A0A5K4FBW9_SCHMA Loading...

Protein-tyrosine-phosphatase AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4FBW9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,718 aa.

						>A0A5K4FBW9_SCHMA|A0A5K4FBW9
MRVTLQILIILYIIPSYIVNTHNISSINSIDNEKLSIIGPPRELILEIACDQLRPCIKASWLPPIDFQQFFDQKDYTTNNKHDHENKNHLLTYRIRYHIIHPIELSKINVDNDHNNLDHKLLTKTIEKNITGLQYTSNPGEHLFGVIYEVSVAGVTENGYGRDAISRIATPESAPSDAPSNFRVVGGDQTSVQLAWEPPRLLYRNGIITKYQVRCYIVGEEENHDELKTITEQTLKLYNLPSATHACLVRAWTKAGPGPWSDRIQFLINQKGPPPPFHIQVYWKTQYILTIEWTLPEDKENIAYLIIHYAKQNNPNVWHKYFVKDLKVTEDLGNLSPNDEYLIRLSSVDLNGNEGELSDIINTNSYQHSTLIDNSNGDIHNGNNNLNDKRNHNFIFMDIRDQPEKFTVQNFKCIHRTMNTITIEWLPPIHLANLLEYQLQISGRSEFITSSGVLKSVHLGDIQLHQNIDQQIDNNEPEMLNWPLVNMLNSMSSLEDHHHLQQQTHKMQIPNLKPNSQYKITIRPIYRALITEGNIGAKEGIPVTIICHTEWSAPEHIKQPELLAIYAGPPDPQGPTSIIEIKLHRVSEENGPIHNYYVIISPELNTVTTNKNLVNNDLLKSSKSLVIDPSHYDLKSLSQNSDLSSNHAPYLALARHTINLFKPNHETAVIILGSEEVDNFILETQYYLHAQTNRNQTYNRNVKETTDLGSYYQDGTSDIHETDSHISKNNEDKPYYHNFNGDMFMKTIQVNNKRLFQSTIYRVALRACSQYPNGHQLCSTSQWSDRISPINPIQSNTFSKLKSLKDKINEWNLHESSSSFTIILIGLSSGLIFFAILSTILGCILRRRKQQLIRRSMLESNNNHLDVQIYRDLSKSMFSENVSTTSNPRTKCYSPKVKTNNNNNSLMNSQPSSYFLNLHNEGSYSPSNSSNGIPILNFPHPNTGGLTVGINQISPLALSSNQLTISDLSPVITRSVYMNTRNKSESPTRSMNSSDALIGKTIYNIPSKVGTTNILENFNQLVRDGTLEIHRMPIPVEQFQEVIYQSRNNNYISFQQEFQTIEQISSTRYISAVHSNLDINKSKNRYPNILAYDCTRVSIQSNYQHHSNAQYGIVSGSDYINANYIDGYRKQKAYIATQAPLPNTFDHFWTMIWEQNTNVIVMLSKLIELGQMKCDQYWPNNGTLHFSDKLIVTHLETNELANYVIRCFELRKDKEHRKIWHLQYTSWPDQEVSTYPTVFLMFLRRVGTLTPNDCGPIVVHCSSGTGRTVNQLRLQRNYMIETQEQYQFIYTALLESITDGNTEVSARNLYTHIQHLSILQTTNTTISSTNDYMSNFNNPLTTTITPTTTSTNTLNDLSNNTTTTNSLGLTGFQLEFRKINKLSPNITLTLNCIQSKTGFVNYTPPGSPIHGYKLSVSCDVAKRSVNLSKNRLVSIVPFDWNRVTLCSIRGVDGSDYINASFIDGYLEKNAYIACQGPMISTVEDFWRMVWEKHSCLIVMLCSVKESGKEKCFTYWPEDKPSRYQFFVIDLTAQYTMSSHILREFKLTDTRDGESRTIRQLQYIHWNEQGLPHTGESLIDLIGHVHKIKEQYHYDGPITIHCSSGSGRTGLFITMCNVLERLRQESVIDMYQTVKLLRQQRVWMIQTEEQYRFCYTTTLDYLNSFDLCTQPQLLIQTTNTIQLNSPNLKMKMKSSQCNDKTVVFELDKDYELNHSHLVK
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE 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	31.4	Very low	32.4	Very low	120 Å²	120	113.1 Å²	113.1	59%	0.591	57%	0.565	S	S	*	*				0	145.6	0	-69.5	-175.9	176.7	0	0	109.6	E478	M1-E478 PolarHBondContact N-OE1 2.85Å; M1-E478 PolarHBondContact N-OE2 3.16Å
2	R	33.9	Very low	32	Very low	201 Å²	201	118.5 Å²	118.5	76%	0.758	58%	0.576	S	S	*	*				-159.1	22.7	51.7	-148.5	178.4	-163.1	166.4	4.4	114.6
3	V	37.4	Very low	31.9	Very low	124 Å²	124	121.8 Å²	121.8	75%	0.752	60%	0.595	S	S	*	*			trans	-103.9	59.1	174.5	-167.8	0	0	0	0	111.2	Q503	V3-Q503 PolarHBondContact O-NE2 2.9Å
4	T	36.7	Very low	31.8	Very low	56 Å²	56	120.6 Å²	120.6	34%	0.344	59%	0.591	S	S	.	*	S	Bend	trans	-122.3	138.4	142.8	-33.7	0	0	0	0	104.2	L500 Q503	T4-L500 HydrophobicContact CG2-CD2 4.32Å; T4-Q503 PolarHBondContact OG1-NE2 3.02Å
5	L	29.9	Very low	31.7	Very low	115 Å²	115	119.5 Å²	119.5	60%	0.602	60%	0.597	S	S	*	*			trans	63.7	59.1	-174.1	-78.5	63.3	0	0	0	114.6	L500	L5-L500 HydrophobicContact CD1-CD2 3.8Å; L5-L500 HydrophobicContact CD1-CG 4.08Å
6	Q	28.1	Very low	31.3	Very low	149 Å²	149	117.4 Å²	117.4	70%	0.696	60%	0.597	S	S	*	*	S	Bend		-110.2	121.8	121.4	-108.1	-169.5	-27.4	0	0	109.2	Q501	Q6-Q501 PolarHBondContact O-NE2 3.43Å
7	I	38.5	Very low	31.1	Very low	102 Å²	102	122.1 Å²	122.1	52%	0.523	61%	0.607	S	S	.	*			trans	49.4	106.5	144	-51.3	163.5	0	0	0	116.8	I9	I7-I9 HydrophobicContact CG1-CB 4.47Å; I7-I9 HydrophobicContact CG2-CB 4.32Å
8	L	29	Very low	30.9	Very low	41 Å²	41	122.3 Å²	122.3	22%	0.215	61%	0.61	C	S	.	*			cis	62.4	31.8	-23.4	-124.7	166.3	0	0	0	118.9	H499 Q501	L8-H499 HydrophobicContact CD1-CB 4.09Å; L8-H499 WeakPolarHBondContact CD1-O 3.48Å; L8-H499 HydrophobicContact CD2-CB 3.79Å; L8-H499 VanDerWaalsContact CD2-O 3.29Å; L8-H499 WeakPolarHBondContact CD2-O 3.39Å; L8-H499 HydrophobicContact CG-CB 4.04Å; L8-Q501 HydrophobicContact CD1-CG 4.16Å
9	I	29.3	Very low	30.7	Very low	128 Å²	128	123.1 Å²	123.1	66%	0.656	62%	0.621	S	S	*	*			trans	-154.7	30.1	166.9	-105.8	148	0	0	0	110.6	I7	I7-I9 HydrophobicContact CG1-CB 4.47Å; I7-I9 HydrophobicContact CG2-CB 4.32Å
10	I	33.8	Very low	30.6	Very low	151 Å²	151	123.1 Å²	123.1	77%	0.774	62%	0.623	S	S	*	*			trans	-141.4	109.3	154.9	-51.1	177.8	0	0	0	106.3
11	L	28.6	Very low	30.4	Very low	57 Å²	57	122.4 Å²	122.4	30%	0.298	63%	0.625	S	S	.	*			cis	65.9	117.5	-4.3	-57.3	-178	0	0	0	118.9	H498	L11-H498 HydrophobicContact CD1-CB 4.03Å; L11-H498 VanDerWaalsContact CD2-CE1 3.46Å; L11-H498 WeakPolarHBondContact CD2-CE1 3.38Å
12	Y	27.4	Very low	30.1	Very low	178 Å²	178	125 Å²	125	70%	0.698	64%	0.635	S	S	*	*			trans	77.3	39.2	139.2	-97.1	-86.2	0	0	0	121.7	I14	Y12-I14 HydrophobicContact CD1-CD1 3.57Å; Y12-I14 HydrophobicContact CE1-CD1 3.52Å; Y12-I14 HydrophobicContact CG-CD1 4.47Å
13	I	31.3	Very low	29.8	Very low	161 Å²	161	122.2 Å²	122.2	83%	0.826	64%	0.635	S	S	*	*			trans	-140.2	100.1	146.7	-60.4	-175.5	0	0	0	104.3
14	I	29.7	Very low	29.2	Very low	106 Å²	106	123.6 Å²	123.6	54%	0.544	64%	0.637	S	S	.	*			cis	54.5	111.7	40.9	-56.3	-175.4	0	0	0	110.2	Y12	Y12-I14 HydrophobicContact CD1-CD1 3.57Å; Y12-I14 HydrophobicContact CE1-CD1 3.52Å; Y12-I14 HydrophobicContact CG-CD1 4.47Å
15	P	30.5	Very low	28.7	Very low	104 Å²	104	125.5 Å²	125.5	68%	0.675	65%	0.653	S	S	*	*			cis	-106.1	170.6	32.2	42.7	-35.9	0	0	0	112.5
16	S	26	Very low	28.7	Very low	86 Å²	86	124.6 Å²	124.6	60%	0.601	66%	0.656	S	S	*	*			cis	59.4	138.3	45.7	-33.6	0	0	0	0	110.3
17	Y	27.9	Very low	28.9	Very low	197 Å²	197	124.1 Å²	124.1	77%	0.773	66%	0.657	S	S	*	*			cis	-133.9	143.7	24.8	-87.9	-112	0	0	0	108.8
18	I	27.4	Very low	28.5	Very low	126 Å²	126	125.7 Å²	125.7	65%	0.646	67%	0.666	S	S	*	*				52.6	83.8	82.9	-48.7	173.5	0	0	0	113.9	N20	I18-N20 HydrophobicContact CG2-CB 4.01Å
19	V	27.4	Very low	28.7	Very low	136 Å²	136	128.2 Å²	128.2	82%	0.824	69%	0.687	S	S	*	*			trans	-150.8	96.8	142.1	-176.5	0	0	0	0	103.9
20	N	28.8	Very low	28.8	Very low	124 Å²	124	130.1 Å²	130.1	66%	0.663	70%	0.697	S	S	*	*			cis	66.1	145.6	32.6	-154.5	14.2	0	0	0	113.6	I18	I18-N20 HydrophobicContact CG2-CB 4.01Å
21	T	25.1	Very low	28.7	Very low	109 Å²	109	129.2 Å²	129.2	67%	0.669	69%	0.694	S	S	*	*			trans	66.1	119.4	-160.4	70.4	0	0	0	0	112.1
22	H	25.8	Very low	28.7	Very low	173 Å²	173	134 Å²	134	80%	0.801	72%	0.72	S	S	*	*				60.3	117.9	73.6	-71.4	-46.3	0	0	0	113.9
23	N	26.4	Very low	28.9	Very low	143 Å²	143	134 Å²	134	77%	0.765	73%	0.726	S	S	*	*			trans	32.2	139.6	142.3	-71.3	1.8	0	0	0	121.1
24	I	25.5	Very low	29	Very low	154 Å²	154	136.5 Å²	136.5	79%	0.79	73%	0.731	S	S	*	*			trans	92.1	94.6	156.9	-59	143.8	0	0	0	116.4
25	S	26.9	Very low	29.3	Very low	96 Å²	96	136.3 Å²	136.3	67%	0.671	73%	0.731	S	S	*	*			trans	54.3	133.6	137.3	74.3	0	0	0	0	123.4
26	S	30.3	Very low	30	Very low	96 Å²	96	135.2 Å²	135.2	67%	0.671	73%	0.726	S	S	*	*				88.4	137.1	127	74.9	0	0	0	0	121.8
27	I	31.4	Very low	31.4	Very low	138 Å²	138	137.1 Å²	137.1	71%	0.708	73%	0.727	S	S	*	*			trans	83.1	88.5	145.3	-67.9	159.7	0	0	0	118.7
28	N	30.7	Very low	33.2	Very low	135 Å²	135	128.5 Å²	128.5	72%	0.722	70%	0.695	S	S	*	*				68.9	142.5	117.7	-55.4	-5.4	0	0	0	123.3
29	S	31.6	Very low	35.4	Very low	94 Å²	94	122.7 Å²	122.7	66%	0.657	67%	0.666	S	S	*	*			trans	57	117.4	141.6	60.8	0	0	0	0	119.1
30	I	32.8	Very low	38	Very low	168 Å²	168	118.7 Å²	118.7	86%	0.862	64%	0.643	S	S	*	*				-143.2	133.7	86.7	-91.5	149.7	0	0	0	108.6
31	D	31.6	Very low	40.6	Very low	132 Å²	132	113.1 Å²	113.1	71%	0.706	61%	0.613	S	S	*	*			trans	-71.1	151.9	174.7	-56	-99.4	0	0	0	111.8
32	N	28.5	Very low	43.4	Very low	157 Å²	157	111.5 Å²	111.5	84%	0.84	60%	0.595	S	S	*	*				-168.9	158.1	120	-97.4	-45	0	0	0	112.9
33	E	31.3	Very low	46.2	Very low	179 Å²	179	109.5 Å²	109.5	84%	0.836	59%	0.586	S	S	*	*			trans	59	91.2	172.9	-53	-139	129	0	0	117	L35	E33-L35 PolarHBondContact O-N 2.94Å
34	K	33.1	Very low	49	Very low	213 Å²	213	103.8 Å²	103.8	93%	0.926	56%	0.556	S	S	*	*			trans	-87.5	79.5	-169.9	-170.9	178.9	-173.3	174	0	112.1	S36	K34-S36 PolarHBondContact O-N 3.39Å
35	L	36.1	Very low	52	Low	103 Å²	103	100.7 Å²	100.7	54%	0.539	54%	0.54	S	S	.	.			trans	-57.1	132.6	173.5	-101.4	67.3	0	0	0	111.7	E33 I37 N158	E33-L35 PolarHBondContact O-N 2.94Å; L35-I37 PolarHBondContact O-N 3.43Å; L35-N158 HydrophobicContact CD2-CB 3.8Å; L35-N158 VanDerWaalsContact CD2-CG 3.46Å
36	S	45.8	Very low	54.8	Low	81 Å²	81	97.5 Å²	97.5	57%	0.566	52%	0.515	S	S	*	.			trans	-77.4	102.8	-175.9	45	0	0	0	0	112.5	K34 I38 N88	K34-S36 PolarHBondContact O-N 3.39Å; S36-I38 PolarHBondContact O-N 3.05Å; S36-N88 PolarHBondContact O-ND2 3.22Å; S36-N88 PolarHBondContact OG-ND2 3.15Å
37	I	55	Low	57.4	Low	125 Å²	125	96.9 Å²	96.9	64%	0.641	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-75.4	116.7	174.1	-55.2	173.9	0	0	0	109.7	L35	L35-I37 PolarHBondContact O-N 3.43Å
38	I	64.5	Low	59.8	Low	16 Å²	16	94.5 Å²	94.5	8%	0.082	49%	0.489	C	S	.	.	P	Polyproline II helix	trans	-61.3	138	179.4	-61.9	-173.3	0	0	0	111.5	S36 P64 L90 T156	S36-I38 PolarHBondContact O-N 3.05Å; I38-P64 HydrophobicContact CG2-CB 3.72Å; I38-P64 HydrophobicContact CG2-CG 3.6Å; I38-L90 HydrophobicContact CD1-CB 4.14Å; I38-L90 HydrophobicContact CD1-CD1 3.95Å; I38-T156 HydrophobicContact CD1-CG2 3.36Å; I38-T156 HydrophobicContact CG1-CG2 3.95Å
39	G	73.8	Confident	61.6	Low	5 Å²	5	90.2 Å²	90.2	5%	0.052	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-62.9	172.9	174.9	0	0	0	0	0	114.9	P64 D66	G39-P64 VanDerWaalsContact O-CG 3.24Å; G39-P64 WeakPolarHBondContact O-CG 3.07Å; G39-D66 PolarHBondContact N-OD2 3.13Å
40	P	82.4	Confident	63	Low	51 Å²	51	87.6 Å²	87.6	33%	0.331	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-70.6	154.1	177.8	31.1	-34.7	0	0	0	111.9	R162 A164	P40-R162 WeakPolarHBondContact CA-O 3.45Å; P40-R162 HydrophobicContact CB-CB 4.02Å; P40-R162 HydrophobicContact CG-CB 4.43Å; P40-A164 HydrophobicContact CB-CB 4.46Å
41	P	83.5	Confident	64.1	Low	7 Å²	7	83.4 Å²	83.4	5%	0.045	43%	0.433	C	S	.	.	P	Polyproline II helix	trans	-57.3	151.1	165.6	-21.8	33.9	0	0	0	111.9	W61 Y93 V152 A164	P41-W61 HydrophobicContact CB-CB 3.96Å; P41-W61 HydrophobicContact CB-CG 3.99Å; P41-Y93 HydrophobicContact CG-CD1 4.02Å; P41-Y93 HydrophobicContact CG-CE1 4.08Å; P41-V152 VanDerWaalsContact CD-O 3.26Å; P41-V152 WeakPolarHBondContact CD-O 3.3Å; P41-V152 HydrophobicContact CG-CB 4.31Å; P41-V152 HydrophobicContact CG-CG1 4.06Å; P41-V152 WeakPolarHBondContact CG-O 3.14Å; P41-A164 HydrophobicContact CB-CB 4.44Å; P41-A164 WeakPolarHBondContact O-CB 3.49Å
42	R	84.9	Confident	65.3	Low	76 Å²	76	84 Å²	84	29%	0.287	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	161	176.1	-75.5	178.1	-73.1	174.9	-5.9	110.8	L44 W61 L62 P63	R42-L44 PolarHBondContact O-N 3Å; R42-W61 CarbonylContact O-C 3.5Å; R42-W61 WeakPolarHBondContact O-CA 3.45Å; R42-W61 WeakPolarHBondContact O-CB 3.5Å; R42-L62 HydrophobicContact CB-CB 3.93Å; R42-L62 PolarHBondContact N-O 3.17Å; R42-L62 PolarHBondContact O-N 3.3Å; R42-P63 VanDerWaalsContact CZ-O 3.26Å; R42-P63 PolarHBondContact NE-O 3.03Å; R42-P63 PolarHBondContact NH2-O 3.03Å
43	E	83.5	Confident	66.5	Low	130 Å²	130	80.8 Å²	80.8	61%	0.607	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	49.9	56.4	166.6	-67.7	169.6	-140.7	0	0	115	I45 L62	E43-I45 PolarHBondContact O-N 2.93Å; E43-L62 HydrophobicContact CB-CG 4.38Å; E43-L62 VanDerWaalsContact CD-CD1 3.47Å; E43-L62 HydrophobicContact CG-CD1 4.45Å; E43-L62 WeakPolarHBondContact OE1-CD1 3.44Å; E43-L62 VanDerWaalsContact OE2-CD1 3.31Å; E43-L62 WeakPolarHBondContact OE2-CD1 3.41Å
44	L	86.3	Confident	67.9	Low	24 Å²	24	78 Å²	78	13%	0.126	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	90.6	177.7	-178.7	58.1	0	0	0	112.1	R42 L46 A59 S60 W61 V152 A164	R42-L44 PolarHBondContact O-N 3Å; L44-L46 HydrophobicContact CD1-CD2 4.27Å; L44-L46 HydrophobicContact CG-CD2 4.46Å; L44-A59 HydrophobicContact CD1-CB 4.13Å; L44-S60 CarbonylContact C-O 3.6Å; L44-S60 WeakPolarHBondContact CA-O 3.46Å; L44-W61 HydrophobicContact CD1-CB 4.44Å; L44-W61 HydrophobicContact CD1-CE3 4.08Å; L44-V152 HydrophobicContact CD1-CG2 3.74Å; L44-V152 HydrophobicContact CD2-CG2 4.07Å; L44-A164 HydrophobicContact CD2-CB 4.49Å; L44-A164 WeakPolarHBondContact CD2-O 3.47Å
45	I	87	Confident	69.5	Low	89 Å²	89	67.9 Å²	67.9	46%	0.456	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	139.3	174.7	-60.9	168.1	0	0	0	109.4	E43 E47 A59 S60	E43-I45 PolarHBondContact O-N 2.93Å; I45-E47 HydrophobicContact CG2-CG 4.37Å; I45-A59 WeakPolarHBondContact O-CA 3.06Å; I45-S60 PolarHBondContact N-O 3.17Å; I45-S60 PolarHBondContact O-N 3.36Å
46	L	87.1	Confident	71.4	Confident	29 Å²	29	63.1 Å²	63.1	15%	0.152	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	134.2	174.3	-58.4	-179.5	0	0	0	111.2	L44 I57 K58 A59 V150 I168	L44-L46 HydrophobicContact CD1-CD2 4.27Å; L44-L46 HydrophobicContact CG-CD2 4.46Å; L46-I57 HydrophobicContact CD2-CG2 4.18Å; L46-K58 CarbonylContact C-O 3.3Å; L46-K58 VanDerWaalsContact CA-O 3.29Å; L46-K58 WeakPolarHBondContact CA-O 3.31Å; L46-A59 HydrophobicContact CD2-CB 3.55Å; L46-V150 HydrophobicContact CD1-CB 3.98Å; L46-V150 HydrophobicContact CD1-CG2 3.62Å; L46-V150 HydrophobicContact CD2-CB 3.99Å; L46-V150 HydrophobicContact CD2-CG1 4.04Å; L46-V150 HydrophobicContact CD2-CG2 3.99Å; L46-V150 HydrophobicContact CG-CG2 4.5Å; L46-I168 HydrophobicContact CB-CB 4.16Å; L46-I168 HydrophobicContact CB-CD1 3.95Å; L46-I168 HydrophobicContact CD1-CB 3.95Å; L46-I168 HydrophobicContact CD1-CG2 3.95Å
47	E	85.1	Confident	73.2	Confident	82 Å²	82	59.3 Å²	59.3	38%	0.383	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	150.5	-179.2	-69.3	169.4	-146.9	0	0	111.7	I45 A49 I57 K58	I45-E47 HydrophobicContact CG2-CG 4.37Å; E47-A49 PolarHBondContact O-N 3.12Å; E47-I57 WeakPolarHBondContact O-CA 3.47Å; E47-K58 HydrophobicContact CB-CB 4.27Å; E47-K58 HydrophobicContact CB-CD 4.41Å; E47-K58 PolarHBondContact N-O 3.23Å; E47-K58 PolarHBondContact O-N 3.17Å; E47-K58 IonicContact OE1-NZ 3.19Å; E47-K58 PolarHBondContact OE1-NZ 3.04Å; E47-K58 WeakPolarHBondContact OE2-CD 3.32Å; E47-K58 IonicContact OE2-NZ 2.73Å; E47-K58 PolarHBondContact OE2-NZ 2.94Å
48	I	80.7	Confident	74.7	Confident	88 Å²	88	55.5 Å²	55.5	45%	0.451	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	105.8	166.8	-57.6	163.2	0	0	0	107.8	C56 I168	I48-C56 WeakPolarHBondContact CA-O 3.49Å; I48-I168 HydrophobicContact CG1-CD1 4.03Å
49	A	68	Low	75.9	Confident	46 Å²	46	54.7 Å²	54.7	38%	0.38	28%	0.275	S	S	.	.			trans	-103.4	8.4	-171.2	0	0	0	0	0	114.9	E47 C56 K58 T136	E47-A49 PolarHBondContact O-N 3.12Å; A49-C56 PolarHBondContact N-O 3.08Å; A49-C56 VanDerWaalsContact N-O 3.13Å; A49-K58 HydrophobicContact CB-CB 3.53Å; A49-K58 HydrophobicContact CB-CD 4.41Å; A49-T136 HydrophobicContact CB-CG2 3.86Å
50	C	62.1	Low	76.5	Confident	39 Å²	39	55.6 Å²	55.6	26%	0.264	28%	0.28	S	S	.	.	S	Bend	trans	-137.5	158.6	178.7	-67.3	0	0	0	0	111.9	R54 C56	C50-R54 WeakPolarHBondContact CB-O 3.16Å; C50-C56 HydrophobicContact CB-CB 3.51Å; C50-C56 WeakPolarHBondContact CB-SG 3.38Å; C50-C56 WeakPolarHBondContact SG-CB 3.27Å; C50-C56 CovalentContact SG-SG 2.02Å; C50-C56 PolarHBondContact SG-SG 2.63Å
51	D	56.7	Low	76.9	Confident	80 Å²	80	53.5 Å²	53.5	43%	0.428	27%	0.266	S	S	.	.			trans	-61.3	158.1	-174.8	-168.7	19.6	0	0	0	114.2	L53 R54 P772	D51-L53 PolarHBondContact O-N 3.48Å; D51-R54 CarbonylContact O-C 3.59Å; D51-R54 PolarHBondContact O-N 3.18Å; D51-P772 HydrophobicContact CB-CB 4.44Å; D51-P772 VanDerWaalsContact OD2-C 3.31Å; D51-P772 WeakPolarHBondContact OD2-CA 3.4Å; D51-P772 WeakPolarHBondContact OD2-CB 3.27Å
52	Q	54.9	Low	77	Confident	145 Å²	145	56.3 Å²	56.3	68%	0.678	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-5.6	-170.9	-59.5	-171.7	0.3	0	0	115.1	F144	Q52-F144 WeakPolarHBondContact O-CE1 3.49Å
53	L	53.9	Low	76.7	Confident	89 Å²	89	54.3 Å²	54.3	47%	0.466	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	-1.3	179.2	-77.1	164.9	0	0	0	114.6	D51 F144 P772	D51-L53 PolarHBondContact O-N 3.48Å; L53-F144 WeakPolarHBondContact O-CZ 3.5Å; L53-P772 HydrophobicContact CB-CB 3.83Å; L53-P772 HydrophobicContact CB-CG 3.73Å; L53-P772 HydrophobicContact CD1-CB 3.87Å; L53-P772 HydrophobicContact CD1-CG 3.72Å; L53-P772 HydrophobicContact CG-CB 4.44Å; L53-P772 HydrophobicContact CG-CG 4.37Å
