobicContact CD1-CD2 3.79Å; Y3061-L3180 HydrophobicContact CG-CD2 4.01Å; L3076-L3180 HydrophobicContact CB-CD1 4.46Å; K3077-L3180 CarbonylContact O-C 3.54Å; K3077-L3180 WeakPolarHBondContact O-CA 2.94Å; L3078-L3180 HydrophobicContact CD2-CB 4.13Å; L3078-L3180 HydrophobicContact CD2-CD1 3.62Å; L3078-L3180 HydrophobicContact CD2-CG 4.46Å; I3174-L3180 HydrophobicContact CD1-CD1 4.34Å; I3174-L3180 HydrophobicContact CD1-CD2 3.85Å; L3180-T3183 HydrophobicContact CD1-CG2 3.9Å; L3180-T3183 HydrophobicContact CD2-CG2 3.81Å; L3180-T3183 HydrophobicContact CG-CG2 4.16Å
3181	Y	84	Confident	80.9	Confident	50 Å²	50	49 Å²	49	20%	0.196	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	-31.7	-173.1	-62.1	-77.8	0	0	0	113.9	L3054 P3056 K3077 A3079 N3179	L3054-Y3181 HydrophobicContact CB-CD1 4.35Å; L3054-Y3181 WeakPolarHBondContact O-CD1 3.43Å; P3056-Y3181 HydrophobicContact CB-CD1 4.47Å; P3056-Y3181 HydrophobicContact CB-CE1 4.23Å; K3077-Y3181 PolarHBondContact O-N 3.28Å; A3079-Y3181 HydrophobicContact CB-CE2 3.74Å; N3179-Y3181 HydrophobicContact CB-CE1 4.24Å; N3179-Y3181 HydrophobicContact CB-CE2 3.75Å; N3179-Y3181 WeakPolarHBondContact CB-OH 3.39Å; N3179-Y3181 PolarHBondContact ND2-OH 3.4Å
3182	E	82.3	Confident	78.3	Confident	78 Å²	78	58.2 Å²	58.2	36%	0.364	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	139.6	178	-161.8	-173.7	140.1	0	0	110	L3054 K3077 S3184	L3054-E3182 HydrophobicContact CD1-CB 4.16Å; K3077-E3182 HydrophobicContact CB-CB 4Å; K3077-E3182 PolarHBondContact N-O 2.67Å; E3182-S3184 VanDerWaalsContact OE1-CB 3.29Å; E3182-S3184 WeakPolarHBondContact OE1-CB 3.25Å; E3182-S3184 PolarHBondContact OE1-OG 2.78Å
3183	T	78	Confident	75.6	Confident	24 Å²	24	69.5 Å²	69.5	15%	0.147	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	121.3	154.4	63.2	0	0	0	0	108.6	Y3061 V3063 L3076 I3174 L3180 P3185	Y3061-T3183 HydrophobicContact CD1-CG2 3.91Å; Y3061-T3183 HydrophobicContact CE1-CG2 3.66Å; V3063-T3183 HydrophobicContact CG2-CG2 3.87Å; L3076-T3183 HydrophobicContact CD2-CG2 3.84Å; I3174-T3183 HydrophobicContact CD1-CG2 4.47Å; L3180-T3183 HydrophobicContact CD1-CG2 3.9Å; L3180-T3183 HydrophobicContact CD2-CG2 3.81Å; L3180-T3183 HydrophobicContact CG-CG2 4.16Å; T3183-P3185 WeakPolarHBondContact O-CD 3.32Å
3184	S	77.8	Confident	72.8	Confident	19 Å²	19	74 Å²	74	13%	0.133	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	79.3	174.9	-112.1	0	0	0	0	108.7	R3046 M3075 E3182	R3046-S3184 PolarHBondContact NH1-OG 3.28Å; M3075-S3184 PolarHBondContact N-O 2.78Å; M3075-S3184 VanDerWaalsContact N-O 3.08Å; M3075-S3184 PolarHBondContact O-N 3.19Å; E3182-S3184 VanDerWaalsContact OE1-CB 3.29Å; E3182-S3184 WeakPolarHBondContact OE1-CB 3.25Å; E3182-S3184 PolarHBondContact OE1-OG 2.78Å
3185	P	81.1	Confident	69.9	Low	76 Å²	76	86 Å²	86	49%	0.494	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	148.5	174.6	30.6	-35	0	0	0	111.1	V3063 F3073 T3183	V3063-P3185 HydrophobicContact CG1-CB 4.02Å; F3073-P3185 CarbonylContact O-C 3.55Å; F3073-P3185 WeakPolarHBondContact O-CA 2.72Å; T3183-P3185 WeakPolarHBondContact O-CD 3.32Å
3186	G	80.4	Confident	67.1	Low	15 Å²	15	95 Å²	95	16%	0.155	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	162.3	179.6	0	0	0	0	0	112.4	N3072 F3073	N3072-G3186 CarbonylContact C-O 3.59Å; F3073-G3186 WeakPolarHBondContact CD1-O 3.37Å; F3073-G3186 VanDerWaalsContact CE1-C 3.49Å; F3073-G3186 PolarHBondContact N-O 2.9Å; F3073-G3186 PolarHBondContact O-N 3.19Å