54	R	60.6	Low	76.5	Confident	120 Å²	120	48.2 Å²	48.2	45%	0.453	25%	0.249	S	C	.	.	S	Bend	trans	-154.5	98.7	165.8	-64.1	-170.7	-171.2	178.6	3.6	110	C50 D51 P139 E550	C50-R54 WeakPolarHBondContact CB-O 3.16Å; D51-R54 CarbonylContact O-C 3.59Å; D51-R54 PolarHBondContact O-N 3.18Å; R54-P139 HydrophobicContact CB-CB 3.73Å; R54-E550 IonicContact NH2-OE1 2.79Å; R54-E550 PolarHBondContact NH2-OE1 2.94Å; R54-E550 VanDerWaalsContact NH2-OE1 3.12Å
55	P	68.1	Low	75.7	Confident	1 Å²	1	51.9 Å²	51.9	1%	0.006	27%	0.268	C	S	.	.			trans	-71.1	140.1	-171.3	30.2	-35	0	0	0	111.6	G140 H142 F144 T170	P55-G140 PolarHBondContact O-N 3.25Å; P55-H142 HydrophobicContact CG-CB 4.28Å; P55-H142 VanDerWaalsContact CG-O 3.29Å; P55-H142 WeakPolarHBondContact CG-O 3.36Å; P55-F144 HydrophobicContact CG-CD1 4.14Å; P55-F144 HydrophobicContact CG-CE1 4.24Å; P55-F144 HydrophobicContact CG-CG 4.48Å; P55-T170 HydrophobicContact CB-CG2 4.07Å; P55-T170 HydrophobicContact CG-CG2 4.41Å
56	C	76.3	Confident	74.5	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.014	27%	0.267	C	S	.	.			trans	-126.8	143	168.8	-55.4	0	0	0	0	109.8	I48 A49 C50 T136 S137 P139	I48-C56 WeakPolarHBondContact CA-O 3.49Å; A49-C56 PolarHBondContact N-O 3.08Å; A49-C56 VanDerWaalsContact N-O 3.13Å; C50-C56 HydrophobicContact CB-CB 3.51Å; C50-C56 WeakPolarHBondContact CB-SG 3.38Å; C50-C56 WeakPolarHBondContact SG-CB 3.27Å; C50-C56 CovalentContact SG-SG 2.02Å; C50-C56 PolarHBondContact SG-SG 2.63Å; C56-T136 HydrophobicContact CB-CG2 3.96Å; C56-S137 VanDerWaalsContact CA-OG 3.25Å; C56-S137 WeakPolarHBondContact CA-OG 3.34Å; C56-S137 PolarHBondContact SG-O 3.35Å; C56-S137 VanDerWaalsContact SG-O 3.39Å; C56-P139 WeakPolarHBondContact SG-CA 3.49Å
57	I	83.7	Confident	73	Confident	2 Å²	2	53.6 Å²	53.6	1%	0.01	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	113.6	169	-61.4	167.9	0	0	0	107.4	L46 E47 Y97 S137 Y148 V150 I168	L46-I57 HydrophobicContact CD2-CG2 4.18Å; E47-I57 WeakPolarHBondContact O-CA 3.47Å; I57-Y97 HydrophobicContact CB-CE1 3.98Å; I57-Y97 HydrophobicContact CD1-CD1 4.21Å; I57-Y97 HydrophobicContact CD1-CE1 4.1Å; I57-Y97 HydrophobicContact CG2-CE1 3.96Å; I57-S137 PolarHBondContact N-OG 3.01Å; I57-S137 PolarHBondContact O-N 3.3Å; I57-Y148 HydrophobicContact CD1-CD2 3.93Å; I57-Y148 HydrophobicContact CD1-CG 3.81Å; I57-V150 HydrophobicContact CG2-CG2 4.32Å; I57-I168 HydrophobicContact CB-CG2 4.45Å; I57-I168 HydrophobicContact CD1-CG2 3.46Å; I57-I168 VanDerWaalsContact CD1-CG2 3.46Å; I57-I168 HydrophobicContact CG1-CG2 3.73Å; I57-I168 HydrophobicContact CG2-CD1 4.44Å; I57-I168 HydrophobicContact CG2-CG2 3.86Å
58	K	86.3	Confident	71.3	Confident	44 Å²	44	55.1 Å²	55.1	19%	0.191	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	131.5	162.8	168.3	-173.2	163.9	-148.4	0	108	L46 E47 A49 Y135 T136	L46-K58 CarbonylContact C-O 3.3Å; L46-K58 VanDerWaalsContact CA-O 3.29Å; L46-K58 WeakPolarHBondContact CA-O 3.31Å; E47-K58 HydrophobicContact CB-CB 4.27Å; E47-K58 HydrophobicContact CB-CD 4.41Å; E47-K58 PolarHBondContact N-O 3.23Å; E47-K58 PolarHBondContact O-N 3.17Å; E47-K58 IonicContact OE1-NZ 3.19Å; E47-K58 PolarHBondContact OE1-NZ 3.04Å; E47-K58 WeakPolarHBondContact OE2-CD 3.32Å; E47-K58 IonicContact OE2-NZ 2.73Å; E47-K58 PolarHBondContact OE2-NZ 2.94Å; A49-K58 HydrophobicContact CB-CB 3.53Å; A49-K58 HydrophobicContact CB-CD 4.41Å; K58-Y135 CarbonylContact C-O 3.51Å; K58-Y135 WeakPolarHBondContact CA-O 3.38Å; K58-T136 HydrophobicContact CB-CG2 4.25Å
59	A	88.3	Confident	69.7	Low	0 Å²	0	58.7 Å²	58.7	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	138.5	170.5	0	0	0	0	0	108.8	L44 I45 L46 W61 I95 Q134 Y135	L44-A59 HydrophobicContact CD1-CB 4.13Å; I45-A59 WeakPolarHBondContact O-CA 3.06Å; L46-A59 HydrophobicContact CD2-CB 3.55Å; A59-W61 HydrophobicContact CB-CE3 4.32Å; A59-W61 HydrophobicContact CB-CZ3 3.94Å; A59-W61 WeakPolarHBondContact O-CZ3 3.4Å; A59-I95 HydrophobicContact CB-CD1 3.71Å; A59-Q134 CarbonylContact O-C 2.92Å; A59-Q134 VanDerWaalsContact O-CA 3.23Å; A59-Q134 WeakPolarHBondContact O-CA 3.26Å; A59-Y135 PolarHBondContact N-O 3.23Å; A59-Y135 PolarHBondContact O-N 3.06Å
60	S	88.1	Confident	68.5	Low	23 Å²	23	64.4 Å²	64.4	16%	0.161	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	146.2	173.8	47.4	0	0	0	0	110.8	L44 I45 L133	L44-S60 CarbonylContact C-O 3.6Å; L44-S60 WeakPolarHBondContact CA-O 3.46Å; I45-S60 PolarHBondContact N-O 3.17Å; I45-S60 PolarHBondContact O-N 3.36Å; S60-L133 WeakPolarHBondContact CA-O 3.33Å
61	W	90.4	Very high	67.5	Low	7 Å²	7	70.4 Å²	70.4	3%	0.027	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	159	-172.5	56	89.3	0	0	0	111.5	P41 R42 L44 A59 Y93 I95 I130 G132 L133 V152	P41-W61 HydrophobicContact CB-CB 3.96Å; P41-W61 HydrophobicContact CB-CG 3.99Å; R42-W61 CarbonylContact O-C 3.5Å; R42-W61 WeakPolarHBondContact O-CA 3.45Å; R42-W61 WeakPolarHBondContact O-CB 3.5Å; L44-W61 HydrophobicContact CD1-CB 4.44Å; L44-W61 HydrophobicContact CD1-CE3 4.08Å; A59-W61 HydrophobicContact CB-CE3 4.32Å; A59-W61 HydrophobicContact CB-CZ3 3.94Å; A59-W61 WeakPolarHBondContact O-CZ3 3.4Å; W61-Y93 AromaticContact CD1-CE1 3.99Å; W61-Y93 HydrophobicContact CZ2-CD2 4.22Å; W61-Y93 HydrophobicContact CZ2-CG 4.08Å; W61-Y93 AromaticContact NE1-CD1 3.46Å; W61-Y93 AromaticContact NE1-CD2 3.54Å; W61-Y93 AromaticContact NE1-CE1 3.62Å; W61-Y93 AromaticContact NE1-CE2 3.7Å; W61-Y93 AromaticContact NE1-CG 3.43Å; W61-Y93 AromaticContact NE1-CZ 3.74Å; W61-I95 HydrophobicContact CZ3-CD1 4.39Å; W61-I130 HydrophobicContact CH2-CD1 4.26Å; W61-I130 HydrophobicContact CH2-CG2 4.15Å; W61-I130 HydrophobicContact CZ2-CG2 4.14Å; W61-G132 VanDerWaalsContact CZ2-O 3.25Å; W61-G132 WeakPolarHBondContact CZ2-O 3.43Å; W61-L133 PolarHBondContact N-O 3.43Å; W61-L133 WeakPolarHBondContact O-CB 3.28Å; W61-V152 HydrophobicContact CD2-CG1 3.89Å; W61-V152 HydrophobicContact CD2-CG2 4.45Å; W61-V152 HydrophobicContact CE3-CG1 4.17Å; W61-V152 HydrophobicContact CE3-CG2 4Å; W61-V152 HydrophobicContact CG-CG1 4.41Å; W61-V152 HydrophobicContact CH2-CG1 4.3Å; W61-V152 HydrophobicContact CZ2-CG1 4Å; W61-V152 HydrophobicContact CZ3-CG1 4.37Å; W61-V152 HydrophobicContact CZ3-CG2 4.17Å
62	L	84.9	Confident	66.7	Low	67 Å²	67	73.8 Å²	73.8	35%	0.351	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	156.7	172	-70.4	-173.6	0	0	0	112.2	R42 E43	R42-L62 HydrophobicContact CB-CB 3.93Å; R42-L62 PolarHBondContact N-O 3.17Å; R42-L62 PolarHBondContact O-N 3.3Å; E43-L62 HydrophobicContact CB-CG 4.38Å; E43-L62 VanDerWaalsContact CD-CD1 3.47Å; E43-L62 HydrophobicContact CG-CD1 4.45Å; E43-L62 WeakPolarHBondContact OE1-CD1 3.44Å; E43-L62 VanDerWaalsContact OE2-CD1 3.31Å; E43-L62 WeakPolarHBondContact OE2-CD1 3.41Å
63	P	79.3	Confident	66	Low	34 Å²	34	75.8 Å²	75.8	22%	0.221	36%	0.362	C	S	.	.	P	Polyproline II helix	trans	-60.5	152.2	178.2	-19.6	29.5	0	0	0	113.3	R42 L133	R42-P63 VanDerWaalsContact CZ-O 3.26Å; R42-P63 PolarHBondContact NE-O 3.03Å; R42-P63 PolarHBondContact NH2-O 3.03Å; P63-L133 HydrophobicContact CG-CD1 3.96Å; P63-L133 HydrophobicContact CG-CD2 3.92Å
64	P	77.6	Confident	65.1	Low	1 Å²	1	81 Å²	81	1%	0.006	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-55.6	147.2	165.3	-24.5	35.7	0	0	0	112.1	I38 G39 D66 F67	I38-P64 HydrophobicContact CG2-CB 3.72Å; I38-P64 HydrophobicContact CG2-CG 3.6Å; G39-P64 VanDerWaalsContact O-CG 3.24Å; G39-P64 WeakPolarHBondContact O-CG 3.07Å; P64-D66 VanDerWaalsContact C-N 3.27Å; P64-D66 PolarHBondContact O-N 3.12Å; P64-F67 PolarHBondContact O-N 2.67Å
65	I	69.7	Low	63.9	Low	102 Å²	102	81.6 Å²	81.6	52%	0.523	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-60	-38.5	-175.6	-63.3	170.9	0	0	0	111.5	F67 Q68	I65-F67 PolarHBondContact O-N 3.29Å; I65-Q68 PolarHBondContact O-N 2.8Å
66	D	62.7	Low	62.4	Low	82 Å²	82	90.8 Å²	90.8	44%	0.439	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-55.4	-23.6	-176.8	-41.6	-44.3	0	0	0	113.4	G39 P64	G39-D66 PolarHBondContact N-OD2 3.13Å; P64-D66 VanDerWaalsContact C-N 3.27Å; P64-D66 PolarHBondContact O-N 3.12Å
67	F	55.6	Low	60.5	Low	72 Å²	72	95.9 Å²	95.9	32%	0.316	46%	0.461	S	S	.	.	G	3₁₀ helix	trans	-82.8	-18.3	-178	-143.7	-103	0	0	0	113.8	P64 I65 L90	P64-F67 PolarHBondContact O-N 2.67Å; I65-F67 PolarHBondContact O-N 3.29Å; F67-L90 HydrophobicContact CD2-CB 4.1Å; F67-L90 HydrophobicContact CE2-CB 3.44Å; F67-L90 VanDerWaalsContact CE2-CB 3.44Å; F67-L90 HydrophobicContact CE2-CD2 4.46Å; F67-L90 HydrophobicContact CZ-CB 3.84Å
68	Q	48.4	Very low	58.2	Low	114 Å²	114	101.6 Å²	101.6	53%	0.533	50%	0.496	S	S	.	.	G	3₁₀ helix	trans	-79.6	-24.1	-178.4	-69.2	-173.4	-98.9	0	0	113.2	I65 F70	I65-Q68 PolarHBondContact O-N 2.8Å; Q68-F70 PolarHBondContact O-N 2.93Å
69	Q	48.3	Very low	55.6	Low	162 Å²	162	106.6 Å²	106.6	76%	0.757	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-72.7	-10.2	-178.1	-67.1	-174.3	-10.9	0	0	114.3
70	F	43.1	Very low	53.3	Low	166 Å²	166	113.9 Å²	113.9	73%	0.728	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-90.3	-4.8	-176.2	-90.6	-82	0	0	0	115.6	Q68	Q68-F70 PolarHBondContact O-N 2.93Å
71	F	40.9	Very low	50.6	Low	166 Å²	166	121.5 Å²	121.5	73%	0.728	59%	0.594	S	S	*	*	S	Bend	trans	-106.6	-13.1	-175.9	-85.8	-87	0	0	0	115.5
72	D	39.8	Very low	47.9	Very low	150 Å²	150	129.2 Å²	129.2	80%	0.802	63%	0.63	S	S	*	*	S	Bend	trans	-98.8	18	-169.7	-73.9	-22.7	0	0	0	115.2
73	Q	40.2	Very low	45.5	Very low	187 Å²	187	132.3 Å²	132.3	87%	0.874	65%	0.647	S	S	*	*			trans	-126.4	102.2	173.9	-72.4	-167.3	-11	0	0	113.7
74	K	34.1	Very low	43.3	Very low	200 Å²	200	139.3 Å²	139.3	87%	0.87	68%	0.676	S	S	*	*			trans	-121.1	113.1	151.7	-78.7	-178.3	177.6	175.7	0	108.2
75	D	35.7	Very low	41.4	Very low	132 Å²	132	146.2 Å²	146.2	71%	0.706	71%	0.708	S	S	*	*			trans	-178.1	155.3	141.5	-109.4	-5.5	0	0	0	112.4
76	Y	36.7	Very low	39.9	Very low	193 Å²	193	149.5 Å²	149.5	76%	0.757	73%	0.727	S	S	*	*			trans	42.5	128.6	166	-57.9	-65.1	0	0	0	120.3
77	T	36.3	Very low	39.1	Very low	110 Å²	110	150 Å²	150	68%	0.675	73%	0.725	S	S	*	*			cis	170.7	172.6	-14.9	19.3	0	0	0	0	105.9
78	T	36.5	Very low	39	Very low	122 Å²	122	148.5 Å²	148.5	75%	0.748	72%	0.72	S	S	*	*			trans	77.1	109.1	164.9	68.2	0	0	0	0	120.2
79	N	30.8	Very low	39.5	Very low	149 Å²	149	148.3 Å²	148.3	80%	0.797	72%	0.719	S	S	*	*			trans	39.6	93.6	131.7	-55.3	-7.8	0	0	0	120.6
80	N	39.2	Very low	40.4	Very low	152 Å²	152	142.2 Å²	142.2	81%	0.813	69%	0.692	S	S	*	*				-165.8	132.4	128.9	-89.4	-41.3	0	0	0	107.4
81	K	33.1	Very low	41.9	Very low	183 Å²	183	138.4 Å²	138.4	80%	0.796	68%	0.678	S	S	*	*				58	85.9	77.2	-84.9	-167.5	173.1	-174.8	0	114.5
82	H	32.8	Very low	43.8	Very low	169 Å²	169	131.9 Å²	131.9	78%	0.782	65%	0.652	S	S	*	*			trans	65	143	151.3	-78.2	-88.8	0	0	0	120.4
83	D	34.3	Very low	46.1	Very low	133 Å²	133	125.2 Å²	125.2	71%	0.711	62%	0.616	S	S	*	*			trans	79.1	140.5	161.2	-48.2	-28.7	0	0	0	119.5
84	H	34.5	Very low	48.3	Very low	181 Å²	181	117.7 Å²	117.7	84%	0.838	58%	0.579	S	S	*	*			trans	64.5	101.4	171.6	-53.9	-77.5	0	0	0	120.8
85	E	37.2	Very low	50.9	Low	146 Å²	146	108.1 Å²	108.1	68%	0.682	54%	0.538	S	S	*	.			trans	-140.5	78.1	147.6	-75.3	-149.5	141.1	0	0	112.1	K87	E85-K87 VanDerWaalsContact CD-CE 3.47Å; E85-K87 PolarHBondContact O-N 3.16Å; E85-K87 VanDerWaalsContact OE1-CE 3.25Å; E85-K87 WeakPolarHBondContact OE1-CE 3.11Å; E85-K87 IonicContact OE1-NZ 2.81Å; E85-K87 PolarHBondContact OE1-NZ 2.86Å; E85-K87 WeakPolarHBondContact OE2-CE 3.28Å; E85-K87 IonicContact OE2-NZ 2.77Å; E85-K87 PolarHBondContact OE2-NZ 3.29Å
86	N	38.8	Very low	53.3	Low	170 Å²	170	105.8 Å²	105.8	91%	0.909	52%	0.519	S	S	*	.			trans	-81.8	94.5	165.1	-87.3	0.9	0	0	0	109.5
87	K	45	Very low	55.5	Low	93 Å²	93	96.7 Å²	96.7	40%	0.404	48%	0.483	S	S	.	.			trans	-98.1	116.6	178.2	-76.2	173.3	176	159.9	0	111.2	E85 H89	E85-K87 VanDerWaalsContact CD-CE 3.47Å; E85-K87 PolarHBondContact O-N 3.16Å; E85-K87 VanDerWaalsContact OE1-CE 3.25Å; E85-K87 WeakPolarHBondContact OE1-CE 3.11Å; E85-K87 IonicContact OE1-NZ 2.81Å; E85-K87 PolarHBondContact OE1-NZ 2.86Å; E85-K87 WeakPolarHBondContact OE2-CE 3.28Å; E85-K87 IonicContact OE2-NZ 2.77Å; E85-K87 PolarHBondContact OE2-NZ 3.29Å; K87-H89 VanDerWaalsContact C-N 3.32Å; K87-H89 PolarHBondContact O-N 3.17Å
88	N	53.5	Low	57.3	Low	41 Å²	41	95.2 Å²	95.2	22%	0.219	47%	0.469	C	S	.	.			trans	-65.4	83.3	176.2	-86.7	-14.5	0	0	0	111.5	S36 N158	S36-N88 PolarHBondContact O-ND2 3.22Å; S36-N88 PolarHBondContact OG-ND2 3.15Å; N88-N158 PolarHBondContact OD1-ND2 2.76Å
89	H	59.5	Low	59.2	Low	110 Å²	110	90.3 Å²	90.3	51%	0.509	44%	0.438	S	S	.	.			trans	-72.9	132.2	175.1	-68.9	169.1	0	0	0	111.3	K87 L91 T156	K87-H89 VanDerWaalsContact C-N 3.32Å; K87-H89 PolarHBondContact O-N 3.17Å; H89-L91 PolarHBondContact O-N 3.15Å; H89-T156 WeakPolarHBondContact O-CA 3.41Å
90	L	67.1	Low	61	Low	34 Å²	34	85.5 Å²	85.5	18%	0.178	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	116	168.7	-179.5	74.3	0	0	0	108.2	I38 F67 Y93	I38-L90 HydrophobicContact CD1-CB 4.14Å; I38-L90 HydrophobicContact CD1-CD1 3.95Å; F67-L90 HydrophobicContact CD2-CB 4.1Å; F67-L90 HydrophobicContact CE2-CB 3.44Å; F67-L90 VanDerWaalsContact CE2-CB 3.44Å; F67-L90 HydrophobicContact CE2-CD2 4.46Å; F67-L90 HydrophobicContact CZ-CB 3.84Å; L90-Y93 HydrophobicContact CD2-CE1 4.35Å; L90-Y93 HydrophobicContact CD2-CE2 4.15Å
91	L	73	Confident	62	Low	85 Å²	85	83.7 Å²	83.7	45%	0.445	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	-49.5	-177.2	-59.9	179.1	0	0	0	112.1	H89 V155 E157	H89-L91 PolarHBondContact O-N 3.15Å; L91-V155 PolarHBondContact N-O 3.44Å; L91-E157 HydrophobicContact CD1-CG 3.85Å; L91-E157 HydrophobicContact CD2-CG 4.01Å; L91-E157 HydrophobicContact CG-CG 4.16Å
92	T	82.5	Confident	63.2	Low	29 Å²	29	76.2 Å²	76.2	18%	0.178	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	-178.3	-175	59.9	0	0	0	0	111.1	I130 T131 V155	T92-I130 CarbonylContact C-O 3.5Å; T92-I130 WeakPolarHBondContact CA-O 3.25Å; T92-I130 WeakPolarHBondContact CB-O 3.49Å; T92-T131 HydrophobicContact CG2-CG2 3.9Å; T92-V155 PolarHBondContact N-O 2.97Å; T92-V155 WeakPolarHBondContact O-CA 3.5Å; T92-V155 WeakPolarHBondContact O-CB 3.44Å; T92-V155 PolarHBondContact O-N 3.29Å; T92-V155 WeakPolarHBondContact OG1-CB 3.48Å; T92-V155 WeakPolarHBondContact OG1-CG2 3.5Å
93	Y	86.5	Confident	64.1	Low	11 Å²	11	72.4 Å²	72.4	4%	0.043	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	136.1	165.8	-64.5	-88.1	0	0	0	109.9	P41 W61 L90 N129 I130 G132 L133 V152 A153	P41-Y93 HydrophobicContact CG-CD1 4.02Å; P41-Y93 HydrophobicContact CG-CE1 4.08Å; W61-Y93 AromaticContact CD1-CE1 3.99Å; W61-Y93 HydrophobicContact CZ2-CD2 4.22Å; W61-Y93 HydrophobicContact CZ2-CG 4.08Å; W61-Y93 AromaticContact NE1-CD1 3.46Å; W61-Y93 AromaticContact NE1-CD2 3.54Å; W61-Y93 AromaticContact NE1-CE1 3.62Å; W61-Y93 AromaticContact NE1-CE2 3.7Å; W61-Y93 AromaticContact NE1-CG 3.43Å; W61-Y93 AromaticContact NE1-CZ 3.74Å; L90-Y93 HydrophobicContact CD2-CE1 4.35Å; L90-Y93 HydrophobicContact CD2-CE2 4.15Å; Y93-N129 CarbonylContact O-C 3.45Å; Y93-N129 VanDerWaalsContact O-CA 3.31Å; Y93-N129 WeakPolarHBondContact O-CA 3.27Å; Y93-I130 PolarHBondContact N-O 3.34Å; Y93-I130 PolarHBondContact O-N 3.38Å; Y93-G132 WeakPolarHBondContact CD2-O 3.49Å; Y93-L133 HydrophobicContact CE2-CD2 3.77Å; Y93-L133 WeakPolarHBondContact OH-CD2 3.49Å; Y93-V152 HydrophobicContact CD1-CG1 4.44Å; Y93-A153 CarbonylContact C-O 3.5Å; Y93-A153 WeakPolarHBondContact CA-O 3.37Å
94	R	87.7	Confident	64.9	Low	28 Å²	28	70 Å²	70	11%	0.106	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	121.3	170.9	175.7	-167	64.2	-166.5	3.2	109.6	R96 E127 K128 N129 V152 A153 V155 Y160 D163	R94-R96 HydrophobicContact CG-CG 4.19Å; R94-E127 VanDerWaalsContact CD-CD 3.49Å; R94-E127 WeakPolarHBondContact CD-OE1 3.29Å; R94-E127 HydrophobicContact CG-CG 3.85Å; R94-K128 CarbonylContact C-O 3.58Å; R94-K128 WeakPolarHBondContact CA-O 3.26Å; R94-N129 WeakPolarHBondContact CB-OD1 3.42Å; R94-V152 CarbonylContact O-C 3.55Å; R94-V152 VanDerWaalsContact O-CA 3.26Å; R94-V152 WeakPolarHBondContact O-CA 3.4Å; R94-A153 PolarHBondContact N-O 3.23Å; R94-A153 PolarHBondContact O-N 2.94Å; R94-V155 HydrophobicContact CB-CG2 4.08Å; R94-Y160 HydrophobicContact CB-CD1 4.12Å; R94-Y160 HydrophobicContact CB-CE1 4.08Å; R94-Y160 HydrophobicContact CG-CE1 4.28Å; R94-D163 IonicContact CZ-OD1 2.78Å; R94-D163 IonicContact NE-OD1 2.65Å; R94-D163 VanDerWaalsContact NH2-CG 3.29Å; R94-D163 IonicContact NH2-OD1 2.69Å; R94-D163 PolarHBondContact NH2-OD1 3.23Å; R94-D163 IonicContact NH2-OD2 3.17Å; R94-D163 PolarHBondContact NH2-OD2 2.89Å; R94-D163 VanDerWaalsContact NH2-OD2 3.12Å
95	I	87.4	Confident	65.3	Low	0 Å²	0	64.7 Å²	64.7	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	147.3	164.1	-163	156.5	0	0	0	110.9	A59 W61 Y97 E127 K128 I130 Y135 V150 S151 V152	A59-I95 HydrophobicContact CB-CD1 3.71Å; W61-I95 HydrophobicContact CZ3-CD1 4.39Å; I95-Y97 HydrophobicContact CD1-CE2 4.08Å; I95-Y97 HydrophobicContact CG1-CE2 3.98Å; I95-Y97 HydrophobicContact CG2-CE2 4Å; I95-E127 WeakPolarHBondContact O-CA 3.49Å; I95-K128 HydrophobicContact CG2-CB 3.94Å; I95-K128 PolarHBondContact N-O 2.82Å; I95-K128 PolarHBondContact O-N 3.24Å; I95-I130 HydrophobicContact CB-CD1 3.74Å; I95-I130 HydrophobicContact CG2-CD1 3.36Å; I95-Y135 HydrophobicContact CD1-CD1 4.01Å; I95-Y135 HydrophobicContact CG2-CD1 4.17Å; I95-Y135 HydrophobicContact CG2-CE1 4.41Å; I95-V150 HydrophobicContact CD1-CG1 3.66Å; I95-V150 HydrophobicContact CG1-CG1 3.75Å; I95-S151 CarbonylContact C-O 3.57Å; I95-S151 VanDerWaalsContact CA-O 3.29Å; I95-S151 WeakPolarHBondContact CA-O 2.96Å; I95-V152 HydrophobicContact CB-CG2 4.39Å; I95-V152 HydrophobicContact CD1-CG2 3.95Å; I95-V152 HydrophobicContact CG1-CG2 3.89Å
96	R	85.8	Confident	65.3	Low	82 Å²	82	63.4 Å²	63.4	31%	0.309	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	147.1	169.4	-47	-176.9	-74	167	-7.5	111	R94 T125 I126 E127 V150 S151 D163	R94-R96 HydrophobicContact CG-CG 4.19Å; R96-T125 HydrophobicContact CB-CG2 4.25Å; R96-I126 CarbonylContact C-O 3.58Å; R96-I126 WeakPolarHBondContact CA-O 3.16Å; R96-E127 WeakPolarHBondContact CD-OE2 3.16Å; R96-E127 HydrophobicContact CG-CB 4.22Å; R96-E127 HydrophobicContact CG-CG 3.98Å; R96-V150 CarbonylContact O-C 3.33Å; R96-V150 WeakPolarHBondContact O-CA 3.43Å; R96-S151 WeakPolarHBondContact CB-OG 3.49Å; R96-S151 PolarHBondContact N-O 3.11Å; R96-S151 PolarHBondContact NE-OG 2.84Å; R96-S151 VanDerWaalsContact NE-OG 3.11Å; R96-S151 PolarHBondContact O-N 3.02Å; R96-D163 IonicContact CZ-OD2 3.75Å; R96-D163 IonicContact NH2-OD1 2.69Å; R96-D163 IonicContact NH2-OD2 2.7Å; R96-D163 PolarHBondContact NH2-OD2 3.24Å
97	Y	83.6	Confident	65.5	Low	2 Å²	2	64.5 Å²	64.5	1%	0.008	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	141.1	174.6	-61.5	-97.3	0	0	0	111.2	I57 I95 T125 I126 Y135 H142 E149 V150	I57-Y97 HydrophobicContact CB-CE1 3.98Å; I57-Y97 HydrophobicContact CD1-CD1 4.21Å; I57-Y97 HydrophobicContact CD1-CE1 4.1Å; I57-Y97 HydrophobicContact CG2-CE1 3.96Å; I95-Y97 HydrophobicContact CD1-CE2 4.08Å; I95-Y97 HydrophobicContact CG1-CE2 3.98Å; I95-Y97 HydrophobicContact CG2-CE2 4Å; Y97-T125 VanDerWaalsContact O-CA 3.29Å; Y97-T125 WeakPolarHBondContact O-CA 3.33Å; Y97-T125 WeakPolarHBondContact O-CG2 3.49Å; Y97-I126 HydrophobicContact CD2-CB 4.22Å; Y97-I126 HydrophobicContact CD2-CG2 4.38Å; Y97-I126 PolarHBondContact N-O 3.33Å; Y97-I126 PolarHBondContact O-N 2.86Å; Y97-I126 VanDerWaalsContact O-N 3.12Å; Y97-Y135 HydrophobicContact CE2-CD1 4.48Å; Y97-Y135 HydrophobicContact CE2-CE1 4.01Å; Y97-Y135 VanDerWaalsContact OH-CD1 3.28Å; Y97-Y135 WeakPolarHBondContact OH-CD1 3.25Å; Y97-Y135 VanDerWaalsContact OH-CE1 3.23Å; Y97-Y135 WeakPolarHBondContact OH-CE1 3.26Å; Y97-H142 AromaticContact CD1-CE1 3.43Å; Y97-H142 VanDerWaalsContact CD1-CE1 3.43Å; Y97-H142 WeakPolarHBondContact CD1-CE1 3.13Å; Y97-H142 AromaticContact CE1-CE1 3.7Å; Y97-H142 AromaticContact CE1-NE2 3.85Å; Y97-H142 AromaticContact CG-CE1 3.82Å; Y97-E149 CarbonylContact C-O 3.55Å; Y97-E149 WeakPolarHBondContact CA-O 3.27Å; Y97-V150 HydrophobicContact CD1-CB 4.46Å; Y97-V150 HydrophobicContact CD1-CG1 4.19Å; Y97-V150 HydrophobicContact CD1-CG2 3.71Å; Y97-V150 HydrophobicContact CE1-CG1 3.94Å; Y97-V150 HydrophobicContact CE1-CG2 3.8Å
98	H	75	Confident	65.1	Low	80 Å²	80	66.4 Å²	66.4	37%	0.37	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	147.4	177.3	173.6	48.9	0	0	0	110.7	Y148 E149	H98-Y148 CarbonylContact O-C 3.46Å; H98-Y148 VanDerWaalsContact O-CA 3.28Å; H98-Y148 WeakPolarHBondContact O-CA 3.4Å; H98-E149 HydrophobicContact CB-CB 4.37Å; H98-E149 PolarHBondContact N-O 3.48Å; H98-E149 PolarHBondContact O-N 2.9Å
99	I	75.6	Confident	64.1	Low	18 Å²	18	70.5 Å²	70.5	9%	0.092	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	121.7	177.2	-68.9	169.9	0	0	0	109.2	L143 V146 Y148	I99-L143 HydrophobicContact CD1-CD1 4.18Å; I99-V146 HydrophobicContact CB-CG1 4.27Å; I99-V146 HydrophobicContact CD1-CG1 4.23Å; I99-V146 HydrophobicContact CG1-CG1 3.91Å; I99-V146 HydrophobicContact CG2-CG1 3.51Å; I99-Y148 HydrophobicContact CD1-CE1 4.03Å; I99-Y148 HydrophobicContact CG1-CD1 3.96Å; I99-Y148 HydrophobicContact CG1-CE1 3.44Å; I99-Y148 VanDerWaalsContact CG1-CE1 3.44Å
100	I	69.1	Low	62.9	Low	48 Å²	48	69.9 Å²	69.9	25%	0.246	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	-42.7	-177.3	-45.3	179.1	0	0	0	111.7	I147 E149 R167	I100-I147 HydrophobicContact CD1-CG2 4.3Å; I100-I147 PolarHBondContact N-O 2.67Å; I100-E149 HydrophobicContact CD1-CB 3.71Å; I100-E149 HydrophobicContact CD1-CG 4.15Å; I100-E149 HydrophobicContact CG1-CB 3.79Å; I100-R167 HydrophobicContact CD1-CG 3.82Å
101	H	60.5	Low	61.3	Low	114 Å²	114	73.9 Å²	73.9	53%	0.528	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	113	-168.5	-101.9	31.3	0	0	0	112.9	I147	H101-I147 HydrophobicContact CB-CD1 4.34Å
102	P	56.9	Low	59.5	Low	26 Å²	26	72.7 Å²	72.7	17%	0.169	37%	0.373	C	S	.	.			trans	-74.9	124.2	143.2	-10.8	30.1	0	0	0	108.3	E104 L105 L122	P102-E104 PolarHBondContact O-N 3.11Å; P102-L105 HydrophobicContact CB-CD1 4.15Å; P102-L105 HydrophobicContact CB-CG 4.44Å; P102-L105 HydrophobicContact CG-CD1 3.85Å; P102-L122 HydrophobicContact CG-CD1 4.08Å; P102-L122 HydrophobicContact CG-CD2 3.53Å; P102-L122 HydrophobicContact CG-CG 4.45Å
103	I	52.8	Low	57.3	Low	89 Å²	89	75.2 Å²	75.2	46%	0.456	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	8.8	-159.5	-61.1	170.6	0	0	0	114.5	I207	I103-I207 HydrophobicContact CB-CG1 4.45Å; I103-I207 HydrophobicContact CD1-CD1 4.42Å; I103-I207 HydrophobicContact CG2-CD1 3.8Å; I103-I207 HydrophobicContact CG2-CG1 4.2Å
104	E	50.8	Low	55.1	Low	83 Å²	83	81.4 Å²	81.4	39%	0.388	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.4	-1	-176.1	-74	-175.7	-163.7	0	0	116.8	P102 S106 R204	P102-E104 PolarHBondContact O-N 3.11Å; E104-S106 PolarHBondContact O-N 2.97Å; E104-S106 VanDerWaalsContact O-N 3.14Å; E104-R204 VanDerWaalsContact CD-NH1 3.33Å; E104-R204 IonicContact OE1-NH1 3.27Å; E104-R204 IonicContact OE2-CZ 3.31Å; E104-R204 IonicContact OE2-NH1 3.31Å; E104-R204 PolarHBondContact OE2-NH1 3.02Å
105	L	42.8	Very low	52.7	Low	70 Å²	70	86.8 Å²	86.8	37%	0.366	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-72.2	-7.2	-171.9	-78.9	173.9	0	0	0	115.9	P102 K107 I108 L122	P102-L105 HydrophobicContact CB-CD1 4.15Å; P102-L105 HydrophobicContact CB-CG 4.44Å; P102-L105 HydrophobicContact CG-CD1 3.85Å; L105-K107 PolarHBondContact O-N 3.35Å; L105-I108 HydrophobicContact CD2-CD1 4.46Å; L105-L122 HydrophobicContact CD1-CD1 4.13Å
106	S	37.6	Very low	50.4	Low	119 Å²	119	90.6 Å²	90.6	83%	0.832	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-74.9	15.4	-176.8	62.3	0	0	0	0	115.8	E104	E104-S106 PolarHBondContact O-N 2.97Å; E104-S106 VanDerWaalsContact O-N 3.14Å
107	K	42.2	Very low	48.3	Very low	193 Å²	193	93 Å²	93	84%	0.839	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-133	0.7	-179.6	-72.6	-172.6	177.1	179.1	0	115.5	L105	L105-K107 PolarHBondContact O-N 3.35Å
108	I	36.9	Very low	46.5	Very low	133 Å²	133	95.3 Å²	95.3	68%	0.682	50%	0.496	S	S	*	.			trans	-103.3	107.1	179	-57.2	-179.3	0	0	0	109.1	L105	L105-I108 HydrophobicContact CD2-CD1 4.46Å
109	N	33.3	Very low	45	Very low	126 Å²	126	96.5 Å²	96.5	67%	0.674	50%	0.502	S	S	*	.			trans	-93.6	144.6	177	-104.7	-9.3	0	0	0	111.1
110	V	33.6	Very low	43.6	Very low	98 Å²	98	103.9 Å²	103.9	59%	0.594	53%	0.533	S	S	*	.			trans	64.1	100	140.3	-178.2	0	0	0	0	117.9
111	D	33.4	Very low	42.7	Very low	118 Å²	118	105 Å²	105	63%	0.631	54%	0.539	S	S	*	.			trans	69.1	132.2	135	-49.1	-9.4	0	0	0	123.5
112	N	35.2	Very low	42.3	Very low	60 Å²	60	101.3 Å²	101.3	32%	0.321	52%	0.523	S	S	.	.			trans	100.3	9.4	148.5	-49.9	-74	0	0	0	121.4	L827 S828 L831	N112-L827 HydrophobicContact CB-CB 3.67Å; N112-S828 VanDerWaalsContact CG-CA 3.42Å; N112-S828 PolarHBondContact ND2-OG 3.43Å; N112-L831 WeakPolarHBondContact O-CD1 3.36Å
113	D	37.3	Very low	42	Very low	81 Å²	81	104.4 Å²	104.4	43%	0.433	54%	0.542	S	S	.	.			trans	-100.5	113.7	165.5	-133.1	-44	0	0	0	111.7	N115 L827	D113-N115 PolarHBondContact O-N 2.95Å; D113-N115 PolarHBondContact OD1-ND2 3.2Å; D113-L827 HydrophobicContact CB-CD1 4.13Å
114	H	39.9	Very low	42.1	Very low	142 Å²	142	106.4 Å²	106.4	66%	0.657	55%	0.547	S	S	*	.			trans	-79.8	-1.4	177.4	-82.6	-1.4	0	0	0	113.6	N116 L831	H114-N116 PolarHBondContact O-N 3.38Å; H114-L831 HydrophobicContact CB-CD1 4.44Å; H114-L831 HydrophobicContact CB-CD2 3.77Å
115	N	37	Very low	42.8	Very low	140 Å²	140	106.2 Å²	106.2	75%	0.749	55%	0.552	S	S	*	*			trans	-73.6	36	-180	-69.6	-63.1	0	0	0	114.4	D113 L117	D113-N115 PolarHBondContact O-N 2.95Å; D113-N115 PolarHBondContact OD1-ND2 3.2Å; N115-L117 PolarHBondContact O-N 3.19Å; N115-L117 VanDerWaalsContact O-N 3.11Å
116	N	40.2	Very low	43.9	Very low	80 Å²	80	104 Å²	104	43%	0.428	54%	0.54	S	S	.	.			trans	-94.1	63.1	-161.6	-155.6	-17.1	0	0	0	113.8	H114 D118 H119	H114-N116 PolarHBondContact O-N 3.38Å; N116-D118 VanDerWaalsContact C-N 3.31Å; N116-D118 PolarHBondContact O-N 3.47Å; N116-H119 PolarHBondContact ND2-CD2 3.18Å; N116-H119 VanDerWaalsContact OD1-CB 3.3Å; N116-H119 WeakPolarHBondContact OD1-CB 3.42Å; N116-H119 PolarHBondContact OD1-CD2 3.46Å; N116-H119 PolarHBondContact OD1-N 2.81Å
117	L	40.7	Very low	45.7	Very low	133 Å²	133	102.9 Å²	102.9	70%	0.696	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-33.3	177.5	-157.4	76.4	0	0	0	112.3	N115 K120	N115-L117 PolarHBondContact O-N 3.19Å; N115-L117 VanDerWaalsContact O-N 3.11Å; L117-K120 PolarHBondContact O-N 2.78Å
118	D	45.1	Very low	47.4	Very low	51 Å²	51	96.2 Å²	96.2	27%	0.273	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-37.7	-175.7	-77.5	-3.7	0	0	0	112.7	N116 K120 L121 L122	N116-D118 VanDerWaalsContact C-N 3.31Å; N116-D118 PolarHBondContact O-N 3.47Å; D118-K120 PolarHBondContact O-N 3.24Å; D118-K120 VanDerWaalsContact O-N 3.16Å; D118-L121 PolarHBondContact O-N 3.35Å; D118-L122 PolarHBondContact O-N 3.42Å; D118-L122 VanDerWaalsContact O-N 3.17Å
119	H	44.8	Very low	49.4	Very low	104 Å²	104	94.2 Å²	94.2	48%	0.481	48%	0.483	S	S	.	.	H	α-helix	trans	-58.3	-30.1	174.5	-99.3	-110.7	0	0	0	113.4	N116 L121 L122 T123	N116-H119 PolarHBondContact ND2-CD2 3.18Å; N116-H119 VanDerWaalsContact OD1-CB 3.3Å; N116-H119 WeakPolarHBondContact OD1-CB 3.42Å; N116-H119 PolarHBondContact OD1-CD2 3.46Å; N116-H119 PolarHBondContact OD1-N 2.81Å; H119-L121 VanDerWaalsContact C-N 3.28Å; H119-L121 PolarHBondContact O-N 3.24Å; H119-L122 PolarHBondContact O-N 3.13Å; H119-T123 PolarHBondContact O-N 3.46Å; H119-T123 PolarHBondContact O-OG1 2.95Å
120	K	46.3	Very low	51.6	Low	173 Å²	173	89 Å²	89	75%	0.752	46%	0.455	S	S	*	.	H	α-helix	trans	-77.3	-14.8	-179.6	-154.2	168.9	-173.3	172.1	0	113.1	L117 D118	L117-K120 PolarHBondContact O-N 2.78Å; D118-K120 PolarHBondContact O-N 3.24Å; D118-K120 VanDerWaalsContact O-N 3.16Å
121	L	49.3	Very low	53.6	Low	72 Å²	72	90.1 Å²	90.1	38%	0.377	46%	0.463	S	S	.	.	H	α-helix	trans	-88	-38.6	169.5	-78.2	157.4	0	0	0	111.7	D118 H119 T123 K124 L202	D118-L121 PolarHBondContact O-N 3.35Å; H119-L121 VanDerWaalsContact C-N 3.28Å; H119-L121 PolarHBondContact O-N 3.24Å; L121-T123 PolarHBondContact O-N 3.33Å; L121-K124 WeakPolarHBondContact O-CB 3.45Å; L121-K124 PolarHBondContact O-N 3.06Å; L121-L202 HydrophobicContact CD1-CD1 4.25Å; L121-L202 HydrophobicContact CD1-CD2 3.92Å
122	L	52.3	Low	55.7	Low	36 Å²	36	85.9 Å²	85.9	19%	0.188	45%	0.447	C	S	.	.	H	α-helix	trans	-63.7	-24.5	178.5	-66.7	177.3	0	0	0	113.9	P102 L105 D118 H119	P102-L122 HydrophobicContact CG-CD1 4.08Å; P102-L122 HydrophobicContact CG-CD2 3.53Å; P102-L122 HydrophobicContact CG-CG 4.45Å; L105-L122 HydrophobicContact CD1-CD1 4.13Å; D118-L122 PolarHBondContact O-N 3.42Å; D118-L122 VanDerWaalsContact O-N 3.17Å; H119-L122 PolarHBondContact O-N 3.13Å
123	T	50.8	Low	58	Low	92 Å²	92	86.3 Å²	86.3	56%	0.564	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	6.4	-177.7	42.3	0	0	0	0	114.3	H119 L121 T125	H119-T123 PolarHBondContact O-N 3.46Å; H119-T123 PolarHBondContact O-OG1 2.95Å; L121-T123 PolarHBondContact O-N 3.33Å; T123-T125 PolarHBondContact O-N 3.2Å
124	K	55.3	Low	60.3	Low	131 Å²	131	88.3 Å²	88.3	57%	0.57	46%	0.455	S	S	*	.			trans	-78.1	102.4	-174.9	-173.5	-169	174.6	-163.8	0	112.8	L121	L121-K124 WeakPolarHBondContact O-CB 3.45Å; L121-K124 PolarHBondContact O-N 3.06Å
125	T	64	Low	62.4	Low	79 Å²	79	83.2 Å²	83.2	49%	0.485	43%	0.431	S	S	.	.			trans	-71.7	140.1	164.3	-47.1	0	0	0	0	110.9	R96 Y97 T123	R96-T125 HydrophobicContact CB-CG2 4.25Å; Y97-T125 VanDerWaalsContact O-CA 3.29Å; Y97-T125 WeakPolarHBondContact O-CA 3.33Å; Y97-T125 WeakPolarHBondContact O-CG2 3.49Å; T123-T125 PolarHBondContact O-N 3.2Å
126	I	66.1	Low	64.7	Low	24 Å²	24	79.4 Å²	79.4	12%	0.123	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	124.5	172.1	-55.4	166.9	0	0	0	107.6	R96 Y97 E141	R96-I126 CarbonylContact C-O 3.58Å; R96-I126 WeakPolarHBondContact CA-O 3.16Å; Y97-I126 HydrophobicContact CD2-CB 4.22Å; Y97-I126 HydrophobicContact CD2-CG2 4.38Å; Y97-I126 PolarHBondContact N-O 3.33Å; Y97-I126 PolarHBondContact O-N 2.86Å; Y97-I126 VanDerWaalsContact O-N 3.12Å; I126-E141 HydrophobicContact CD1-CG 3.93Å
127	E	76.8	Confident	66.6	Low	94 Å²	94	75.7 Å²	75.7	44%	0.439	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	136.2	-176.9	178.7	165.6	148.4	0	0	111.5	R94 I95 R96	R94-E127 VanDerWaalsContact CD-CD 3.49Å; R94-E127 WeakPolarHBondContact CD-OE1 3.29Å; R94-E127 HydrophobicContact CG-CG 3.85Å; I95-E127 WeakPolarHBondContact O-CA 3.49Å; R96-E127 WeakPolarHBondContact CD-OE2 3.16Å; R96-E127 HydrophobicContact CG-CB 4.22Å; R96-E127 HydrophobicContact CG-CG 3.98Å
128	K	76.3	Confident	68.1	Low	54 Å²	54	73.8 Å²	73.8	24%	0.235	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	146.9	-179.4	-72	178.1	177.9	174.4	0	111.8	R94 I95 Y135 N138 E141	R94-K128 CarbonylContact C-O 3.58Å; R94-K128 WeakPolarHBondContact CA-O 3.26Å; I95-K128 HydrophobicContact CG2-CB 3.94Å; I95-K128 PolarHBondContact N-O 2.82Å; I95-K128 PolarHBondContact O-N 3.24Å; K128-Y135 HydrophobicContact CD-CE1 4.45Å; K128-Y135 HydrophobicContact CD-CE2 4.03Å; K128-Y135 WeakPolarHBondContact CD-OH 3.19Å; K128-Y135 WeakPolarHBondContact CE-OH 3.32Å; K128-Y135 PolarHBondContact NZ-OH 2.83Å; K128-N138 PolarHBondContact NZ-ND2 3.18Å; K128-E141 WeakPolarHBondContact CE-OE1 3.45Å; K128-E141 IonicContact NZ-OE1 3.73Å; K128-E141 PolarHBondContact NZ-OE1 2.83Å; K128-E141 IonicContact NZ-OE2 3.23Å; K128-E141 PolarHBondContact NZ-OE2 3.02Å
129	N	79.4	Confident	69.1	Low	90 Å²	90	75 Å²	75	48%	0.481	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	139.3	173.3	-67.7	-13.9	0	0	0	111.1	Y93 R94	Y93-N129 CarbonylContact O-C 3.45Å; Y93-N129 VanDerWaalsContact O-CA 3.31Å; Y93-N129 WeakPolarHBondContact O-CA 3.27Å; R94-N129 WeakPolarHBondContact CB-OD1 3.42Å
130	I	79.3	Confident	69.9	Low	17 Å²	17	72.3 Å²	72.3	9%	0.087	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	131.9	-164.8	-67.8	134.4	0	0	0	110	W61 T92 Y93 I95 Y135	W61-I130 HydrophobicContact CH2-CD1 4.26Å; W61-I130 HydrophobicContact CH2-CG2 4.15Å; W61-I130 HydrophobicContact CZ2-CG2 4.14Å; T92-I130 CarbonylContact C-O 3.5Å; T92-I130 WeakPolarHBondContact CA-O 3.25Å; T92-I130 WeakPolarHBondContact CB-O 3.49Å; Y93-I130 PolarHBondContact N-O 3.34Å; Y93-I130 PolarHBondContact O-N 3.38Å; I95-I130 HydrophobicContact CB-CD1 3.74Å; I95-I130 HydrophobicContact CG2-CD1 3.36Å; I130-Y135 HydrophobicContact CD1-CD1 4.21Å; I130-Y135 HydrophobicContact CD1-CD2 3.73Å; I130-Y135 HydrophobicContact CD1-CG 3.53Å; I130-Y135 HydrophobicContact CG1-CD2 3.63Å; I130-Y135 HydrophobicContact CG1-CE2 4.46Å; I130-Y135 HydrophobicContact CG1-CG 3.92Å
131	T	76.2	Confident	71.1	Confident	122 Å²	122	66.3 Å²	66.3	75%	0.748	37%	0.369	S	S	*	.	S	Bend	trans	-83.7	-20.1	175.6	45	0	0	0	0	114.1	T92	T92-T131 HydrophobicContact CG2-CG2 3.9Å