3187	V	79.9	Confident	64.3	Low	50 Å²	50	96.9 Å²	96.9	30%	0.303	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	138.3	-167.9	179.6	0	0	0	0	109.7	K3066 V3069 A3071 E3189	K3066-V3187 HydrophobicContact CB-CG2 4.45Å; K3066-V3187 HydrophobicContact CD-CG1 4.29Å; K3066-V3187 HydrophobicContact CD-CG2 4.12Å; K3066-V3187 HydrophobicContact CG-CG2 4.12Å; V3069-V3187 HydrophobicContact CB-CG1 3.73Å; V3069-V3187 HydrophobicContact CG1-CG1 3.57Å; V3069-V3187 HydrophobicContact CG2-CG1 3.97Å; A3071-V3187 WeakPolarHBondContact O-CA 3.41Å; V3187-E3189 HydrophobicContact CG1-CG 3.6Å
3188	I	69.4	Low	61.5	Low	47 Å²	47	103.6 Å²	103.6	24%	0.241	51%	0.507	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	107	163.6	-64.5	-174.3	0	0	0	108.5	T3035 I3039 V3070 A3071	T3035-I3188 HydrophobicContact CG2-CD1 3.75Å; I3039-I3188 HydrophobicContact CD1-CD1 3.9Å; I3039-I3188 HydrophobicContact CG1-CD1 3.45Å; I3039-I3188 VanDerWaalsContact CG1-CD1 3.45Å; I3039-I3188 HydrophobicContact CG1-CG1 4.28Å; V3070-I3188 HydrophobicContact CB-CG2 4.19Å; V3070-I3188 VanDerWaalsContact CB-O 3.31Å; V3070-I3188 WeakPolarHBondContact CB-O 3.47Å; V3070-I3188 PolarHBondContact N-O 2.83Å; A3071-I3188 HydrophobicContact CB-CB 4.48Å; A3071-I3188 PolarHBondContact N-O 2.84Å; A3071-I3188 PolarHBondContact O-N 2.7Å
3189	E	69.7	Low	60.1	Low	109 Å²	109	108.8 Å²	108.8	51%	0.509	53%	0.532	S	S	.	.			trans	-87.3	143.4	175	-60.1	-170.3	-179.3	0	0	110.5	K3066 V3069 V3187 V3191	K3066-E3189 IonicContact NZ-OE1 2.78Å; K3066-E3189 PolarHBondContact NZ-OE1 3.1Å; V3069-E3189 HydrophobicContact CG1-CG 4.21Å; V3187-E3189 HydrophobicContact CG1-CG 3.6Å; E3189-V3191 PolarHBondContact O-N 2.95Å
3190	K	55.2	Low	58.7	Low	177 Å²	177	112.6 Å²	112.6	77%	0.77	55%	0.55	S	S	*	*			trans	-73.8	104.2	-178.3	-164.1	179.6	-176.4	-175.8	0	108.5	V3070 K3192	V3070-K3190 HydrophobicContact CG2-CB 3.61Å; V3070-K3190 HydrophobicContact CG2-CG 4.14Å; K3190-K3192 PolarHBondContact O-N 3.28Å
3191	V	41.7	Very low	57	Low	132 Å²	132	118.8 Å²	118.8	80%	0.8	58%	0.581	S	S	*	*			trans	-55.9	98.3	179.8	-178.7	0	0	0	0	109.9	E3189 R3193	E3189-V3191 PolarHBondContact O-N 2.95Å; V3191-R3193 PolarHBondContact O-N 2.97Å
3192	K	36.5	Very low	55.4	Low	193 Å²	193	122.9 Å²	122.9	84%	0.839	60%	0.603	S	S	*	*			trans	-64.5	100.3	168.8	-76.9	-174.4	177	-179.6	0	106.7	K3190 K3194	K3190-K3192 PolarHBondContact O-N 3.28Å; K3192-K3194 VanDerWaalsContact C-N 3.34Å; K3192-K3194 PolarHBondContact O-N 3.06Å
3193	R	34.5	Very low	53.8	Low	237 Å²	237	125.7 Å²	125.7	89%	0.894	62%	0.618	S	S	*	*			trans	-52.8	102	162.9	-84.8	-177.3	168.2	174.6	-5.2	107.1	V3191 R3195	V3191-R3193 PolarHBondContact O-N 2.97Å; R3193-R3195 PolarHBondContact O-N 3.49Å
3194	K	32.9	Very low	52.1	Low	180 Å²	180	132.5 Å²	132.5	78%	0.783	65%	0.65	S	S	*	*			trans	-60.4	111.4	168.4	-78.9	-171.1	174.6	-176	0	106.2	K3192 R3196	K3192-K3194 VanDerWaalsContact C-N 3.34Å; K3192-K3194 PolarHBondContact O-N 3.06Å; K3194-R3196 PolarHBondContact O-N 3.06Å
3195	R	31.9	Very low	50.3	Low	252 Å²	252	140.6 Å²	140.6	95%	0.951	69%	0.687	S	S	*	*			trans	-64.5	79.9	158	-78.3	-177.7	170.5	176	-4.2	106.9	R3193 G3197	R3193-R3195 PolarHBondContact O-N 3.49Å; R3195-G3197 PolarHBondContact O-N 2.87Å
3196	R	33	Very low	47.9	Very low	214 Å²	214	145.5 Å²	145.5	81%	0.808	70%	0.702	S	S	*	*			trans	-74.6	112.2	156.4	-86.3	-174.7	162.6	171.9	-6.8	105.2	K3194	K3194-R3196 PolarHBondContact O-N 3.06Å
3197	G	31.1	Very low	45.2	Very low	75 Å²	75	156.4 Å²	156.4	77%	0.773	75%	0.747	S	S	*	*			trans	-77.6	117.5	169.2	0	0	0	0	0	108.7	R3195	R3195-G3197 PolarHBondContact O-N 2.87Å
3198	T	27.2	Very low	42.1	Very low	211 Å²	211	166.1 Å²	166.1	100%	1.294	79%	0.787	S	S	*	*			trans	-169.1	0	158.2	-5.6	0	0	0	0	106.9

Retrieved 3,198 of 3,198 residues in 762.7 ms (Link to these results)

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