132	G	76.4	Confident	72.3	Confident	28 Å²	28	63.2 Å²	63.2	29%	0.289	35%	0.353	S	S	.	.	S	Bend	trans	-86.7	173.9	-178.9	0	0	0	0	0	114.8	W61 Y93 Q134	W61-G132 VanDerWaalsContact CZ2-O 3.25Å; W61-G132 WeakPolarHBondContact CZ2-O 3.43Å; Y93-G132 WeakPolarHBondContact CD2-O 3.49Å; G132-Q134 VanDerWaalsContact C-N 3.28Å
133	L	84.2	Confident	73.4	Confident	70 Å²	70	64.3 Å²	64.3	37%	0.366	36%	0.358	S	S	.	.	S	Bend	trans	-89.6	9.6	171	-71.6	175.8	0	0	0	113.3	S60 W61 P63 Y93	S60-L133 WeakPolarHBondContact CA-O 3.33Å; W61-L133 PolarHBondContact N-O 3.43Å; W61-L133 WeakPolarHBondContact O-CB 3.28Å; P63-L133 HydrophobicContact CG-CD1 3.96Å; P63-L133 HydrophobicContact CG-CD2 3.92Å; Y93-L133 HydrophobicContact CE2-CD2 3.77Å; Y93-L133 WeakPolarHBondContact OH-CD2 3.49Å
134	Q	85.5	Confident	74.5	Confident	123 Å²	123	61.6 Å²	61.6	58%	0.575	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149.7	152.2	176.9	60.1	176.7	-11.3	0	0	110.2	A59 G132	A59-Q134 CarbonylContact O-C 2.92Å; A59-Q134 VanDerWaalsContact O-CA 3.23Å; A59-Q134 WeakPolarHBondContact O-CA 3.26Å; G132-Q134 VanDerWaalsContact C-N 3.28Å
135	Y	84.9	Confident	75.4	Confident	34 Å²	34	56 Å²	56	13%	0.133	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	132.7	174.1	171.2	-94.9	0	0	0	110.5	K58 A59 I95 Y97 K128 I130 S137 E141	K58-Y135 CarbonylContact C-O 3.51Å; K58-Y135 WeakPolarHBondContact CA-O 3.38Å; A59-Y135 PolarHBondContact N-O 3.23Å; A59-Y135 PolarHBondContact O-N 3.06Å; I95-Y135 HydrophobicContact CD1-CD1 4.01Å; I95-Y135 HydrophobicContact CG2-CD1 4.17Å; I95-Y135 HydrophobicContact CG2-CE1 4.41Å; Y97-Y135 HydrophobicContact CE2-CD1 4.48Å; Y97-Y135 HydrophobicContact CE2-CE1 4.01Å; Y97-Y135 VanDerWaalsContact OH-CD1 3.28Å; Y97-Y135 WeakPolarHBondContact OH-CD1 3.25Å; Y97-Y135 VanDerWaalsContact OH-CE1 3.23Å; Y97-Y135 WeakPolarHBondContact OH-CE1 3.26Å; K128-Y135 HydrophobicContact CD-CE1 4.45Å; K128-Y135 HydrophobicContact CD-CE2 4.03Å; K128-Y135 WeakPolarHBondContact CD-OH 3.19Å; K128-Y135 WeakPolarHBondContact CE-OH 3.32Å; K128-Y135 PolarHBondContact NZ-OH 2.83Å; I130-Y135 HydrophobicContact CD1-CD1 4.21Å; I130-Y135 HydrophobicContact CD1-CD2 3.73Å; I130-Y135 HydrophobicContact CD1-CG 3.53Å; I130-Y135 HydrophobicContact CG1-CD2 3.63Å; I130-Y135 HydrophobicContact CG1-CE2 4.46Å; I130-Y135 HydrophobicContact CG1-CG 3.92Å; Y135-S137 WeakPolarHBondContact OH-CA 3.26Å; Y135-E141 PolarHBondContact OH-OE2 3.13Å
136	T	84.2	Confident	76	Confident	60 Å²	60	53 Å²	53	37%	0.368	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	129.4	171.8	-54.1	0	0	0	0	109.4	A49 C56 K58	A49-T136 HydrophobicContact CB-CG2 3.86Å; C56-T136 HydrophobicContact CB-CG2 3.96Å; K58-T136 HydrophobicContact CB-CG2 4.25Å
137	S	80.2	Confident	76.8	Confident	3 Å²	3	54.4 Å²	54.4	2%	0.021	31%	0.307	C	S	.	.			trans	-64.1	158.4	176	73.8	0	0	0	0	112.6	C56 I57 Y135 H142	C56-S137 VanDerWaalsContact CA-OG 3.25Å; C56-S137 WeakPolarHBondContact CA-OG 3.34Å; C56-S137 PolarHBondContact SG-O 3.35Å; C56-S137 VanDerWaalsContact SG-O 3.39Å; I57-S137 PolarHBondContact N-OG 3.01Å; I57-S137 PolarHBondContact O-N 3.3Å; Y135-S137 WeakPolarHBondContact OH-CA 3.26Å; S137-H142 WeakPolarHBondContact CB-NE2 3.46Å; S137-H142 PolarHBondContact OG-CD2 3.08Å; S137-H142 PolarHBondContact OG-NE2 3.47Å; S137-H142 VanDerWaalsContact OG-NE2 3.07Å
138	N	72	Confident	77.1	Confident	92 Å²	92	50.2 Å²	50.2	49%	0.492	29%	0.288	S	S	.	.			trans	-67.2	145.1	176.3	-66.1	-34.6	0	0	0	110.7	K128 G140 E141	K128-N138 PolarHBondContact NZ-ND2 3.18Å; N138-G140 PolarHBondContact O-N 2.92Å; N138-G140 VanDerWaalsContact O-N 3.13Å; N138-E141 HydrophobicContact CB-CB 4.09Å; N138-E141 PolarHBondContact N-OE2 3.11Å; N138-E141 WeakPolarHBondContact O-CB 3.36Å; N138-E141 PolarHBondContact O-N 2.74Å
139	P	65.9	Low	77.6	Confident	76 Å²	76	50 Å²	50	49%	0.494	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.3	115.7	175.7	-21.7	30.2	0	0	0	112.4	R54 C56	R54-P139 HydrophobicContact CB-CB 3.73Å; C56-P139 WeakPolarHBondContact SG-CA 3.49Å
140	G	62.1	Low	77.9	Confident	48 Å²	48	45.7 Å²	45.7	50%	0.495	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.9	13.5	-175.4	0	0	0	0	0	114.7	P55 N138 H142	P55-G140 PolarHBondContact O-N 3.25Å; N138-G140 PolarHBondContact O-N 2.92Å; N138-G140 VanDerWaalsContact O-N 3.13Å; G140-H142 PolarHBondContact O-N 2.76Å
141	E	72.5	Confident	78.4	Confident	48 Å²	48	45.4 Å²	45.4	22%	0.224	26%	0.264	C	S	.	.	S	Bend	trans	-69.7	-15.2	166	-170.6	150.6	-121.2	0	0	112.2	I126 K128 Y135 N138	I126-E141 HydrophobicContact CD1-CG 3.93Å; K128-E141 WeakPolarHBondContact CE-OE1 3.45Å; K128-E141 IonicContact NZ-OE1 3.73Å; K128-E141 PolarHBondContact NZ-OE1 2.83Å; K128-E141 IonicContact NZ-OE2 3.23Å; K128-E141 PolarHBondContact NZ-OE2 3.02Å; Y135-E141 PolarHBondContact OH-OE2 3.13Å; N138-E141 HydrophobicContact CB-CB 4.09Å; N138-E141 PolarHBondContact N-OE2 3.11Å; N138-E141 WeakPolarHBondContact O-CB 3.36Å; N138-E141 PolarHBondContact O-N 2.74Å
142	H	74.5	Confident	79	Confident	7 Å²	7	39.6 Å²	39.6	3%	0.032	23%	0.228	C	C	.	.	S	Bend	trans	-118.8	145.5	177.1	-56.7	-69	0	0	0	111.9	P55 Y97 S137 G140 Y148 T170	P55-H142 HydrophobicContact CG-CB 4.28Å; P55-H142 VanDerWaalsContact CG-O 3.29Å; P55-H142 WeakPolarHBondContact CG-O 3.36Å; Y97-H142 AromaticContact CD1-CE1 3.43Å; Y97-H142 VanDerWaalsContact CD1-CE1 3.43Å; Y97-H142 WeakPolarHBondContact CD1-CE1 3.13Å; Y97-H142 AromaticContact CE1-CE1 3.7Å; Y97-H142 AromaticContact CE1-NE2 3.85Å; Y97-H142 AromaticContact CG-CE1 3.82Å; S137-H142 WeakPolarHBondContact CB-NE2 3.46Å; S137-H142 PolarHBondContact OG-CD2 3.08Å; S137-H142 PolarHBondContact OG-NE2 3.47Å; S137-H142 VanDerWaalsContact OG-NE2 3.07Å; G140-H142 PolarHBondContact O-N 2.76Å; H142-Y148 HydrophobicContact CB-CE1 4.32Å; H142-Y148 HydrophobicContact CB-CE2 3.84Å; H142-Y148 AromaticContact ND1-CD1 3.56Å; H142-Y148 AromaticContact ND1-CE1 3.28Å; H142-Y148 VanDerWaalsContact ND1-CE1 3.28Å; H142-Y148 WeakPolarHBondContact ND1-CE1 3.29Å; H142-Y148 AromaticContact ND1-CZ 3.58Å; H142-T170 HydrophobicContact CB-CG2 4.09Å
143	L	74	Confident	79.5	Confident	58 Å²	58	38.3 Å²	38.3	30%	0.304	22%	0.215	S	C	.	.			trans	-70.2	149.5	166.2	-54	178.4	0	0	0	111.4	I99 V146 Y148 T170 L202	I99-L143 HydrophobicContact CD1-CD1 4.18Å; L143-V146 HydrophobicContact CB-CB 4.41Å; L143-V146 HydrophobicContact CB-CG2 3.98Å; L143-V146 HydrophobicContact CD1-CG2 4.48Å; L143-Y148 WeakPolarHBondContact CB-OH 3.41Å; L143-Y148 PolarHBondContact N-OH 3.45Å; L143-T170 WeakPolarHBondContact O-CG2 3.46Å; L143-T170 PolarHBondContact O-OG1 3.19Å; L143-L202 HydrophobicContact CD1-CD1 4.3Å; L143-L202 HydrophobicContact CD2-CD1 3.72Å
144	F	74.6	Confident	79.4	Confident	35 Å²	35	35 Å²	35	15%	0.154	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	152.7	172.8	-61.2	-89.2	0	0	0	112.8	Q52 L53 P55 V146 P171 N205	Q52-F144 WeakPolarHBondContact O-CE1 3.49Å; L53-F144 WeakPolarHBondContact O-CZ 3.5Å; P55-F144 HydrophobicContact CG-CD1 4.14Å; P55-F144 HydrophobicContact CG-CE1 4.24Å; P55-F144 HydrophobicContact CG-CG 4.48Å; F144-V146 PolarHBondContact O-N 3.3Å; F144-P171 WeakPolarHBondContact CB-O 3.09Å; F144-N205 HydrophobicContact CB-CB 3.75Å; F144-N205 WeakPolarHBondContact CB-O 3.17Å; F144-N205 HydrophobicContact CD2-CB 4.24Å; F144-N205 HydrophobicContact CG-CB 4.25Å
145	G	74	Confident	79.2	Confident	14 Å²	14	29.8 Å²	29.8	14%	0.144	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.6	18.4	176.5	0	0	0	0	0	115.4	T170 P171	G145-T170 PolarHBondContact N-OG1 3.11Å; G145-P171 PolarHBondContact N-O 3.44Å
146	V	76.8	Confident	78.8	Confident	17 Å²	17	29 Å²	29	10%	0.103	17%	0.173	C	C	.	.			trans	-116.1	148.7	-175.3	173.6	0	0	0	0	111.4	I99 L143 F144 Y148 T170	I99-V146 HydrophobicContact CB-CG1 4.27Å; I99-V146 HydrophobicContact CD1-CG1 4.23Å; I99-V146 HydrophobicContact CG1-CG1 3.91Å; I99-V146 HydrophobicContact CG2-CG1 3.51Å; L143-V146 HydrophobicContact CB-CB 4.41Å; L143-V146 HydrophobicContact CB-CG2 3.98Å; L143-V146 HydrophobicContact CD1-CG2 4.48Å; F144-V146 PolarHBondContact O-N 3.3Å; V146-Y148 HydrophobicContact CB-CE2 3.92Å; V146-Y148 HydrophobicContact CG1-CD2 4.35Å; V146-Y148 HydrophobicContact CG1-CE2 3.77Å; V146-T170 PolarHBondContact N-OG1 2.95Å; V146-T170 PolarHBondContact O-N 3.29Å; V146-T170 PolarHBondContact O-OG1 3.48Å; V146-T170 VanDerWaalsContact O-OG1 3.05Å
147	I	82.1	Confident	78.1	Confident	53 Å²	53	32.4 Å²	32.4	27%	0.272	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	125.4	176.3	-55.2	176.1	0	0	0	110.2	I100 H101 A169	I100-I147 HydrophobicContact CD1-CG2 4.3Å; I100-I147 PolarHBondContact N-O 2.67Å; H101-I147 HydrophobicContact CB-CD1 4.34Å; I147-A169 HydrophobicContact CG1-CB 4.24Å
148	Y	83.4	Confident	77.4	Confident	6 Å²	6	37 Å²	37	2%	0.024	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	141.4	178.1	-69	-94.6	0	0	0	112	I57 H98 I99 H142 L143 V146 R167 I168 T170	I57-Y148 HydrophobicContact CD1-CD2 3.93Å; I57-Y148 HydrophobicContact CD1-CG 3.81Å; H98-Y148 CarbonylContact O-C 3.46Å; H98-Y148 VanDerWaalsContact O-CA 3.28Å; H98-Y148 WeakPolarHBondContact O-CA 3.4Å; I99-Y148 HydrophobicContact CD1-CE1 4.03Å; I99-Y148 HydrophobicContact CG1-CD1 3.96Å; I99-Y148 HydrophobicContact CG1-CE1 3.44Å; I99-Y148 VanDerWaalsContact CG1-CE1 3.44Å; H142-Y148 HydrophobicContact CB-CE1 4.32Å; H142-Y148 HydrophobicContact CB-CE2 3.84Å; H142-Y148 AromaticContact ND1-CD1 3.56Å; H142-Y148 AromaticContact ND1-CE1 3.28Å; H142-Y148 VanDerWaalsContact ND1-CE1 3.28Å; H142-Y148 WeakPolarHBondContact ND1-CE1 3.29Å; H142-Y148 AromaticContact ND1-CZ 3.58Å; L143-Y148 WeakPolarHBondContact CB-OH 3.41Å; L143-Y148 PolarHBondContact N-OH 3.45Å; V146-Y148 HydrophobicContact CB-CE2 3.92Å; V146-Y148 HydrophobicContact CG1-CD2 4.35Å; V146-Y148 HydrophobicContact CG1-CE2 3.77Å; Y148-R167 VanDerWaalsContact O-CA 3.28Å; Y148-R167 WeakPolarHBondContact O-CA 3.35Å; Y148-I168 PolarHBondContact N-O 2.92Å; Y148-I168 PolarHBondContact O-N 3.18Å; Y148-T170 HydrophobicContact CD2-CG2 3.9Å; Y148-T170 HydrophobicContact CE2-CG2 3.66Å
149	E	87	Confident	77.4	Confident	48 Å²	48	33.9 Å²	33.9	22%	0.224	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	141.7	158.2	-152.5	151.9	72.8	0	0	109.2	Y97 H98 I100 I165 R167	Y97-E149 CarbonylContact C-O 3.55Å; Y97-E149 WeakPolarHBondContact CA-O 3.27Å; H98-E149 HydrophobicContact CB-CB 4.37Å; H98-E149 PolarHBondContact N-O 3.48Å; H98-E149 PolarHBondContact O-N 2.9Å; I100-E149 HydrophobicContact CD1-CB 3.71Å; I100-E149 HydrophobicContact CD1-CG 4.15Å; I100-E149 HydrophobicContact CG1-CB 3.79Å; E149-I165 HydrophobicContact CG-CG2 3.58Å; E149-R167 HydrophobicContact CG-CG 4.26Å; E149-R167 IonicContact OE2-CZ 2.62Å; E149-R167 IonicContact OE2-NE 3.37Å; E149-R167 PolarHBondContact OE2-NE 2.99Å; E149-R167 IonicContact OE2-NH2 3.41Å; E149-R167 PolarHBondContact OE2-NH2 3.08Å
150	V	86.7	Confident	78	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	127.4	179.9	-170.1	0	0	0	0	108.7	L46 I57 I95 R96 Y97 I165 S166	L46-V150 HydrophobicContact CD1-CB 3.98Å; L46-V150 HydrophobicContact CD1-CG2 3.62Å; L46-V150 HydrophobicContact CD2-CB 3.99Å; L46-V150 HydrophobicContact CD2-CG1 4.04Å; L46-V150 HydrophobicContact CD2-CG2 3.99Å; L46-V150 HydrophobicContact CG-CG2 4.5Å; I57-V150 HydrophobicContact CG2-CG2 4.32Å; I95-V150 HydrophobicContact CD1-CG1 3.66Å; I95-V150 HydrophobicContact CG1-CG1 3.75Å; R96-V150 CarbonylContact O-C 3.33Å; R96-V150 WeakPolarHBondContact O-CA 3.43Å; Y97-V150 HydrophobicContact CD1-CB 4.46Å; Y97-V150 HydrophobicContact CD1-CG1 4.19Å; Y97-V150 HydrophobicContact CD1-CG2 3.71Å; Y97-V150 HydrophobicContact CE1-CG1 3.94Å; Y97-V150 HydrophobicContact CE1-CG2 3.8Å; V150-I165 CarbonylContact O-C 3.6Å; V150-I165 VanDerWaalsContact O-CA 3.3Å; V150-I165 WeakPolarHBondContact O-CA 3.43Å; V150-S166 PolarHBondContact N-O 3.35Å; V150-S166 PolarHBondContact O-N 3.02Å
151	S	89.2	Confident	78.7	Confident	12 Å²	12	34.3 Å²	34.3	8%	0.084	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	134.6	178.8	79.8	0	0	0	0	112.2	I95 R96 A164	I95-S151 CarbonylContact C-O 3.57Å; I95-S151 VanDerWaalsContact CA-O 3.29Å; I95-S151 WeakPolarHBondContact CA-O 2.96Å; R96-S151 WeakPolarHBondContact CB-OG 3.49Å; R96-S151 PolarHBondContact N-O 3.11Å; R96-S151 PolarHBondContact NE-OG 2.84Å; R96-S151 VanDerWaalsContact NE-OG 3.11Å; R96-S151 PolarHBondContact O-N 3.02Å; S151-A164 CarbonylContact C-O 2.84Å; S151-A164 WeakPolarHBondContact CA-O 3.37Å
152	V	88.1	Confident	79.1	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	129.3	179.3	-169	0	0	0	0	112.1	P41 L44 W61 Y93 R94 I95 D163 A164	P41-V152 VanDerWaalsContact CD-O 3.26Å; P41-V152 WeakPolarHBondContact CD-O 3.3Å; P41-V152 HydrophobicContact CG-CB 4.31Å; P41-V152 HydrophobicContact CG-CG1 4.06Å; P41-V152 WeakPolarHBondContact CG-O 3.14Å; L44-V152 HydrophobicContact CD1-CG2 3.74Å; L44-V152 HydrophobicContact CD2-CG2 4.07Å; W61-V152 HydrophobicContact CD2-CG1 3.89Å; W61-V152 HydrophobicContact CD2-CG2 4.45Å; W61-V152 HydrophobicContact CE3-CG1 4.17Å; W61-V152 HydrophobicContact CE3-CG2 4Å; W61-V152 HydrophobicContact CG-CG1 4.41Å; W61-V152 HydrophobicContact CH2-CG1 4.3Å; W61-V152 HydrophobicContact CZ2-CG1 4Å; W61-V152 HydrophobicContact CZ3-CG1 4.37Å; W61-V152 HydrophobicContact CZ3-CG2 4.17Å; Y93-V152 HydrophobicContact CD1-CG1 4.44Å; R94-V152 CarbonylContact O-C 3.55Å; R94-V152 VanDerWaalsContact O-CA 3.26Å; R94-V152 WeakPolarHBondContact O-CA 3.4Å; I95-V152 HydrophobicContact CB-CG2 4.39Å; I95-V152 HydrophobicContact CD1-CG2 3.95Å; I95-V152 HydrophobicContact CG1-CG2 3.89Å; V152-D163 CarbonylContact O-C 3.53Å; V152-D163 VanDerWaalsContact O-CA 3.3Å; V152-D163 WeakPolarHBondContact O-CA 3.25Å; V152-A164 PolarHBondContact N-O 2.88Å; V152-A164 PolarHBondContact O-N 3Å
153	A	86.9	Confident	79.6	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	154.3	174.5	0	0	0	0	0	112.5	Y93 R94 R162 D163	Y93-A153 CarbonylContact C-O 3.5Å; Y93-A153 WeakPolarHBondContact CA-O 3.37Å; R94-A153 PolarHBondContact N-O 3.23Å; R94-A153 PolarHBondContact O-N 2.94Å; A153-R162 WeakPolarHBondContact CA-O 3.39Å; A153-R162 WeakPolarHBondContact CB-O 3.47Å; A153-D163 VanDerWaalsContact CB-OD1 3.26Å; A153-D163 WeakPolarHBondContact CB-OD1 3.29Å
154	G	83.5	Confident	80.2	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.01	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	159.2	169.4	0	0	0	0	0	113.2	Y160 G161	G154-Y160 WeakPolarHBondContact O-CA 3.25Å; G154-G161 PolarHBondContact O-N 3.5Å
155	V	81.7	Confident	80.8	Confident	14 Å²	14	43 Å²	43	9%	0.085	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	128.9	178.6	-170.6	0	0	0	0	109.6	L91 T92 R94 Y160	L91-V155 PolarHBondContact N-O 3.44Å; T92-V155 PolarHBondContact N-O 2.97Å; T92-V155 WeakPolarHBondContact O-CA 3.5Å; T92-V155 WeakPolarHBondContact O-CB 3.44Å; T92-V155 PolarHBondContact O-N 3.29Å; T92-V155 WeakPolarHBondContact OG1-CB 3.48Å; T92-V155 WeakPolarHBondContact OG1-CG2 3.5Å; R94-V155 HydrophobicContact CB-CG2 4.08Å; V155-Y160 HydrophobicContact CG1-CD1 4.5Å; V155-Y160 HydrophobicContact CG2-CD1 3.88Å; V155-Y160 HydrophobicContact CG2-CE1 4.11Å
156	T	75.9	Confident	81.5	Confident	17 Å²	17	44 Å²	44	10%	0.104	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	172.9	177.1	62.8	0	0	0	0	110.7	I38 H89 N158 G159	I38-T156 HydrophobicContact CD1-CG2 3.36Å; I38-T156 HydrophobicContact CG1-CG2 3.95Å; H89-T156 WeakPolarHBondContact O-CA 3.41Å; T156-N158 PolarHBondContact O-N 2.95Å; T156-N158 VanDerWaalsContact O-N 3.12Å; T156-N158 PolarHBondContact OG1-N 2.71Å; T156-N158 VanDerWaalsContact OG1-N 3.17Å; T156-G159 PolarHBondContact N-O 2.94Å; T156-G159 PolarHBondContact O-N 3.32Å; T156-G159 VanDerWaalsContact O-N 3.08Å; T156-G159 PolarHBondContact OG1-N 3.26Å; T156-G159 PolarHBondContact OG1-O 2.92Å
157	E	68.9	Low	82.1	Confident	131 Å²	131	50.8 Å²	50.8	61%	0.612	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.6	-24.9	166.8	-65.8	-179.6	171.2	0	0	112.7	L91	L91-E157 HydrophobicContact CD1-CG 3.85Å; L91-E157 HydrophobicContact CD2-CG 4.01Å; L91-E157 HydrophobicContact CG-CG 4.16Å
158	N	65.6	Low	82.3	Confident	99 Å²	99	49.4 Å²	49.4	53%	0.529	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	14.4	-179.6	-67	-56.2	0	0	0	113.9	L35 N88 T156	L35-N158 HydrophobicContact CD2-CB 3.8Å; L35-N158 VanDerWaalsContact CD2-CG 3.46Å; N88-N158 PolarHBondContact OD1-ND2 2.76Å; T156-N158 PolarHBondContact O-N 2.95Å; T156-N158 VanDerWaalsContact O-N 3.12Å; T156-N158 PolarHBondContact OG1-N 2.71Å; T156-N158 VanDerWaalsContact OG1-N 3.17Å
159	G	72.5	Confident	82.2	Confident	27 Å²	27	51.8 Å²	51.8	28%	0.278	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	108.6	-162.3	172.3	0	0	0	0	0	115.9	T156	T156-G159 PolarHBondContact N-O 2.94Å; T156-G159 PolarHBondContact O-N 3.32Å; T156-G159 VanDerWaalsContact O-N 3.08Å; T156-G159 PolarHBondContact OG1-N 3.26Å; T156-G159 PolarHBondContact OG1-O 2.92Å
160	Y	77.2	Confident	81.8	Confident	121 Å²	121	50 Å²	50	48%	0.475	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	139.7	-169.4	-55.5	-87.4	0	0	0	113.3	R94 G154 V155	R94-Y160 HydrophobicContact CB-CD1 4.12Å; R94-Y160 HydrophobicContact CB-CE1 4.08Å; R94-Y160 HydrophobicContact CG-CE1 4.28Å; G154-Y160 WeakPolarHBondContact O-CA 3.25Å; V155-Y160 HydrophobicContact CG1-CD1 4.5Å; V155-Y160 HydrophobicContact CG2-CD1 3.88Å; V155-Y160 HydrophobicContact CG2-CE1 4.11Å
161	G	76.9	Confident	81.4	Confident	13 Å²	13	51.6 Å²	51.6	13%	0.134	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	-166.4	168.5	0	0	0	0	0	113.3	G154	G154-G161 PolarHBondContact O-N 3.5Å
162	R	82.4	Confident	80.8	Confident	154 Å²	154	53 Å²	53	58%	0.581	27%	0.271	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.8	145.2	178.5	-76.2	176.4	-88.4	178.4	-5.2	112.2	P40 A153	P40-R162 WeakPolarHBondContact CA-O 3.45Å; P40-R162 HydrophobicContact CB-CB 4.02Å; P40-R162 HydrophobicContact CG-CB 4.43Å; A153-R162 WeakPolarHBondContact CA-O 3.39Å; A153-R162 WeakPolarHBondContact CB-O 3.47Å
163	D	83.7	Confident	80.2	Confident	52 Å²	52	53.7 Å²	53.7	28%	0.278	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	141.8	175.1	-64.7	-61.4	0	0	0	112	R94 R96 V152 A153	R94-D163 IonicContact CZ-OD1 2.78Å; R94-D163 IonicContact NE-OD1 2.65Å; R94-D163 VanDerWaalsContact NH2-CG 3.29Å; R94-D163 IonicContact NH2-OD1 2.69Å; R94-D163 PolarHBondContact NH2-OD1 3.23Å; R94-D163 IonicContact NH2-OD2 3.17Å; R94-D163 PolarHBondContact NH2-OD2 2.89Å; R94-D163 VanDerWaalsContact NH2-OD2 3.12Å; R96-D163 IonicContact CZ-OD2 3.75Å; R96-D163 IonicContact NH2-OD1 2.69Å; R96-D163 IonicContact NH2-OD2 2.7Å; R96-D163 PolarHBondContact NH2-OD2 3.24Å; V152-D163 CarbonylContact O-C 3.53Å; V152-D163 VanDerWaalsContact O-CA 3.3Å; V152-D163 WeakPolarHBondContact O-CA 3.25Å; A153-D163 VanDerWaalsContact CB-OD1 3.26Å; A153-D163 WeakPolarHBondContact CB-OD1 3.29Å
164	A	87.3	Confident	79.7	Confident	17 Å²	17	55 Å²	55	14%	0.14	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	141.4	160.5	0	0	0	0	0	109.4	P40 P41 L44 S151 V152	P40-A164 HydrophobicContact CB-CB 4.46Å; P41-A164 HydrophobicContact CB-CB 4.44Å; P41-A164 WeakPolarHBondContact O-CB 3.49Å; L44-A164 HydrophobicContact CD2-CB 4.49Å; L44-A164 WeakPolarHBondContact CD2-O 3.47Å; S151-A164 CarbonylContact C-O 2.84Å; S151-A164 WeakPolarHBondContact CA-O 3.37Å; V152-A164 PolarHBondContact N-O 2.88Å; V152-A164 PolarHBondContact O-N 3Å
165	I	87.8	Confident	79.6	Confident	108 Å²	108	55.2 Å²	55.2	55%	0.554	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.6	138.9	-168.3	-55.3	177.5	0	0	0	111.8	E149 V150	E149-I165 HydrophobicContact CG-CG2 3.58Å; V150-I165 CarbonylContact O-C 3.6Å; V150-I165 VanDerWaalsContact O-CA 3.3Å; V150-I165 WeakPolarHBondContact O-CA 3.43Å
166	S	88.7	Confident	79.3	Confident	35 Å²	35	56.7 Å²	56.7	25%	0.245	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	171.1	175	-171.6	0	0	0	0	111.6	V150	V150-S166 PolarHBondContact N-O 3.35Å; V150-S166 PolarHBondContact O-N 3.02Å
167	R	89.3	Confident	79.3	Confident	159 Å²	159	57 Å²	57	60%	0.6	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.3	145.3	-173.2	-64.7	-179.4	173.9	177.7	-6.9	113	I100 Y148 E149	I100-R167 HydrophobicContact CD1-CG 3.82Å; Y148-R167 VanDerWaalsContact O-CA 3.28Å; Y148-R167 WeakPolarHBondContact O-CA 3.35Å; E149-R167 HydrophobicContact CG-CG 4.26Å; E149-R167 IonicContact OE2-CZ 2.62Å; E149-R167 IonicContact OE2-NE 3.37Å; E149-R167 PolarHBondContact OE2-NE 2.99Å; E149-R167 IonicContact OE2-NH2 3.41Å; E149-R167 PolarHBondContact OE2-NH2 3.08Å
168	I	85.5	Confident	80.1	Confident	23 Å²	23	51.2 Å²	51.2	12%	0.118	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	146.1	179.4	-169.6	166.3	0	0	0	112	L46 I48 I57 Y148	L46-I168 HydrophobicContact CB-CB 4.16Å; L46-I168 HydrophobicContact CB-CD1 3.95Å; L46-I168 HydrophobicContact CD1-CB 3.95Å; L46-I168 HydrophobicContact CD1-CG2 3.95Å; I48-I168 HydrophobicContact CG1-CD1 4.03Å; I57-I168 HydrophobicContact CB-CG2 4.45Å; I57-I168 HydrophobicContact CD1-CG2 3.46Å; I57-I168 VanDerWaalsContact CD1-CG2 3.46Å; I57-I168 HydrophobicContact CG1-CG2 3.73Å; I57-I168 HydrophobicContact CG2-CD1 4.44Å; I57-I168 HydrophobicContact CG2-CG2 3.86Å; Y148-I168 PolarHBondContact N-O 2.92Å; Y148-I168 PolarHBondContact O-N 3.18Å
169	A	82.4	Confident	81.2	Confident	56 Å²	56	46.8 Å²	46.8	46%	0.463	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	131.1	173.2	0	0	0	0	0	110.5	I147	I147-A169 HydrophobicContact CG1-CB 4.24Å
170	T	78.7	Confident	81.7	Confident	10 Å²	10	47.2 Å²	47.2	6%	0.061	25%	0.25	C	C	.	.	P	Polyproline II helix	trans	-77	150.6	172	55.9	0	0	0	0	111.2	P55 H142 L143 G145 V146 Y148	P55-T170 HydrophobicContact CB-CG2 4.07Å; P55-T170 HydrophobicContact CG-CG2 4.41Å; H142-T170 HydrophobicContact CB-CG2 4.09Å; L143-T170 WeakPolarHBondContact O-CG2 3.46Å; L143-T170 PolarHBondContact O-OG1 3.19Å; G145-T170 PolarHBondContact N-OG1 3.11Å; V146-T170 PolarHBondContact N-OG1 2.95Å; V146-T170 PolarHBondContact O-N 3.29Å; V146-T170 PolarHBondContact O-OG1 3.48Å; V146-T170 VanDerWaalsContact O-OG1 3.05Å; Y148-T170 HydrophobicContact CD2-CG2 3.9Å; Y148-T170 HydrophobicContact CE2-CG2 3.66Å
171	P	76.6	Confident	81.9	Confident	34 Å²	34	45.5 Å²	45.5	22%	0.221	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-59.1	152.5	175.5	27	-35.3	0	0	0	111.9	F144 G145	F144-P171 WeakPolarHBondContact CB-O 3.09Å; G145-P171 PolarHBondContact N-O 3.44Å
172	E	77.5	Confident	82.4	Confident	41 Å²	41	46.4 Å²	46.4	19%	0.192	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-71.2	149.2	166.4	-66.6	-177	-138.9	0	0	110.1	N205 T253 K254 A255	E172-N205 CarbonylContact C-O 3.58Å; E172-N205 VanDerWaalsContact CA-O 3.29Å; E172-N205 WeakPolarHBondContact CA-O 3.28Å; E172-T253 WeakPolarHBondContact OE2-CB 3.31Å; E172-K254 IonicContact OE1-NZ 2.7Å; E172-K254 PolarHBondContact OE1-NZ 3.4Å; E172-K254 WeakPolarHBondContact OE2-CB 3.04Å; E172-K254 WeakPolarHBondContact OE2-CG 3.05Å; E172-K254 PolarHBondContact OE2-N 2.83Å; E172-A255 HydrophobicContact CB-CB 4.38Å; E172-A255 WeakPolarHBondContact O-CB 3.5Å
173	S	74.4	Confident	82.4	Confident	16 Å²	16	42.3 Å²	42.3	11%	0.112	23%	0.234	C	C	.	.			trans	-131.2	169.6	166	-162.6	0	0	0	0	110	N205 T253	S173-N205 PolarHBondContact N-O 3.01Å; S173-N205 WeakPolarHBondContact O-CB 3.49Å; S173-T253 WeakPolarHBondContact O-CB 3.3Å; S173-T253 WeakPolarHBondContact O-CG2 3.47Å; S173-T253 PolarHBondContact O-OG1 3.26Å
174	A	77.3	Confident	82.3	Confident	28 Å²	28	42.7 Å²	42.7	23%	0.231	24%	0.238	C	C	.	.			trans	-63.2	145.8	177.1	0	0	0	0	0	110.7	S176 N205 P257	A174-S176 PolarHBondContact O-N 3.14Å; A174-N205 PolarHBondContact O-ND2 3.23Å; A174-P257 WeakPolarHBondContact CB-O 3.48Å
175	P	80.8	Confident	81.7	Confident	4 Å²	4	44.9 Å²	44.9	3%	0.026	25%	0.249	C	C	.	.			trans	-55.8	130.8	176.9	-24.7	32.7	0	0	0	112.1	D177 P199 Y203 I208 A251 T253 G258 P259	P175-D177 VanDerWaalsContact C-N 3.34Å; P175-P199 HydrophobicContact CB-CG 4.19Å; P175-Y203 CarbonylContact C-O 3.41Å; P175-Y203 VanDerWaalsContact CA-O 3.32Å; P175-Y203 WeakPolarHBondContact CA-O 3.28Å; P175-I208 HydrophobicContact CG-CD1 3.91Å; P175-A251 HydrophobicContact CB-CB 4.49Å; P175-A251 HydrophobicContact CG-CB 4.03Å; P175-T253 HydrophobicContact CG-CG2 3.96Å; P175-G258 WeakPolarHBondContact O-CA 3.43Å; P175-P259 WeakPolarHBondContact O-CD 3.44Å
176	S	75.7	Confident	80.8	Confident	46 Å²	46	41.3 Å²	41.3	32%	0.322	24%	0.239	S	C	.	.	S	Bend	trans	-88.1	1	178.4	-65.9	0	0	0	0	114.2	A174 Y203 N205 H548	A174-S176 PolarHBondContact O-N 3.14Å; S176-Y203 PolarHBondContact N-O 3.37Å; S176-N205 PolarHBondContact OG-ND2 3.3Å; S176-H548 PolarHBondContact O-CE1 2.87Å
177	D	77.4	Confident	79.7	Confident	23 Å²	23	42.3 Å²	42.3	12%	0.123	26%	0.255	C	S	.	.	S	Bend	trans	-138.8	154.8	176	-167.7	16.1	0	0	0	109.2	P175 P199 Y203 I546	P175-D177 VanDerWaalsContact C-N 3.34Å; D177-P199 HydrophobicContact CB-CB 4.37Å; D177-P199 WeakPolarHBondContact O-CG 3.18Å; D177-Y203 VanDerWaalsContact CB-CB 3.46Å; D177-Y203 HydrophobicContact CB-CD2 3.58Å; D177-Y203 HydrophobicContact CB-CG 3.8Å; D177-Y203 WeakPolarHBondContact OD2-CD2 3.44Å; D177-I546 VanDerWaalsContact OD1-CD1 3.3Å; D177-I546 WeakPolarHBondContact OD1-CD1 3.39Å
178	A	85.7	Confident	78.7	Confident	9 Å²	9	38.8 Å²	38.8	7%	0.074	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-75.6	164.7	-179.7	0	0	0	0	0	111	S180 W260	A178-S180 PolarHBondContact O-N 2.77Å; A178-W260 WeakPolarHBondContact CB-O 3.38Å
179	P	88.3	Confident	77.9	Confident	6 Å²	6	44.6 Å²	44.6	4%	0.039	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-54.4	127.8	164.7	-23.5	35.6	0	0	0	110	W196 E197 Y211 V249 A251	P179-W196 HydrophobicContact CB-CB 3.89Å; P179-W196 HydrophobicContact CB-CG 3.85Å; P179-E197 CarbonylContact C-O 3.55Å; P179-E197 VanDerWaalsContact CA-O 3.26Å; P179-E197 WeakPolarHBondContact CA-O 3.44Å; P179-E197 WeakPolarHBondContact CB-O 2.97Å; P179-Y211 HydrophobicContact CB-CE1 4.4Å; P179-Y211 HydrophobicContact CG-CD1 4.01Å; P179-Y211 HydrophobicContact CG-CE1 4.13Å; P179-V249 HydrophobicContact CB-CG1 3.91Å; P179-V249 WeakPolarHBondContact CD-O 3.44Å; P179-V249 HydrophobicContact CG-CG1 3.94Å; P179-V249 HydrophobicContact CG-CG2 4.17Å; P179-A251 HydrophobicContact CG-CB 4.16Å
180	S	81.9	Confident	77.5	Confident	37 Å²	37	45.4 Å²	45.4	26%	0.259	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	164.4	-175.1	61.5	0	0	0	0	110.9	A178 F182 W196 E197 P198	A178-S180 PolarHBondContact O-N 2.77Å; S180-F182 PolarHBondContact O-N 3.1Å; S180-W196 CarbonylContact O-C 3.46Å; S180-E197 PolarHBondContact N-O 3.36Å; S180-E197 PolarHBondContact O-N 2.88Å; S180-E197 WeakPolarHBondContact OG-CB 3.28Å; S180-P198 PolarHBondContact OG-O 2.84Å; S180-P198 VanDerWaalsContact OG-O 3.09Å
181	N	81.4	Confident	77.6	Confident	84 Å²	84	45 Å²	45	45%	0.449	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	51.1	32.2	176.7	-154.8	3.1	0	0	0	115	R183 E197	N181-R183 PolarHBondContact ND2-NH1 3.22Å; N181-R183 VanDerWaalsContact ND2-NH1 3.16Å; N181-R183 WeakPolarHBondContact O-CG 3.44Å; N181-R183 PolarHBondContact O-N 3.37Å; N181-R183 PolarHBondContact O-NH1 3.33Å; N181-E197 HydrophobicContact CB-CB 4.45Å; N181-E197 VanDerWaalsContact CB-CD 3.49Å; N181-E197 HydrophobicContact CB-CG 4.48Å; N181-E197 WeakPolarHBondContact CB-OE1 3.28Å; N181-E197 VanDerWaalsContact CB-OE2 3.28Å; N181-E197 WeakPolarHBondContact CB-OE2 3.21Å; N181-E197 PolarHBondContact ND2-OE1 3.2Å; N181-E197 PolarHBondContact ND2-OE2 3.31Å
182	F	88.2	Confident	77.9	Confident	32 Å²	32	43.9 Å²	43.9	14%	0.14	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	121.8	176.9	-176	-137.4	0	0	0	109.7	S180 L194 A195 W196 C247 V249 S261 I264	S180-F182 PolarHBondContact O-N 3.1Å; F182-L194 HydrophobicContact CE2-CB 4.16Å; F182-L194 HydrophobicContact CE2-CD1 4.25Å; F182-L194 HydrophobicContact CZ-CD1 4.29Å; F182-A195 CarbonylContact C-O 3.13Å; F182-A195 VanDerWaalsContact CA-O 3.29Å; F182-A195 WeakPolarHBondContact CA-O 3.42Å; F182-W196 HydrophobicContact CB-CB 4.2Å; F182-W196 HydrophobicContact CD2-CB 4.1Å; F182-W196 HydrophobicContact CD2-CD2 4.41Å; F182-W196 AromaticContact CD2-CE3 3.73Å; F182-W196 HydrophobicContact CD2-CE3 3.73Å; F182-W196 AromaticContact CE2-CE3 3.71Å; F182-W196 HydrophobicContact CE2-CE3 3.71Å; F182-W196 HydrophobicContact CE2-CZ3 4.12Å; F182-C247 WeakPolarHBondContact CE1-O 3.44Å; F182-C247 HydrophobicContact CZ-CB 4.22Å; F182-V249 HydrophobicContact CB-CG1 4.17Å; F182-V249 HydrophobicContact CD1-CG1 3.86Å; F182-V249 HydrophobicContact CD2-CB 4.33Å; F182-V249 HydrophobicContact CD2-CG1 3.49Å; F182-V249 VanDerWaalsContact CD2-CG1 3.49Å; F182-V249 HydrophobicContact CE1-CB 4.45Å; F182-V249 HydrophobicContact CE1-CG1 4.03Å; F182-V249 HydrophobicContact CE2-CB 4Å; F182-V249 HydrophobicContact CE2-CG1 3.67Å; F182-V249 HydrophobicContact CG-CG1 3.58Å; F182-V249 HydrophobicContact CZ-CB 4.07Å; F182-V249 HydrophobicContact CZ-CG1 3.93Å; F182-S261 WeakPolarHBondContact CD1-OG 3.29Å; F182-S261 WeakPolarHBondContact CE1-OG 3.48Å; F182-I264 HydrophobicContact CB-CD1 4.37Å; F182-I264 HydrophobicContact CD1-CD1 3.39Å; F182-I264 HydrophobicContact CD1-CG1 3.58Å; F182-I264 HydrophobicContact CD2-CD1 3.82Å; F182-I264 HydrophobicContact CE1-CB 4.32Å; F182-I264 HydrophobicContact CE1-CD1 3.51Å; F182-I264 HydrophobicContact CE1-CG1 3.63Å; F182-I264 HydrophobicContact CE2-CD1 3.93Å; F182-I264 HydrophobicContact CG-CD1 3.57Å; F182-I264 HydrophobicContact CG-CG1 4.24Å; F182-I264 HydrophobicContact CZ-CD1 3.79Å; F182-I264 HydrophobicContact CZ-CG1 4.32Å
183	R	82.3	Confident	78.4	Confident	68 Å²	68	44.1 Å²	44.1	26%	0.257	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	156.7	-170.7	63.6	-164.6	178.5	-90	21	112.7	N181 V185 L194 A195 E197	N181-R183 PolarHBondContact ND2-NH1 3.22Å; N181-R183 VanDerWaalsContact ND2-NH1 3.16Å; N181-R183 WeakPolarHBondContact O-CG 3.44Å; N181-R183 PolarHBondContact O-N 3.37Å; N181-R183 PolarHBondContact O-NH1 3.33Å; R183-V185 HydrophobicContact CG-CG2 4.25Å; R183-L194 CarbonylContact O-C 3.59Å; R183-L194 WeakPolarHBondContact O-CA 3.22Å; R183-A195 PolarHBondContact N-O 3.49Å; R183-A195 PolarHBondContact O-N 3.37Å; R183-E197 IonicContact CZ-OE1 2.65Å; R183-E197 IonicContact NH1-OE1 2.69Å; R183-E197 PolarHBondContact NH1-OE1 2.84Å; R183-E197 IonicContact NH2-OE1 2.96Å; R183-E197 PolarHBondContact NH2-OE1 3.17Å; R183-E197 VanDerWaalsContact NH2-OE1 3.11Å
184	V	80.3	Confident	79	Confident	61 Å²	61	43.3 Å²	43.3	37%	0.37	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	137.7	156.2	171.4	0	0	0	0	108	V192 L194 I264 F266	V184-V192 HydrophobicContact CB-CG2 4.35Å; V184-V192 HydrophobicContact CG1-CG2 3.57Å; V184-V192 HydrophobicContact CG2-CG2 3.84Å; V184-L194 HydrophobicContact CG2-CD2 3.78Å; V184-I264 HydrophobicContact CG2-CG2 4.14Å; V184-F266 HydrophobicContact CG2-CB 4.46Å; V184-F266 HydrophobicContact CG2-CD1 4.15Å; V184-F266 HydrophobicContact CG2-CG 4.44Å
185	V	76.1	Confident	79.5	Confident	62 Å²	62	42 Å²	42	38%	0.376	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	-29.4	-178.6	-173.2	0	0	0	0	111.8	R183 Q193 A195 F820	R183-V185 HydrophobicContact CG-CG2 4.25Å; V185-Q193 HydrophobicContact CB-CG 4.43Å; V185-Q193 PolarHBondContact N-O 3.04Å; V185-A195 HydrophobicContact CG2-CB 3.32Å; V185-F820 HydrophobicContact CG1-CD2 4.18Å; V185-F820 HydrophobicContact CG1-CE2 3.74Å; V185-F820 HydrophobicContact CG1-CZ 4.49Å
186	G	68	Low	80	Confident	33 Å²	33	42 Å²	42	34%	0.34	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	171.7	179.2	-177.8	0	0	0	0	0	110.5	Q193	G186-Q193 PolarHBondContact O-N 3.06Å
187	G	66.6	Low	80.5	Confident	57 Å²	57	42.6 Å²	42.6	59%	0.588	25%	0.246	S	C	*	.	E	Extended strand (participates in β ladder)	trans	178.1	-179.6	-178.2	0	0	0	0	0	111.6	S191	G187-S191 CarbonylContact C-O 3.43Å; G187-S191 WeakPolarHBondContact CA-O 3.46Å
188	D	68.9	Low	80.8	Confident	85 Å²	85	42.5 Å²	42.5	46%	0.455	25%	0.247	S	C	.	.			trans	-135.3	-165.6	170.3	55.5	40	0	0	0	109.2	T190 S191 K236	D188-T190 PolarHBondContact O-N 3.37Å; D188-T190 VanDerWaalsContact O-N 3.15Å; D188-T190 PolarHBondContact OD1-N 2.83Å; D188-T190 VanDerWaalsContact OD1-N 3.14Å; D188-S191 PolarHBondContact N-O 3.43Å; D188-S191 WeakPolarHBondContact OD1-CB 3.35Å; D188-S191 PolarHBondContact OD1-N 2.74Å; D188-S191 PolarHBondContact OD1-OG 3.02Å; D188-S191 PolarHBondContact OD2-OG 3.45Å; D188-K236 IonicContact OD2-NZ 3.79Å
189	Q	66.9	Low	80.7	Confident	144 Å²	144	42.1 Å²	42.1	67%	0.673	24%	0.243	S	C	*	.	S	Bend	trans	-71	-4.2	-174.7	-67.1	-174.3	-24.7	0	0	114.7	I268 N269	Q189-I268 WeakPolarHBondContact O-CG2 3.46Å; Q189-N269 VanDerWaalsContact CB-OD1 3.26Å; Q189-N269 WeakPolarHBondContact CB-OD1 3.46Å; Q189-N269 VanDerWaalsContact CG-OD1 3.24Å; Q189-N269 WeakPolarHBondContact CG-OD1 3.49Å
190	T	74.6	Confident	79.9	Confident	73 Å²	73	48.6 Å²	48.6	45%	0.448	27%	0.267	S	S	.	.	S	Bend	trans	-141.1	0.1	177.7	60.6	0	0	0	0	114.4	D188 Y238 N239 L240	D188-T190 PolarHBondContact O-N 3.37Å; D188-T190 VanDerWaalsContact O-N 3.15Å; D188-T190 PolarHBondContact OD1-N 2.83Å; D188-T190 VanDerWaalsContact OD1-N 3.14Å; T190-Y238 CarbonylContact O-C 3.59Å; T190-N239 PolarHBondContact O-N 3.22Å; T190-L240 PolarHBondContact O-N 3.04Å; T190-L240 VanDerWaalsContact O-N 3.11Å
191	S	80.8	Confident	79.3	Confident	2 Å²	2	49.7 Å²	49.7	1%	0.014	27%	0.27	C	S	.	.			trans	-141.1	149.6	-177.3	73.8	0	0	0	0	113	G187 D188 K236 L237	G187-S191 CarbonylContact C-O 3.43Å; G187-S191 WeakPolarHBondContact CA-O 3.46Å; D188-S191 PolarHBondContact N-O 3.43Å; D188-S191 WeakPolarHBondContact OD1-CB 3.35Å; D188-S191 PolarHBondContact OD1-N 2.74Å; D188-S191 PolarHBondContact OD1-OG 3.02Å; D188-S191 PolarHBondContact OD2-OG 3.45Å; S191-K236 VanDerWaalsContact CB-CE 3.42Å; S191-K236 WeakPolarHBondContact OG-CE 3.45Å; S191-K236 PolarHBondContact OG-NZ 3.13Å; S191-K236 VanDerWaalsContact OG-NZ 3.13Å; S191-L237 CarbonylContact C-O 3.55Å; S191-L237 WeakPolarHBondContact CA-O 3.44Å; S191-L237 WeakPolarHBondContact CB-O 3.31Å
192	V	83.6	Confident	78.5	Confident	10 Å²	10	48 Å²	48	6%	0.061	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	141.2	175.9	72.1	0	0	0	0	110.2	V184 K236 L237 L240 F266	V184-V192 HydrophobicContact CB-CG2 4.35Å; V184-V192 HydrophobicContact CG1-CG2 3.57Å; V184-V192 HydrophobicContact CG2-CG2 3.84Å; V192-K236 CarbonylContact O-C 3.37Å; V192-K236 VanDerWaalsContact O-CA 3.28Å; V192-K236 WeakPolarHBondContact O-CA 3.4Å; V192-L237 HydrophobicContact CG1-CB 4.06Å; V192-L237 HydrophobicContact CG1-CD1 3.8Å; V192-L237 HydrophobicContact CG1-CG 4.45Å; V192-L237 PolarHBondContact N-O 3.5Å; V192-L237 PolarHBondContact O-N 2.84Å; V192-L240 HydrophobicContact CG1-CD1 3.85Å; V192-F266 HydrophobicContact CB-CD2 4.48Å; V192-F266 HydrophobicContact CB-CE2 4.23Å; V192-F266 HydrophobicContact CG1-CD2 4.2Å; V192-F266 HydrophobicContact CG1-CE1 4.31Å; V192-F266 HydrophobicContact CG1-CE2 3.53Å; V192-F266 HydrophobicContact CG1-CZ 3.6Å; V192-F266 HydrophobicContact CG2-CD2 4.4Å
193	Q	86.9	Confident	77.8	Confident	46 Å²	46	48.9 Å²	48.9	22%	0.215	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	111.4	178.1	-171.4	169.8	20.9	0	0	110.4	V185 G186 K236 S819	V185-Q193 HydrophobicContact CB-CG 4.43Å; V185-Q193 PolarHBondContact N-O 3.04Å; G186-Q193 PolarHBondContact O-N 3.06Å; Q193-K236 HydrophobicContact CB-CB 4.31Å; Q193-K236 HydrophobicContact CB-CG 4.34Å; Q193-K236 HydrophobicContact CG-CB 4.28Å; Q193-S819 PolarHBondContact NE2-O 3.01Å
194	L	88.2	Confident	77.4	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	147.1	172.7	-56.6	174.2	0	0	0	110.3	F182 R183 V184 W196 V213 T234 L235 L237 C247 I264 F266	F182-L194 HydrophobicContact CE2-CB 4.16Å; F182-L194 HydrophobicContact CE2-CD1 4.25Å; F182-L194 HydrophobicContact CZ-CD1 4.29Å; R183-L194 CarbonylContact O-C 3.59Å; R183-L194 WeakPolarHBondContact O-CA 3.22Å; V184-L194 HydrophobicContact CG2-CD2 3.78Å; L194-W196 HydrophobicContact CB-CZ3 4.2Å; L194-V213 HydrophobicContact CD1-CG1 4.25Å; L194-T234 CarbonylContact O-C 3.57Å; L194-T234 WeakPolarHBondContact O-CA 3.49Å; L194-L235 HydrophobicContact CB-CB 4.34Å; L194-L235 PolarHBondContact N-O 3.5Å; L194-L235 PolarHBondContact O-N 3.5Å; L194-L237 HydrophobicContact CD1-CD1 3.84Å; L194-L237 HydrophobicContact CG-CD1 4.38Å; L194-C247 HydrophobicContact CD1-CB 3.95Å; L194-I264 HydrophobicContact CD2-CD1 4.47Å; L194-F266 HydrophobicContact CD2-CE1 4.25Å
195	A	87.6	Confident	77.1	Confident	1 Å²	1	45 Å²	45	1%	0.008	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	154.2	167.7	0	0	0	0	0	112.1	F182 R183 V185 T234 F820	F182-A195 CarbonylContact C-O 3.13Å; F182-A195 VanDerWaalsContact CA-O 3.29Å; F182-A195 WeakPolarHBondContact CA-O 3.42Å; R183-A195 PolarHBondContact N-O 3.49Å; R183-A195 PolarHBondContact O-N 3.37Å; V185-A195 HydrophobicContact CG2-CB 3.32Å; A195-T234 HydrophobicContact CB-CG2 3.4Å; A195-F820 HydrophobicContact CB-CD1 4.48Å
196	W	90.8	Very high	77	Confident	4 Å²	4	42.7 Å²	42.7	2%	0.015	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	173.8	171.7	51.8	90.3	0	0	0	109.5	P179 S180 F182 L194 Y211 V213 I230 Q233 L235 V249	P179-W196 HydrophobicContact CB-CB 3.89Å; P179-W196 HydrophobicContact CB-CG 3.85Å; S180-W196 CarbonylContact O-C 3.46Å; F182-W196 HydrophobicContact CB-CB 4.2Å; F182-W196 HydrophobicContact CD2-CB 4.1Å; F182-W196 HydrophobicContact CD2-CD2 4.41Å; F182-W196 AromaticContact CD2-CE3 3.73Å; F182-W196 HydrophobicContact CD2-CE3 3.73Å; F182-W196 AromaticContact CE2-CE3 3.71Å; F182-W196 HydrophobicContact CE2-CE3 3.71Å; F182-W196 HydrophobicContact CE2-CZ3 4.12Å; L194-W196 HydrophobicContact CB-CZ3 4.2Å; W196-Y211 AromaticContact CD1-CD1 3.84Å; W196-Y211 AromaticContact CD1-CE1 3.64Å; W196-Y211 AromaticContact CE2-CD1 4Å; W196-Y211 AromaticContact CE2-CG 3.9Å; W196-Y211 HydrophobicContact CZ2-CD1 4.46Å; W196-Y211 HydrophobicContact CZ2-CD2 4.29Å; W196-Y211 AromaticContact CZ2-CG 3.94Å; W196-Y211 HydrophobicContact CZ2-CG 3.94Å; W196-Y211 AromaticContact NE1-CD1 3.1Å; W196-Y211 AromaticContact NE1-CD2 3.63Å; W196-Y211 AromaticContact NE1-CE1 3.27Å; W196-Y211 VanDerWaalsContact NE1-CE1 3.27Å; W196-Y211 AromaticContact NE1-CE2 3.79Å; W196-Y211 AromaticContact NE1-CG 3.3Å; W196-Y211 VanDerWaalsContact NE1-CG 3.3Å; W196-Y211 AromaticContact NE1-CZ 3.62Å; W196-V213 HydrophobicContact CH2-CG2 3.32Å; W196-V213 HydrophobicContact CZ2-CG2 4.11Å; W196-V213 HydrophobicContact CZ3-CG2 3.7Å; W196-I230 HydrophobicContact CH2-CD1 3.54Å; W196-I230 HydrophobicContact CH2-CG1 4.36Å; W196-I230 HydrophobicContact CZ2-CD1 3.68Å; W196-I230 HydrophobicContact CZ2-CG1 4.16Å; W196-Q233 VanDerWaalsContact CG-O 3.24Å; W196-Q233 VanDerWaalsContact CZ2-C 3.45Å; W196-Q233 PolarHBondContact N-O 3.27Å; W196-Q233 PolarHBondContact NE1-O 3.29Å; W196-L235 HydrophobicContact CH2-CB 3.9Å; W196-L235 HydrophobicContact CZ3-CB 3.97Å; W196-V249 HydrophobicContact CB-CG1 4.37Å; W196-V249 HydrophobicContact CD2-CB 4.4Å; W196-V249 HydrophobicContact CD2-CG1 4.11Å; W196-V249 HydrophobicContact CD2-CG2 3.79Å; W196-V249 HydrophobicContact CE3-CB 4.37Å; W196-V249 HydrophobicContact CE3-CG1 4.24Å; W196-V249 HydrophobicContact CE3-CG2 4.07Å; W196-V249 HydrophobicContact CG-CG1 4.2Å; W196-V249 HydrophobicContact CG-CG2 4.39Å; W196-V249 HydrophobicContact CH2-CG2 4.02Å; W196-V249 HydrophobicContact CZ2-CG2 3.75Å; W196-V249 HydrophobicContact CZ3-CG2 4.18Å
197	E	87.1	Confident	77.6	Confident	58 Å²	58	43.9 Å²	43.9	27%	0.271	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	154.2	167.7	-82.6	134.2	-129.7	0	0	109	P179 S180 N181 R183	P179-E197 CarbonylContact C-O 3.55Å; P179-E197 VanDerWaalsContact CA-O 3.26Å; P179-E197 WeakPolarHBondContact CA-O 3.44Å; P179-E197 WeakPolarHBondContact CB-O 2.97Å; S180-E197 PolarHBondContact N-O 3.36Å; S180-E197 PolarHBondContact O-N 2.88Å; S180-E197 WeakPolarHBondContact OG-CB 3.28Å; N181-E197 HydrophobicContact CB-CB 4.45Å; N181-E197 VanDerWaalsContact CB-CD 3.49Å; N181-E197 HydrophobicContact CB-CG 4.48Å; N181-E197 WeakPolarHBondContact CB-OE1 3.28Å; N181-E197 VanDerWaalsContact CB-OE2 3.28Å; N181-E197 WeakPolarHBondContact CB-OE2 3.21Å; N181-E197 PolarHBondContact ND2-OE1 3.2Å; N181-E197 PolarHBondContact ND2-OE2 3.31Å; R183-E197 IonicContact CZ-OE1 2.65Å; R183-E197 IonicContact NH1-OE1 2.69Å; R183-E197 PolarHBondContact NH1-OE1 2.84Å; R183-E197 IonicContact NH2-OE1 2.96Å; R183-E197 PolarHBondContact NH2-OE1 3.17Å; R183-E197 VanDerWaalsContact NH2-OE1 3.11Å
198	P	82.8	Confident	78.4	Confident	21 Å²	21	42.3 Å²	42.3	14%	0.136	21%	0.208	C	C	.	.	P	Polyproline II helix	trans	-57	157.5	173.1	24.2	-34.2	0	0	0	111.3	S180 Y211	S180-P198 PolarHBondContact OG-O 2.84Å; S180-P198 VanDerWaalsContact OG-O 3.09Å; P198-Y211 WeakPolarHBondContact CB-OH 3.43Å
199	P	82.4	Confident	79.1	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.203	C	C	.	.	P	Polyproline II helix	trans	-54.1	151.4	168.4	-22.3	32.2	0	0	0	111.3	P175 D177 R204 A251	P175-P199 HydrophobicContact CB-CG 4.19Å; D177-P199 HydrophobicContact CB-CB 4.37Å; D177-P199 WeakPolarHBondContact O-CG 3.18Å; P199-R204 HydrophobicContact CB-CG 4.14Å; P199-R204 WeakPolarHBondContact O-CG 3.49Å; P199-R204 PolarHBondContact O-NE 3.3Å; P199-A251 HydrophobicContact CG-CB 3.88Å
200	R	73.2	Confident	80.2	Confident	142 Å²	142	37 Å²	37	54%	0.536	18%	0.184	S	C	.	.	P	Polyproline II helix	trans	-57.1	147.1	177.6	-64.2	-177	179.4	175.8	0.3	110.6	L202 Y203 R204	R200-L202 PolarHBondContact O-N 3.19Å; R200-L202 VanDerWaalsContact O-N 3.09Å; R200-Y203 HydrophobicContact CB-CD2 4.05Å; R200-Y203 PolarHBondContact O-N 2.67Å; R200-R204 PolarHBondContact O-N 3.27Å
201	L	68	Low	81	Confident	60 Å²	60	34 Å²	34	31%	0.314	16%	0.164	S	C	.	.	H	α-helix	trans	-51.4	-41.3	-172.5	-77.1	170.1	0	0	0	112.9	Y203 R204	L201-Y203 PolarHBondContact O-N 3.2Å; L201-Y203 VanDerWaalsContact O-N 3.13Å; L201-R204 PolarHBondContact O-N 3.4Å
202	L	65.9	Low	81.4	Confident	49 Å²	49	34.6 Å²	34.6	26%	0.257	17%	0.167	S	C	.	.	H	α-helix	trans	-58.8	-21.5	177.3	-171.3	63.9	0	0	0	114.6	L121 L143 R200	L121-L202 HydrophobicContact CD1-CD1 4.25Å; L121-L202 HydrophobicContact CD1-CD2 3.92Å; L143-L202 HydrophobicContact CD1-CD1 4.3Å; L143-L202 HydrophobicContact CD2-CD1 3.72Å; R200-L202 PolarHBondContact O-N 3.19Å; R200-L202 VanDerWaalsContact O-N 3.09Å
203	Y	73.8	Confident	81.7	Confident	50 Å²	50	34.1 Å²	34.1	20%	0.196	16%	0.164	C	C	.	.	H	α-helix	trans	-119.7	-1.6	-172.7	-51.6	-43.5	0	0	0	114.1	P175 S176 D177 R200 L201 N205	P175-Y203 CarbonylContact C-O 3.41Å; P175-Y203 VanDerWaalsContact CA-O 3.32Å; P175-Y203 WeakPolarHBondContact CA-O 3.28Å; S176-Y203 PolarHBondContact N-O 3.37Å; D177-Y203 VanDerWaalsContact CB-CB 3.46Å; D177-Y203 HydrophobicContact CB-CD2 3.58Å; D177-Y203 HydrophobicContact CB-CG 3.8Å; D177-Y203 WeakPolarHBondContact OD2-CD2 3.44Å; R200-Y203 HydrophobicContact CB-CD2 4.05Å; R200-Y203 PolarHBondContact O-N 2.67Å; L201-Y203 PolarHBondContact O-N 3.2Å; L201-Y203 VanDerWaalsContact O-N 3.13Å; Y203-N205 VanDerWaalsContact C-N 3.33Å
204	R	73.9	Confident	81.8	Confident	33 Å²	33	35.3 Å²	35.3	13%	0.125	17%	0.166	C	C	.	.	H	α-helix	trans	-68	-33.3	176.8	-65.8	-175	-172.6	-175.4	3.2	113	E104 P199 R200 L201 G206 I208 T253	E104-R204 VanDerWaalsContact CD-NH1 3.33Å; E104-R204 IonicContact OE1-NH1 3.27Å; E104-R204 IonicContact OE2-CZ 3.31Å; E104-R204 IonicContact OE2-NH1 3.31Å; E104-R204 PolarHBondContact OE2-NH1 3.02Å; P199-R204 HydrophobicContact CB-CG 4.14Å; P199-R204 WeakPolarHBondContact O-CG 3.49Å; P199-R204 PolarHBondContact O-NE 3.3Å; R200-R204 PolarHBondContact O-N 3.27Å; L201-R204 PolarHBondContact O-N 3.4Å; R204-G206 PolarHBondContact O-N 3.28Å; R204-I208 HydrophobicContact CB-CD1 4.12Å; R204-I208 HydrophobicContact CG-CD1 4.22Å; R204-T253 VanDerWaalsContact O-CG2 3.29Å; R204-T253 WeakPolarHBondContact O-CG2 3.47Å
205	N	73	Confident	81.7	Confident	14 Å²	14	35.5 Å²	35.5	8%	0.075	17%	0.168	C	C	.	.			trans	56.3	12.1	-177.3	-60.9	-25.7	0	0	0	116.1	F144 E172 S173 A174 S176 Y203	F144-N205 HydrophobicContact CB-CB 3.75Å; F144-N205 WeakPolarHBondContact CB-O 3.17Å; F144-N205 HydrophobicContact CD2-CB 4.24Å; F144-N205 HydrophobicContact CG-CB 4.25Å; E172-N205 CarbonylContact C-O 3.58Å; E172-N205 VanDerWaalsContact CA-O 3.29Å; E172-N205 WeakPolarHBondContact CA-O 3.28Å; S173-N205 PolarHBondContact N-O 3.01Å; S173-N205 WeakPolarHBondContact O-CB 3.49Å; A174-N205 PolarHBondContact O-ND2 3.23Å; S176-N205 PolarHBondContact OG-ND2 3.3Å; Y203-N205 VanDerWaalsContact C-N 3.33Å
206	G	74.6	Confident	81.6	Confident	14 Å²	14	36.3 Å²	36.3	14%	0.144	17%	0.171	C	C	.	.	S	Bend	trans	167	-168.6	-174.4	0	0	0	0	0	111.7	R204	R204-G206 PolarHBondContact O-N 3.28Å
207	I	80.1	Confident	81.3	Confident	58 Å²	58	37 Å²	37	30%	0.297	18%	0.175	S	C	.	.			trans	-87.5	131.2	175.4	-55.2	172	0	0	0	107.8	I103 T209 T253	I103-I207 HydrophobicContact CB-CG1 4.45Å; I103-I207 HydrophobicContact CD1-CD1 4.42Å; I103-I207 HydrophobicContact CG2-CD1 3.8Å; I103-I207 HydrophobicContact CG2-CG1 4.2Å; I207-T209 PolarHBondContact O-N 2.88Å; I207-T209 VanDerWaalsContact O-N 3.15Å; I207-T253 WeakPolarHBondContact O-CA 3.45Å
208	I	82.4	Confident	80.7	Confident	24 Å²	24	37.2 Å²	37.2	12%	0.123	18%	0.18	C	C	.	.			trans	-73.8	111.2	179.8	-53	-52	0	0	0	109.2	P175 R204 Y211 A251 W252 T253	P175-I208 HydrophobicContact CG-CD1 3.91Å; R204-I208 HydrophobicContact CB-CD1 4.12Å; R204-I208 HydrophobicContact CG-CD1 4.22Å; I208-Y211 HydrophobicContact CG2-CE1 3.98Å; I208-Y211 HydrophobicContact CG2-CE2 4.02Å; I208-A251 HydrophobicContact CD1-CB 4.17Å; I208-A251 HydrophobicContact CG2-CB 4.02Å; I208-W252 CarbonylContact C-O 3.54Å; I208-W252 VanDerWaalsContact CA-O 3.26Å; I208-W252 WeakPolarHBondContact CA-O 3.16Å; I208-T253 HydrophobicContact CD1-CG2 4.13Å
209	T	84.5	Confident	80	Confident	57 Å²	57	39.6 Å²	39.6	35%	0.35	21%	0.207	S	C	.	.			trans	-83.5	-33	-174.9	56.8	0	0	0	0	112.5	I207 W252 T253 K254	I207-T209 PolarHBondContact O-N 2.88Å; I207-T209 VanDerWaalsContact O-N 3.15Å; T209-W252 PolarHBondContact N-O 2.86Å; T209-W252 PolarHBondContact OG1-O 3.21Å; T209-T253 PolarHBondContact OG1-O 2.91Å; T209-K254 HydrophobicContact CG2-CG 3.85Å
210	K	89.3	Confident	79.6	Confident	62 Å²	62	44 Å²	44	27%	0.27	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-166.9	169.3	-179.3	60.7	-171	-173.4	177.9	0	110.7	T229 I230 W252	K210-T229 HydrophobicContact CB-CG2 4.45Å; K210-T229 HydrophobicContact CD-CG2 3.74Å; K210-T229 HydrophobicContact CG-CG2 4.4Å; K210-I230 CarbonylContact C-O 3.46Å; K210-I230 WeakPolarHBondContact CA-O 3.39Å; K210-I230 WeakPolarHBondContact CB-O 3.47Å; K210-W252 HydrophobicContact CD-CD2 4.4Å; K210-W252 HydrophobicContact CD-CG 4.33Å; K210-W252 HydrophobicContact CG-CB 3.63Å; K210-W252 HydrophobicContact CG-CD2 4.33Å; K210-W252 HydrophobicContact CG-CG 3.75Å; K210-W252 WeakPolarHBondContact O-CB 3.4Å; K210-W252 PolarHBondContact O-N 3.4Å
211	Y	91.5	Very high	79.5	Confident	8 Å²	8	42 Å²	42	3%	0.031	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	155.7	165.9	-59.7	-87.3	0	0	0	109.7	P179 W196 P198 I208 T229 I230 E232 Q233 V249 R250 A251	P179-Y211 HydrophobicContact CB-CE1 4.4Å; P179-Y211 HydrophobicContact CG-CD1 4.01Å; P179-Y211 HydrophobicContact CG-CE1 4.13Å; W196-Y211 AromaticContact CD1-CD1 3.84Å; W196-Y211 AromaticContact CD1-CE1 3.64Å; W196-Y211 AromaticContact CE2-CD1 4Å; W196-Y211 AromaticContact CE2-CG 3.9Å; W196-Y211 HydrophobicContact CZ2-CD1 4.46Å; W196-Y211 HydrophobicContact CZ2-CD2 4.29Å; W196-Y211 AromaticContact CZ2-CG 3.94Å; W196-Y211 HydrophobicContact CZ2-CG 3.94Å; W196-Y211 AromaticContact NE1-CD1 3.1Å; W196-Y211 AromaticContact NE1-CD2 3.63Å; W196-Y211 AromaticContact NE1-CE1 3.27Å; W196-Y211 VanDerWaalsContact NE1-CE1 3.27Å; W196-Y211 AromaticContact NE1-CE2 3.79Å; W196-Y211 AromaticContact NE1-CG 3.3Å; W196-Y211 VanDerWaalsContact NE1-CG 3.3Å; W196-Y211 AromaticContact NE1-CZ 3.62Å; P198-Y211 WeakPolarHBondContact CB-OH 3.43Å; I208-Y211 HydrophobicContact CG2-CE1 3.98Å; I208-Y211 HydrophobicContact CG2-CE2 4.02Å; Y211-T229 WeakPolarHBondContact O-CA 3.32Å; Y211-I230 PolarHBondContact N-O 2.85Å; Y211-I230 PolarHBondContact O-N 2.66Å; Y211-E232 WeakPolarHBondContact CD2-O 3.39Å; Y211-Q233 HydrophobicContact CE2-CG 4.03Å; Y211-V249 HydrophobicContact CD1-CG2 4.49Å; Y211-R250 CarbonylContact C-O 3.58Å; Y211-R250 VanDerWaalsContact CA-O 3.26Å; Y211-R250 WeakPolarHBondContact CA-O 3.31Å; Y211-A251 HydrophobicContact CD1-CB 3.89Å; Y211-A251 HydrophobicContact CE1-CB 3.78Å
212	Q	90.6	Very high	79	Confident	16 Å²	16	48.5 Å²	48.5	8%	0.075	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	130.3	164.9	-80.4	-173.4	-36.3	0	0	109.2	L227 K228 T229 V249 R250 W252 W260	Q212-L227 HydrophobicContact CB-CD1 4.15Å; Q212-L227 HydrophobicContact CG-CD1 4.49Å; Q212-K228 CarbonylContact C-O 3.46Å; Q212-K228 WeakPolarHBondContact CA-O 3.44Å; Q212-T229 HydrophobicContact CG-CG2 4.13Å; Q212-T229 WeakPolarHBondContact CG-OG1 3.4Å; Q212-T229 PolarHBondContact NE2-OG1 2.79Å; Q212-V249 CarbonylContact O-C 3.48Å; Q212-V249 WeakPolarHBondContact O-CA 3.47Å; Q212-V249 WeakPolarHBondContact O-CG2 3.5Å; Q212-R250 HydrophobicContact CB-CG 4.05Å; Q212-R250 PolarHBondContact N-O 3.25Å; Q212-R250 PolarHBondContact O-N 3Å; Q212-R250 VanDerWaalsContact OE1-NE 3.15Å; Q212-W252 VanDerWaalsContact CD-NE1 3.34Å; Q212-W260 HydrophobicContact CB-CH2 4.31Å; Q212-W260 WeakPolarHBondContact O-CZ3 3.44Å
213	V	90.1	Very high	78.8	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	125	168.7	-174.5	0	0	0	0	108.2	L194 W196 C215 L227 K228 L235 C247 L248 V249	L194-V213 HydrophobicContact CD1-CG1 4.25Å; W196-V213 HydrophobicContact CH2-CG2 3.32Å; W196-V213 HydrophobicContact CZ2-CG2 4.11Å; W196-V213 HydrophobicContact CZ3-CG2 3.7Å; V213-C215 VanDerWaalsContact CG1-SG 3.52Å; V213-L227 CarbonylContact O-C 3.25Å; V213-K228 PolarHBondContact N-O 3.23Å; V213-K228 PolarHBondContact O-N 3.38Å; V213-L235 HydrophobicContact CB-CD2 3.6Å; V213-L235 HydrophobicContact CG1-CD2 3.89Å; V213-L235 HydrophobicContact CG2-CD2 3.53Å; V213-C247 HydrophobicContact CG1-CB 4.28Å; V213-L248 CarbonylContact C-O 3.56Å; V213-L248 WeakPolarHBondContact CA-O 3.47Å; V213-L248 WeakPolarHBondContact CG1-O 3.3Å; V213-V249 HydrophobicContact CG2-CB 4.04Å; V213-V249 HydrophobicContact CG2-CG2 3.67Å
214	R	88	Confident	78.3	Confident	70 Å²	70	54.5 Å²	54.5	26%	0.264	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	123.3	168.1	-171	-175	-171.9	-151.9	-0.1	107.3	D225 E226 L227 C247 L248 W260	R214-D225 WeakPolarHBondContact CD-OD1 3.42Å; R214-D225 WeakPolarHBondContact CG-OD1 3.18Å; R214-D225 IonicContact CZ-OD1 3.69Å; R214-D225 IonicContact CZ-OD2 3.52Å; R214-D225 VanDerWaalsContact CZ-OD2 3.24Å; R214-D225 IonicContact NE-OD1 3.85Å; R214-D225 PolarHBondContact NE-OD1 2.85Å; R214-D225 IonicContact NE-OD2 2.73Å; R214-D225 PolarHBondContact NE-OD2 3.09Å; R214-D225 IonicContact NH2-OD1 3.67Å; R214-D225 IonicContact NH2-OD2 3.12Å; R214-D225 PolarHBondContact NH2-OD2 3.38Å; R214-E226 WeakPolarHBondContact CA-O 3.45Å; R214-L227 HydrophobicContact CB-CD1 4.18Å; R214-C247 CarbonylContact O-C 3.54Å; R214-C247 VanDerWaalsContact O-CA 3.26Å; R214-C247 WeakPolarHBondContact O-CA 3.37Å; R214-L248 HydrophobicContact CB-CB 4.47Å; R214-L248 PolarHBondContact N-O 3.24Å; R214-L248 PolarHBondContact O-N 2.98Å; R214-W260 HydrophobicContact CB-CH2 3.64Å; R214-W260 HydrophobicContact CB-CZ2 4.33Å; R214-W260 HydrophobicContact CB-CZ3 3.83Å
215	C	86.8	Confident	78.3	Confident	5 Å²	5	56.3 Å²	56.3	3%	0.034	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	135.4	177.2	-73.5	0	0	0	0	110.1	V213 E226 A246 C247	V213-C215 VanDerWaalsContact CG1-SG 3.52Å; C215-E226 PolarHBondContact N-O 3.06Å; C215-E226 PolarHBondContact O-N 2.84Å; C215-A246 CarbonylContact C-O 3.54Å; C215-A246 VanDerWaalsContact CA-O 3.32Å; C215-A246 WeakPolarHBondContact CA-O 3.42Å; C215-C247 HydrophobicContact CB-CB 4.25Å; C215-C247 WeakPolarHBondContact CB-SG 3.43Å; C215-C247 WeakPolarHBondContact SG-CB 3.35Å; C215-C247 CovalentContact SG-SG 2.05Å; C215-C247 PolarHBondContact SG-SG 3.12Å
216	Y	85.6	Confident	78.5	Confident	18 Å²	18	57.9 Å²	57.9	7%	0.071	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	159.8	-177.7	66.2	-88.2	0	0	0	113.3	E221 H224 A246 L248	Y216-E221 HydrophobicContact CD2-CB 4.43Å; Y216-E221 HydrophobicContact CD2-CG 3.79Å; Y216-E221 HydrophobicContact CE2-CG 3.66Å; Y216-E221 WeakPolarHBondContact CE2-OE1 3.49Å; Y216-E221 PolarHBondContact OH-OE1 3.23Å; Y216-H224 WeakPolarHBondContact CA-O 3.12Å; Y216-H224 WeakPolarHBondContact CB-O 3.41Å; Y216-A246 HydrophobicContact CD1-CB 4.4Å; Y216-A246 HydrophobicContact CD2-CB 4.46Å; Y216-A246 HydrophobicContact CE1-CB 3.98Å; Y216-A246 HydrophobicContact CE2-CB 4.05Å; Y216-A246 PolarHBondContact N-O 2.86Å; Y216-A246 PolarHBondContact O-N 2.74Å; Y216-L248 HydrophobicContact CE1-CD1 4.36Å
217	I	83	Confident	79	Confident	19 Å²	19	60.9 Å²	60.9	10%	0.097	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	126.8	175	-60.6	-177.2	0	0	0	109.3	G219 E220 H224 P241 A243	I217-G219 PolarHBondContact O-N 3.15Å; I217-G219 VanDerWaalsContact O-N 3.09Å; I217-E220 HydrophobicContact CB-CB 4.4Å; I217-E220 HydrophobicContact CG2-CB 4.48Å; I217-E220 PolarHBondContact O-N 3.37Å; I217-H224 HydrophobicContact CB-CB 4.31Å; I217-H224 HydrophobicContact CD1-CB 4.25Å; I217-H224 HydrophobicContact CG1-CB 4.11Å; I217-P241 HydrophobicContact CD1-CG 3.76Å; I217-A243 HydrophobicContact CD1-CB 4.34Å; I217-A243 HydrophobicContact CG2-CB 3.94Å
218	V	75	Confident	79.3	Confident	62 Å²	62	58.3 Å²	58.3	38%	0.376	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	110	-176.8	179.6	0	0	0	0	109.9	T244 A246 Q265	V218-T244 HydrophobicContact CB-CG2 4.28Å; V218-T244 HydrophobicContact CG2-CG2 3.98Å; V218-T244 PolarHBondContact N-O 3.32Å; V218-A246 HydrophobicContact CG2-CB 3.63Å; V218-Q265 HydrophobicContact CG2-CG 4.49Å
219	G	68.4	Low	79.5	Confident	70 Å²	70	60.7 Å²	60.7	72%	0.722	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	111.4	-15.4	-176.2	0	0	0	0	0	114.3	I217	I217-G219 PolarHBondContact O-N 3.15Å; I217-G219 VanDerWaalsContact O-N 3.09Å
220	E	74.4	Confident	79.7	Confident	94 Å²	94	59 Å²	59	44%	0.439	31%	0.308	S	S	.	.			trans	-122	39.5	-180	-62.5	-173.6	-179.1	0	0	111.2	I217 E222 N223 H224	I217-E220 HydrophobicContact CB-CB 4.4Å; I217-E220 HydrophobicContact CG2-CB 4.48Å; I217-E220 PolarHBondContact O-N 3.37Å; E220-E222 PolarHBondContact O-N 3.06Å; E220-E222 VanDerWaalsContact O-N 3.12Å; E220-N223 PolarHBondContact O-N 3.15Å; E220-H224 PolarHBondContact O-N 3.25Å; E220-H224 VanDerWaalsContact O-N 3.09Å; E220-H224 IonicContact OE2-CD2 3Å; E220-H224 PolarHBondContact OE2-CD2 3.48Å
221	E	69.8	Low	79.5	Confident	99 Å²	99	61.3 Å²	61.3	46%	0.463	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-24.4	-172.7	-51.6	-163.2	157.6	0	0	113.7	Y216	Y216-E221 HydrophobicContact CD2-CB 4.43Å; Y216-E221 HydrophobicContact CD2-CG 3.79Å; Y216-E221 HydrophobicContact CE2-CG 3.66Å; Y216-E221 WeakPolarHBondContact CE2-OE1 3.49Å; Y216-E221 PolarHBondContact OH-OE1 3.23Å
222	E	58.9	Low	79.2	Confident	197 Å²	197	65.2 Å²	65.2	92%	0.921	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	-21.2	176.8	-61	-171	150.9	0	0	113.7	E220	E220-E222 PolarHBondContact O-N 3.06Å; E220-E222 VanDerWaalsContact O-N 3.12Å
223	N	61.7	Low	79	Confident	125 Å²	125	68.7 Å²	68.7	67%	0.668	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	-30	-173.7	-69.3	-27.5	0	0	0	113.7	E220	E220-N223 PolarHBondContact O-N 3.15Å
224	H	62.6	Low	78.9	Confident	99 Å²	99	69.1 Å²	69.1	46%	0.458	37%	0.365	S	S	.	.			trans	-129.8	43	-167	-80.2	-49.2	0	0	0	113.8	Y216 I217 E220	Y216-H224 WeakPolarHBondContact CA-O 3.12Å; Y216-H224 WeakPolarHBondContact CB-O 3.41Å; I217-H224 HydrophobicContact CB-CB 4.31Å; I217-H224 HydrophobicContact CD1-CB 4.25Å; I217-H224 HydrophobicContact CG1-CB 4.11Å; E220-H224 PolarHBondContact O-N 3.25Å; E220-H224 VanDerWaalsContact O-N 3.09Å; E220-H224 IonicContact OE2-CD2 3Å; E220-H224 PolarHBondContact OE2-CD2 3.48Å
225	D	73.3	Confident	78.9	Confident	71 Å²	71	65.8 Å²	65.8	38%	0.38	35%	0.353	S	S	.	.			trans	-92.4	100	176.4	-172.5	23	0	0	0	112.9	R214	R214-D225 WeakPolarHBondContact CD-OD1 3.42Å; R214-D225 WeakPolarHBondContact CG-OD1 3.18Å; R214-D225 IonicContact CZ-OD1 3.69Å; R214-D225 IonicContact CZ-OD2 3.52Å; R214-D225 VanDerWaalsContact CZ-OD2 3.24Å; R214-D225 IonicContact NE-OD1 3.85Å; R214-D225 PolarHBondContact NE-OD1 2.85Å; R214-D225 IonicContact NE-OD2 2.73Å; R214-D225 PolarHBondContact NE-OD2 3.09Å; R214-D225 IonicContact NH2-OD1 3.67Å; R214-D225 IonicContact NH2-OD2 3.12Å; R214-D225 PolarHBondContact NH2-OD2 3.38Å
226	E	78.8	Confident	78.9	Confident	48 Å²	48	67.6 Å²	67.6	22%	0.224	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	121.1	175.8	-69.2	-169	101.5	0	0	112.3	R214 C215 K228 E815 S816	R214-E226 WeakPolarHBondContact CA-O 3.45Å; C215-E226 PolarHBondContact N-O 3.06Å; C215-E226 PolarHBondContact O-N 2.84Å; E226-K228 HydrophobicContact CB-CG 4.36Å; E226-K228 WeakPolarHBondContact OE1-CE 3.48Å; E226-K228 IonicContact OE1-NZ 3.99Å; E226-K228 PolarHBondContact OE1-NZ 3.24Å; E226-K228 WeakPolarHBondContact OE2-CE 3.33Å; E226-K228 IonicContact OE2-NZ 3.62Å; E226-K228 PolarHBondContact OE2-NZ 3.09Å; E226-E815 HydrophobicContact CB-CG 4Å; E226-E815 HydrophobicContact CG-CB 4.23Å; E226-E815 HydrophobicContact CG-CG 4.12Å; E226-E815 VanDerWaalsContact OE1-CA 3.23Å; E226-E815 WeakPolarHBondContact OE1-CA 2.94Å; E226-S816 PolarHBondContact OE1-N 2.75Å
227	L	85.3	Confident	78.9	Confident	77 Å²	77	66.8 Å²	66.8	40%	0.403	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	88.5	178.5	-177.2	63.3	0	0	0	112.7	Q212 V213 R214 W260	Q212-L227 HydrophobicContact CB-CD1 4.15Å; Q212-L227 HydrophobicContact CG-CD1 4.49Å; V213-L227 CarbonylContact O-C 3.25Å; R214-L227 HydrophobicContact CB-CD1 4.18Å; L227-W260 HydrophobicContact CD1-CH2 3.79Å
228	K	85.5	Confident	79	Confident	4 Å²	4	71.6 Å²	71.6	2%	0.017	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	127.8	-172.3	-43.1	-160.4	172.1	180	0	110.6	Q212 V213 E226 L235 L237 E815 S816 S817	Q212-K228 CarbonylContact C-O 3.46Å; Q212-K228 WeakPolarHBondContact CA-O 3.44Å; V213-K228 PolarHBondContact N-O 3.23Å; V213-K228 PolarHBondContact O-N 3.38Å; E226-K228 HydrophobicContact CB-CG 4.36Å; E226-K228 WeakPolarHBondContact OE1-CE 3.48Å; E226-K228 IonicContact OE1-NZ 3.99Å; E226-K228 PolarHBondContact OE1-NZ 3.24Å; E226-K228 WeakPolarHBondContact OE2-CE 3.33Å; E226-K228 IonicContact OE2-NZ 3.62Å; E226-K228 PolarHBondContact OE2-NZ 3.09Å; K228-L235 HydrophobicContact CB-CD2 4.38Å; K228-L237 HydrophobicContact CD-CD2 3.89Å; K228-L237 VanDerWaalsContact NZ-CD2 3.34Å; K228-E815 HydrophobicContact CG-CG 4.38Å; K228-E815 WeakPolarHBondContact CG-OE1 3.19Å; K228-S816 PolarHBondContact NZ-O 2.86Å; K228-S817 WeakPolarHBondContact CD-OG 3.49Å
229	T	87.3	Confident	79.2	Confident	74 Å²	74	75.6 Å²	75.6	45%	0.454	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	119.9	-177.4	-57.6	0	0	0	0	110.5	K210 Y211 Q212	K210-T229 HydrophobicContact CB-CG2 4.45Å; K210-T229 HydrophobicContact CD-CG2 3.74Å; K210-T229 HydrophobicContact CG-CG2 4.4Å; Y211-T229 WeakPolarHBondContact O-CA 3.32Å; Q212-T229 HydrophobicContact CG-CG2 4.13Å; Q212-T229 WeakPolarHBondContact CG-OG1 3.4Å; Q212-T229 PolarHBondContact NE2-OG1 2.79Å
230	I	88.4	Confident	79.7	Confident	21 Å²	21	73 Å²	73	11%	0.108	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	163.8	-174.4	72.5	175.2	0	0	0	112.2	W196 K210 Y211 E232 T234 L235	W196-I230 HydrophobicContact CH2-CD1 3.54Å; W196-I230 HydrophobicContact CH2-CG1 4.36Å; W196-I230 HydrophobicContact CZ2-CD1 3.68Å; W196-I230 HydrophobicContact CZ2-CG1 4.16Å; K210-I230 CarbonylContact C-O 3.46Å; K210-I230 WeakPolarHBondContact CA-O 3.39Å; K210-I230 WeakPolarHBondContact CB-O 3.47Å; Y211-I230 PolarHBondContact N-O 2.85Å; Y211-I230 PolarHBondContact O-N 2.66Å; I230-E232 HydrophobicContact CD1-CB 4.34Å; I230-E232 WeakPolarHBondContact CD1-O 3.37Å; I230-E232 WeakPolarHBondContact CG1-O 3.41Å; I230-T234 WeakPolarHBondContact CD1-O 3.48Å; I230-L235 HydrophobicContact CD1-CB 4.13Å; I230-L235 HydrophobicContact CD1-CD1 3.99Å; I230-L235 HydrophobicContact CG2-CD1 4.02Å
231	T	85	Confident	79.8	Confident	110 Å²	110	71.7 Å²	71.7	68%	0.675	36%	0.363	S	S	*	.	S	Bend	trans	-101.1	-23.1	172.9	49.2	0	0	0	0	113.4
232	E	84.2	Confident	80	Confident	90 Å²	90	71.6 Å²	71.6	42%	0.421	37%	0.373	S	S	.	.	S	Bend	trans	-68.5	159.7	175.5	-61.4	179.7	164.1	0	0	111.8	Y211 I230 T234 S819	Y211-E232 WeakPolarHBondContact CD2-O 3.39Å; I230-E232 HydrophobicContact CD1-CB 4.34Å; I230-E232 WeakPolarHBondContact CD1-O 3.37Å; I230-E232 WeakPolarHBondContact CG1-O 3.41Å; E232-T234 PolarHBondContact O-N 3.48Å; E232-S819 WeakPolarHBondContact OE2-CA 3.43Å; E232-S819 PolarHBondContact OE2-N 2.76Å
233	Q	87.2	Confident	80.7	Confident	90 Å²	90	63.4 Å²	63.4	42%	0.421	34%	0.339	S	S	.	.	S	Bend	trans	-83.5	12.7	179.6	-61.6	178.2	5.5	0	0	112.7	W196 Y211	W196-Q233 VanDerWaalsContact CG-O 3.24Å; W196-Q233 VanDerWaalsContact CZ2-C 3.45Å; W196-Q233 PolarHBondContact N-O 3.27Å; W196-Q233 PolarHBondContact NE1-O 3.29Å; Y211-Q233 HydrophobicContact CE2-CG 4.03Å
234	T	87.6	Confident	81.6	Confident	9 Å²	9	60.5 Å²	60.5	6%	0.055	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.7	150.5	-155.4	50.5	0	0	0	0	113.8	L194 A195 I230 E232 S819 F820	L194-T234 CarbonylContact O-C 3.57Å; L194-T234 WeakPolarHBondContact O-CA 3.49Å; A195-T234 HydrophobicContact CB-CG2 3.4Å; I230-T234 WeakPolarHBondContact CD1-O 3.48Å; E232-T234 PolarHBondContact O-N 3.48Å; T234-S819 PolarHBondContact O-N 2.78Å; T234-F820 HydrophobicContact CG2-CB 3.18Å; T234-F820 HydrophobicContact CG2-CD1 3.4Å; T234-F820 HydrophobicContact CG2-CG 3.55Å; T234-F820 VanDerWaalsContact OG1-CB 3.27Å; T234-F820 WeakPolarHBondContact OG1-CB 3.36Å; T234-F820 PolarHBondContact OG1-N 2.7Å
235	L	88.9	Confident	82.5	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	107.3	-167.1	-169.1	59.1	0	0	0	112.9	L194 W196 V213 K228 I230 L237 S817 S818	L194-L235 HydrophobicContact CB-CB 4.34Å; L194-L235 PolarHBondContact N-O 3.5Å; L194-L235 PolarHBondContact O-N 3.5Å; W196-L235 HydrophobicContact CH2-CB 3.9Å; W196-L235 HydrophobicContact CZ3-CB 3.97Å; V213-L235 HydrophobicContact CB-CD2 3.6Å; V213-L235 HydrophobicContact CG1-CD2 3.89Å; V213-L235 HydrophobicContact CG2-CD2 3.53Å; K228-L235 HydrophobicContact CB-CD2 4.38Å; I230-L235 HydrophobicContact CD1-CB 4.13Å; I230-L235 HydrophobicContact CD1-CD1 3.99Å; I230-L235 HydrophobicContact CG2-CD1 4.02Å; L235-L237 HydrophobicContact CD2-CD2 4.41Å; L235-L237 HydrophobicContact CG-CG 4.49Å; L235-S817 VanDerWaalsContact CD1-C 3.43Å; L235-S817 WeakPolarHBondContact CD1-O 3.4Å; L235-S817 WeakPolarHBondContact CD1-OG 3.43Å; L235-S817 WeakPolarHBondContact CG-OG 3.26Å; L235-S818 VanDerWaalsContact CD1-CA 3.48Å
236	K	86.4	Confident	83.1	Confident	43 Å²	43	52.9 Å²	52.9	19%	0.187	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	107.9	165.6	-170.1	170.2	173.7	176.3	0	110.8	D188 S191 V192 Q193 Y238 S817 S818	D188-K236 IonicContact OD2-NZ 3.79Å; S191-K236 VanDerWaalsContact CB-CE 3.42Å; S191-K236 WeakPolarHBondContact OG-CE 3.45Å; S191-K236 PolarHBondContact OG-NZ 3.13Å; S191-K236 VanDerWaalsContact OG-NZ 3.13Å; V192-K236 CarbonylContact O-C 3.37Å; V192-K236 VanDerWaalsContact O-CA 3.28Å; V192-K236 WeakPolarHBondContact O-CA 3.4Å; Q193-K236 HydrophobicContact CB-CB 4.31Å; Q193-K236 HydrophobicContact CB-CG 4.34Å; Q193-K236 HydrophobicContact CG-CB 4.28Å; K236-Y238 HydrophobicContact CB-CE2 4.15Å; K236-Y238 HydrophobicContact CD-CE1 3.93Å; K236-Y238 HydrophobicContact CD-CE2 4.34Å; K236-Y238 HydrophobicContact CG-CD2 4.48Å; K236-Y238 HydrophobicContact CG-CE1 4.23Å; K236-Y238 HydrophobicContact CG-CE2 3.95Å; K236-Y238 WeakPolarHBondContact O-CD2 3.45Å; K236-Y238 WeakPolarHBondContact O-CE2 3.39Å; K236-S817 WeakPolarHBondContact O-CB 3.48Å; K236-S818 WeakPolarHBondContact CA-O 3.39Å; K236-S818 VanDerWaalsContact CB-O 3.22Å; K236-S818 WeakPolarHBondContact CB-O 3.27Å; K236-S818 VanDerWaalsContact N-C 3.33Å; K236-S818 PolarHBondContact N-O 3.37Å; K236-S818 PolarHBondContact O-N 3.48Å
237	L	85.3	Confident	83.6	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	142.2	170.9	-64.5	158.4	0	0	0	109	S191 V192 L194 K228 L235 L240 F266 S817	S191-L237 CarbonylContact C-O 3.55Å; S191-L237 WeakPolarHBondContact CA-O 3.44Å; S191-L237 WeakPolarHBondContact CB-O 3.31Å; V192-L237 HydrophobicContact CG1-CB 4.06Å; V192-L237 HydrophobicContact CG1-CD1 3.8Å; V192-L237 HydrophobicContact CG1-CG 4.45Å; V192-L237 PolarHBondContact N-O 3.5Å; V192-L237 PolarHBondContact O-N 2.84Å; L194-L237 HydrophobicContact CD1-CD1 3.84Å; L194-L237 HydrophobicContact CG-CD1 4.38Å; K228-L237 HydrophobicContact CD-CD2 3.89Å; K228-L237 VanDerWaalsContact NZ-CD2 3.34Å; L235-L237 HydrophobicContact CD2-CD2 4.41Å; L235-L237 HydrophobicContact CG-CG 4.49Å; L237-L240 HydrophobicContact CB-CD1 3.75Å; L237-L240 HydrophobicContact CB-CD2 4.28Å; L237-L240 HydrophobicContact CB-CG 4.11Å; L237-L240 HydrophobicContact CD1-CD1 4.19Å; L237-F266 HydrophobicContact CD1-CZ 4.25Å; L237-S817 VanDerWaalsContact CD2-OG 3.29Å; L237-S817 WeakPolarHBondContact CD2-OG 3.26Å
238	Y	85.1	Confident	83.8	Confident	120 Å²	120	48.1 Å²	48.1	47%	0.471	27%	0.265	S	S	.	.			trans	-129.1	163.1	-179.3	-63	-93.8	0	0	0	110.7	T190 K236 L240	T190-Y238 CarbonylContact O-C 3.59Å; K236-Y238 HydrophobicContact CB-CE2 4.15Å; K236-Y238 HydrophobicContact CD-CE1 3.93Å; K236-Y238 HydrophobicContact CD-CE2 4.34Å; K236-Y238 HydrophobicContact CG-CD2 4.48Å; K236-Y238 HydrophobicContact CG-CE1 4.23Å; K236-Y238 HydrophobicContact CG-CE2 3.95Å; K236-Y238 WeakPolarHBondContact O-CD2 3.45Å; K236-Y238 WeakPolarHBondContact O-CE2 3.39Å; Y238-L240 PolarHBondContact O-N 2.96Å
239	N	78.8	Confident	84.1	Confident	146 Å²	146	48 Å²	48	78%	0.781	26%	0.264	S	S	*	.	S	Bend	trans	55.8	29.7	176.3	-58.2	-20	0	0	0	114.1	T190	T190-N239 PolarHBondContact O-N 3.22Å
240	L	79.6	Confident	84.3	Confident	16 Å²	16	46.8 Å²	46.8	8%	0.084	25%	0.251	C	S	.	.			trans	-73.1	136.6	179.7	-65.4	-177.2	0	0	0	110.7	T190 V192 L237 Y238 F266 I268	T190-L240 PolarHBondContact O-N 3.04Å; T190-L240 VanDerWaalsContact O-N 3.11Å; V192-L240 HydrophobicContact CG1-CD1 3.85Å; L237-L240 HydrophobicContact CB-CD1 3.75Å; L237-L240 HydrophobicContact CB-CD2 4.28Å; L237-L240 HydrophobicContact CB-CG 4.11Å; L237-L240 HydrophobicContact CD1-CD1 4.19Å; Y238-L240 PolarHBondContact O-N 2.96Å; L240-F266 HydrophobicContact CD1-CE2 3.9Å; L240-F266 HydrophobicContact CD1-CZ 4.29Å; L240-I268 HydrophobicContact CB-CD1 3.44Å; L240-I268 VanDerWaalsContact CB-CD1 3.44Å; L240-I268 HydrophobicContact CD1-CD1 3.86Å; L240-I268 HydrophobicContact CG-CD1 4.3Å
241	P	77	Confident	84.4	Confident	67 Å²	67	45.8 Å²	45.8	44%	0.435	25%	0.246	S	C	.	.			trans	-69	164.1	177	26.9	-33.4	0	0	0	112.7	I217 A243 H245	I217-P241 HydrophobicContact CD1-CG 3.76Å; P241-A243 PolarHBondContact O-N 3.31Å; P241-H245 PolarHBondContact O-CE1 2.78Å; P241-H245 VanDerWaalsContact O-CE1 3.22Å
242	S	72.9	Confident	84.5	Confident	96 Å²	96	43.2 Å²	43.2	67%	0.671	22%	0.224	S	C	*	.	S	Bend	trans	-74.7	70.7	175.9	-59.5	0	0	0	0	112	N269	S242-N269 PolarHBondContact OG-ND2 2.88Å
243	A	74.4	Confident	84.5	Confident	26 Å²	26	39 Å²	39	22%	0.215	21%	0.205	C	C	.	.	S	Bend	trans	-142.2	165.1	-179.5	0	0	0	0	0	111.7	I217 P241 H245	I217-A243 HydrophobicContact CD1-CB 4.34Å; I217-A243 HydrophobicContact CG2-CB 3.94Å; P241-A243 PolarHBondContact O-N 3.31Å; A243-H245 PolarHBondContact O-N 2.69Å; A243-H245 PolarHBondContact O-ND1 3.13Å
244	T	80.1	Confident	84.1	Confident	63 Å²	63	41.9 Å²	41.9	39%	0.387	22%	0.216	S	C	.	.			trans	-74.1	110.2	173.2	-55.8	0	0	0	0	109.8	V218	V218-T244 HydrophobicContact CB-CG2 4.28Å; V218-T244 HydrophobicContact CG2-CG2 3.98Å; V218-T244 PolarHBondContact N-O 3.32Å
245	H	82	Confident	83.4	Confident	10 Å²	10	44.2 Å²	44.2	5%	0.046	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	139.9	177.6	-71.2	69.5	0	0	0	110.1	P241 A243 Q265 F266	P241-H245 PolarHBondContact O-CE1 2.78Å; P241-H245 VanDerWaalsContact O-CE1 3.22Å; A243-H245 PolarHBondContact O-N 2.69Å; A243-H245 PolarHBondContact O-ND1 3.13Å; H245-Q265 VanDerWaalsContact O-CA 3.27Å; H245-Q265 WeakPolarHBondContact O-CA 3.34Å; H245-F266 HydrophobicContact CB-CD2 4.07Å; H245-F266 HydrophobicContact CB-CE1 4.14Å; H245-F266 HydrophobicContact CB-CE2 3.43Å; H245-F266 VanDerWaalsContact CB-CE2 3.43Å; H245-F266 HydrophobicContact CB-CZ 3.47Å; H245-F266 VanDerWaalsContact CB-CZ 3.47Å; H245-F266 AromaticContact CG-CE2 4Å; H245-F266 PolarHBondContact N-O 3.28Å; H245-F266 PolarHBondContact O-N 3.45Å
246	A	85.2	Confident	82.8	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	131.3	169.1	0	0	0	0	0	109.8	C215 Y216 V218 I264 Q265	C215-A246 CarbonylContact C-O 3.54Å; C215-A246 VanDerWaalsContact CA-O 3.32Å; C215-A246 WeakPolarHBondContact CA-O 3.42Å; Y216-A246 HydrophobicContact CD1-CB 4.4Å; Y216-A246 HydrophobicContact CD2-CB 4.46Å; Y216-A246 HydrophobicContact CE1-CB 3.98Å; Y216-A246 HydrophobicContact CE2-CB 4.05Å; Y216-A246 PolarHBondContact N-O 2.86Å; Y216-A246 PolarHBondContact O-N 2.74Å; V218-A246 HydrophobicContact CG2-CB 3.63Å; A246-I264 CarbonylContact C-O 3.5Å; A246-I264 WeakPolarHBondContact CA-O 3.26Å; A246-Q265 HydrophobicContact CB-CG 4.02Å
247	C	88.3	Confident	82.7	Confident	0 Å²	0	45 Å²	45	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	149	173.6	-65.2	0	0	0	0	112	F182 L194 V213 R214 C215 R263 I264 F266	F182-C247 WeakPolarHBondContact CE1-O 3.44Å; F182-C247 HydrophobicContact CZ-CB 4.22Å; L194-C247 HydrophobicContact CD1-CB 3.95Å; V213-C247 HydrophobicContact CG1-CB 4.28Å; R214-C247 CarbonylContact O-C 3.54Å; R214-C247 VanDerWaalsContact O-CA 3.26Å; R214-C247 WeakPolarHBondContact O-CA 3.37Å; C215-C247 HydrophobicContact CB-CB 4.25Å; C215-C247 WeakPolarHBondContact CB-SG 3.43Å; C215-C247 WeakPolarHBondContact SG-CB 3.35Å; C215-C247 CovalentContact SG-SG 2.05Å; C215-C247 PolarHBondContact SG-SG 3.12Å; C247-R263 WeakPolarHBondContact O-CA 3.44Å; C247-I264 PolarHBondContact N-O 3.21Å; C247-I264 PolarHBondContact O-N 3.44Å; C247-F266 HydrophobicContact CB-CE1 4.35Å
248	L	90.8	Very high	82.5	Confident	26 Å²	26	45.4 Å²	45.4	14%	0.136	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	142.8	179.2	-69.4	159.2	0	0	0	108.5	V213 R214 Y216 W260 S261 R263	V213-L248 CarbonylContact C-O 3.56Å; V213-L248 WeakPolarHBondContact CA-O 3.47Å; V213-L248 WeakPolarHBondContact CG1-O 3.3Å; R214-L248 HydrophobicContact CB-CB 4.47Å; R214-L248 PolarHBondContact N-O 3.24Å; R214-L248 PolarHBondContact O-N 2.98Å; Y216-L248 HydrophobicContact CE1-CD1 4.36Å; L248-W260 HydrophobicContact CB-CD2 4.24Å; L248-W260 HydrophobicContact CB-CE3 3.67Å; L248-W260 HydrophobicContact CB-CZ3 4.22Å; L248-W260 HydrophobicContact CD2-CB 4.34Å; L248-S261 WeakPolarHBondContact CD2-O 3.17Å; L248-R263 HydrophobicContact CD2-CB 3.7Å; L248-R263 HydrophobicContact CG-CB 4.24Å
249	V	91.5	Very high	82.4	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	142.9	174.9	66.9	0	0	0	0	113	P179 F182 W196 Y211 Q212 V213 W260 S261	P179-V249 HydrophobicContact CB-CG1 3.91Å; P179-V249 WeakPolarHBondContact CD-O 3.44Å; P179-V249 HydrophobicContact CG-CG1 3.94Å; P179-V249 HydrophobicContact CG-CG2 4.17Å; F182-V249 HydrophobicContact CB-CG1 4.17Å; F182-V249 HydrophobicContact CD1-CG1 3.86Å; F182-V249 HydrophobicContact CD2-CB 4.33Å; F182-V249 HydrophobicContact CD2-CG1 3.49Å; F182-V249 VanDerWaalsContact CD2-CG1 3.49Å; F182-V249 HydrophobicContact CE1-CB 4.45Å; F182-V249 HydrophobicContact CE1-CG1 4.03Å; F182-V249 HydrophobicContact CE2-CB 4Å; F182-V249 HydrophobicContact CE2-CG1 3.67Å; F182-V249 HydrophobicContact CG-CG1 3.58Å; F182-V249 HydrophobicContact CZ-CB 4.07Å; F182-V249 HydrophobicContact CZ-CG1 3.93Å; W196-V249 HydrophobicContact CB-CG1 4.37Å; W196-V249 HydrophobicContact CD2-CB 4.4Å; W196-V249 HydrophobicContact CD2-CG1 4.11Å; W196-V249 HydrophobicContact CD2-CG2 3.79Å; W196-V249 HydrophobicContact CE3-CB 4.37Å; W196-V249 HydrophobicContact CE3-CG1 4.24Å; W196-V249 HydrophobicContact CE3-CG2 4.07Å; W196-V249 HydrophobicContact CG-CG1 4.2Å; W196-V249 HydrophobicContact CG-CG2 4.39Å; W196-V249 HydrophobicContact CH2-CG2 4.02Å; W196-V249 HydrophobicContact CZ2-CG2 3.75Å; W196-V249 HydrophobicContact CZ3-CG2 4.18Å; Y211-V249 HydrophobicContact CD1-CG2 4.49Å; Q212-V249 CarbonylContact O-C 3.48Å; Q212-V249 WeakPolarHBondContact O-CA 3.47Å; Q212-V249 WeakPolarHBondContact O-CG2 3.5Å; V213-V249 HydrophobicContact CG2-CB 4.04Å; V213-V249 HydrophobicContact CG2-CG2 3.67Å; V249-W260 CarbonylContact O-C 3.46Å; V249-S261 PolarHBondContact N-OG 2.54Å; V249-S261 WeakPolarHBondContact O-CB 3.41Å; V249-S261 PolarHBondContact O-N 3.47Å
250	R	91.5	Very high	82.6	Confident	49 Å²	49	34.8 Å²	34.8	19%	0.185	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	146.5	171.8	66.5	-178.5	179.6	179.6	-1.4	112.2	Y211 Q212 G258 P259 W260	Y211-R250 CarbonylContact C-O 3.58Å; Y211-R250 VanDerWaalsContact CA-O 3.26Å; Y211-R250 WeakPolarHBondContact CA-O 3.31Å; Q212-R250 HydrophobicContact CB-CG 4.05Å; Q212-R250 PolarHBondContact N-O 3.25Å; Q212-R250 PolarHBondContact O-N 3Å; Q212-R250 VanDerWaalsContact OE1-NE 3.15Å; R250-G258 WeakPolarHBondContact CD-O 3.3Å; R250-P259 WeakPolarHBondContact CB-O 3.49Å; R250-W260 HydrophobicContact CB-CD2 4.11Å; R250-W260 HydrophobicContact CB-CE3 3.84Å; R250-W260 HydrophobicContact CB-CZ3 4.26Å; R250-W260 HydrophobicContact CG-CD2 4.08Å; R250-W260 HydrophobicContact CG-CE3 3.78Å; R250-W260 HydrophobicContact CG-CH2 3.97Å; R250-W260 HydrophobicContact CG-CZ2 4.26Å; R250-W260 HydrophobicContact CG-CZ3 3.73Å
251	A	89.6	Confident	83	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	160.2	173.4	0	0	0	0	0	111.7	P175 P179 P199 I208 Y211 G258	P175-A251 HydrophobicContact CB-CB 4.49Å; P175-A251 HydrophobicContact CG-CB 4.03Å; P179-A251 HydrophobicContact CG-CB 4.16Å; P199-A251 HydrophobicContact CG-CB 3.88Å; I208-A251 HydrophobicContact CD1-CB 4.17Å; I208-A251 HydrophobicContact CG2-CB 4.02Å; Y211-A251 HydrophobicContact CD1-CB 3.89Å; Y211-A251 HydrophobicContact CE1-CB 3.78Å; A251-G258 PolarHBondContact O-N 3.13Å
252	W	88.5	Confident	82.9	Confident	56 Å²	56	36.3 Å²	36.3	21%	0.212	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	145	171.8	-75.3	63.9	0	0	0	111.4	I208 T209 K210 Q212 G256 P257	I208-W252 CarbonylContact C-O 3.54Å; I208-W252 VanDerWaalsContact CA-O 3.26Å; I208-W252 WeakPolarHBondContact CA-O 3.16Å; T209-W252 PolarHBondContact N-O 2.86Å; T209-W252 PolarHBondContact OG1-O 3.21Å; K210-W252 HydrophobicContact CD-CD2 4.4Å; K210-W252 HydrophobicContact CD-CG 4.33Å; K210-W252 HydrophobicContact CG-CB 3.63Å; K210-W252 HydrophobicContact CG-CD2 4.33Å; K210-W252 HydrophobicContact CG-CG 3.75Å; K210-W252 WeakPolarHBondContact O-CB 3.4Å; K210-W252 PolarHBondContact O-N 3.4Å; Q212-W252 VanDerWaalsContact CD-NE1 3.34Å; W252-G256 WeakPolarHBondContact CA-O 3.29Å; W252-P257 HydrophobicContact CD2-CB 3.98Å; W252-P257 HydrophobicContact CG-CB 4.29Å; W252-P257 HydrophobicContact CH2-CG 4.4Å; W252-P257 HydrophobicContact CZ2-CB 4.06Å; W252-P257 HydrophobicContact CZ2-CG 4.18Å
253	T	84.2	Confident	83.2	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.012	20%	0.204	C	C	.	.			trans	-102.5	-165.5	161	54.6	0	0	0	0	110.4	E172 S173 P175 R204 I207 I208 T209 A255 G256	E172-T253 WeakPolarHBondContact OE2-CB 3.31Å; S173-T253 WeakPolarHBondContact O-CB 3.3Å; S173-T253 WeakPolarHBondContact O-CG2 3.47Å; S173-T253 PolarHBondContact O-OG1 3.26Å; P175-T253 HydrophobicContact CG-CG2 3.96Å; R204-T253 VanDerWaalsContact O-CG2 3.29Å; R204-T253 WeakPolarHBondContact O-CG2 3.47Å; I207-T253 WeakPolarHBondContact O-CA 3.45Å; I208-T253 HydrophobicContact CD1-CG2 4.13Å; T209-T253 PolarHBondContact OG1-O 2.91Å; T253-A255 PolarHBondContact OG1-N 2.85Å; T253-G256 PolarHBondContact N-O 3.49Å
254	K	78.1	Confident	83.5	Confident	150 Å²	150	39.3 Å²	39.3	65%	0.652	20%	0.201	S	C	*	.	S	Bend	trans	-68.4	-22.8	166.1	-62.6	-166.2	-165	88.9	0	112.7	E172 T209	E172-K254 IonicContact OE1-NZ 2.7Å; E172-K254 PolarHBondContact OE1-NZ 3.4Å; E172-K254 WeakPolarHBondContact OE2-CB 3.04Å; E172-K254 WeakPolarHBondContact OE2-CG 3.05Å; E172-K254 PolarHBondContact OE2-N 2.83Å; T209-K254 HydrophobicContact CG2-CG 3.85Å
255	A	73	Confident	83.7	Confident	59 Å²	59	40.5 Å²	40.5	49%	0.488	20%	0.202	S	C	.	.	S	Bend	trans	-90.3	-17.3	-174.6	0	0	0	0	0	114.4	E172 T253	E172-A255 HydrophobicContact CB-CB 4.38Å; E172-A255 WeakPolarHBondContact O-CB 3.5Å; T253-A255 PolarHBondContact OG1-N 2.85Å
256	G	76.2	Confident	83.3	Confident	10 Å²	10	41 Å²	41	10%	0.103	20%	0.204	C	C	.	.			trans	154.1	-177.8	171.2	0	0	0	0	0	115.5	W252 T253	W252-G256 WeakPolarHBondContact CA-O 3.29Å; T253-G256 PolarHBondContact N-O 3.49Å
257	P	84.4	Confident	82.7	Confident	49 Å²	49	44.4 Å²	44.4	32%	0.318	22%	0.222	S	C	.	.	B	Isolated β-bridge	trans	-71.9	137.7	171.6	28.7	-32.3	0	0	0	111.8	A174 W252	A174-P257 WeakPolarHBondContact CB-O 3.48Å; W252-P257 HydrophobicContact CD2-CB 3.98Å; W252-P257 HydrophobicContact CG-CB 4.29Å; W252-P257 HydrophobicContact CH2-CG 4.4Å; W252-P257 HydrophobicContact CZ2-CB 4.06Å; W252-P257 HydrophobicContact CZ2-CG 4.18Å
258	G	81.6	Confident	81.6	Confident	8 Å²	8	45.1 Å²	45.1	8%	0.082	23%	0.225	C	C	.	.			trans	-80.1	-176.1	163.2	0	0	0	0	0	112.2	P175 R250 A251	P175-G258 WeakPolarHBondContact O-CA 3.43Å; R250-G258 WeakPolarHBondContact CD-O 3.3Å; A251-G258 PolarHBondContact O-N 3.13Å
259	P	81.8	Confident	79.8	Confident	24 Å²	24	47.2 Å²	47.2	16%	0.156	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-72.4	159.5	-178.7	33.5	-37.7	0	0	0	111.7	P175 R250	P175-P259 WeakPolarHBondContact O-CD 3.44Å; R250-P259 WeakPolarHBondContact CB-O 3.49Å
260	W	84.6	Confident	78	Confident	19 Å²	19	53.3 Å²	53.3	7%	0.072	27%	0.265	C	S	.	.	P	Polyproline II helix	trans	-70.2	151.7	173.3	-63.2	103.2	0	0	0	112.1	A178 Q212 R214 L227 L248 V249 R250 R444	A178-W260 WeakPolarHBondContact CB-O 3.38Å; Q212-W260 HydrophobicContact CB-CH2 4.31Å; Q212-W260 WeakPolarHBondContact O-CZ3 3.44Å; R214-W260 HydrophobicContact CB-CH2 3.64Å; R214-W260 HydrophobicContact CB-CZ2 4.33Å; R214-W260 HydrophobicContact CB-CZ3 3.83Å; L227-W260 HydrophobicContact CD1-CH2 3.79Å; L248-W260 HydrophobicContact CB-CD2 4.24Å; L248-W260 HydrophobicContact CB-CE3 3.67Å; L248-W260 HydrophobicContact CB-CZ3 4.22Å; L248-W260 HydrophobicContact CD2-CB 4.34Å; V249-W260 CarbonylContact O-C 3.46Å; R250-W260 HydrophobicContact CB-CD2 4.11Å; R250-W260 HydrophobicContact CB-CE3 3.84Å; R250-W260 HydrophobicContact CB-CZ3 4.26Å; R250-W260 HydrophobicContact CG-CD2 4.08Å; R250-W260 HydrophobicContact CG-CE3 3.78Å; R250-W260 HydrophobicContact CG-CH2 3.97Å; R250-W260 HydrophobicContact CG-CZ2 4.26Å; R250-W260 HydrophobicContact CG-CZ3 3.73Å; W260-R444 VanDerWaalsContact O-CZ 3.3Å; W260-R444 PolarHBondContact O-NH1 3.3Å; W260-R444 PolarHBondContact O-NH2 2.88Å
261	S	86.7	Confident	76.5	Confident	6 Å²	6	59.3 Å²	59.3	4%	0.042	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-62.8	170.9	167.3	67.5	0	0	0	0	111.9	F182 L248 V249	F182-S261 WeakPolarHBondContact CD1-OG 3.29Å; F182-S261 WeakPolarHBondContact CE1-OG 3.48Å; L248-S261 WeakPolarHBondContact CD2-O 3.17Å; V249-S261 PolarHBondContact N-OG 2.54Å; V249-S261 WeakPolarHBondContact O-CB 3.41Å; V249-S261 PolarHBondContact O-N 3.47Å
262	D	74.6	Confident	75.2	Confident	109 Å²	109	60.5 Å²	60.5	58%	0.583	31%	0.305	S	S	*	.	P	Polyproline II helix	trans	-58.7	146.9	156.8	-64	-34.9	0	0	0	108.8	K519	D262-K519 IonicContact OD2-NZ 2.65Å
263	R	80.3	Confident	74.7	Confident	155 Å²	155	58.4 Å²	58.4	59%	0.585	30%	0.299	S	S	*	.	P	Polyproline II helix	trans	-75	136.4	179.4	73.8	-174.7	-177.3	-164	-1.1	110.7	C247 L248	C247-R263 WeakPolarHBondContact O-CA 3.44Å; L248-R263 HydrophobicContact CD2-CB 3.7Å; L248-R263 HydrophobicContact CG-CB 4.24Å
264	I	81.1	Confident	74.6	Confident	30 Å²	30	60.8 Å²	60.8	15%	0.154	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	130.9	165.1	-54.9	171.5	0	0	0	107.7	F182 V184 L194 A246 C247 F266	F182-I264 HydrophobicContact CB-CD1 4.37Å; F182-I264 HydrophobicContact CD1-CD1 3.39Å; F182-I264 HydrophobicContact CD1-CG1 3.58Å; F182-I264 HydrophobicContact CD2-CD1 3.82Å; F182-I264 HydrophobicContact CE1-CB 4.32Å; F182-I264 HydrophobicContact CE1-CD1 3.51Å; F182-I264 HydrophobicContact CE1-CG1 3.63Å; F182-I264 HydrophobicContact CE2-CD1 3.93Å; F182-I264 HydrophobicContact CG-CD1 3.57Å; F182-I264 HydrophobicContact CG-CG1 4.24Å; F182-I264 HydrophobicContact CZ-CD1 3.79Å; F182-I264 HydrophobicContact CZ-CG1 4.32Å; V184-I264 HydrophobicContact CG2-CG2 4.14Å; L194-I264 HydrophobicContact CD2-CD1 4.47Å; A246-I264 CarbonylContact C-O 3.5Å; A246-I264 WeakPolarHBondContact CA-O 3.26Å; C247-I264 PolarHBondContact N-O 3.21Å; C247-I264 PolarHBondContact O-N 3.44Å; I264-F266 HydrophobicContact CG2-CD1 4.24Å
265	Q	82.7	Confident	74.9	Confident	89 Å²	89	55.2 Å²	55.2	42%	0.416	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	138.9	167.4	-71.9	173.7	-43.7	0	0	109.1	V218 H245 A246	V218-Q265 HydrophobicContact CG2-CG 4.49Å; H245-Q265 VanDerWaalsContact O-CA 3.27Å; H245-Q265 WeakPolarHBondContact O-CA 3.34Å; A246-Q265 HydrophobicContact CB-CG 4.02Å
266	F	75.1	Confident	75.4	Confident	21 Å²	21	52.7 Å²	52.7	9%	0.092	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	150.8	176.7	54.5	-91.4	0	0	0	110.9	V184 V192 L194 L237 L240 H245 C247 I264 I268	V184-F266 HydrophobicContact CG2-CB 4.46Å; V184-F266 HydrophobicContact CG2-CD1 4.15Å; V184-F266 HydrophobicContact CG2-CG 4.44Å; V192-F266 HydrophobicContact CB-CD2 4.48Å; V192-F266 HydrophobicContact CB-CE2 4.23Å; V192-F266 HydrophobicContact CG1-CD2 4.2Å; V192-F266 HydrophobicContact CG1-CE1 4.31Å; V192-F266 HydrophobicContact CG1-CE2 3.53Å; V192-F266 HydrophobicContact CG1-CZ 3.6Å; V192-F266 HydrophobicContact CG2-CD2 4.4Å; L194-F266 HydrophobicContact CD2-CE1 4.25Å; L237-F266 HydrophobicContact CD1-CZ 4.25Å; L240-F266 HydrophobicContact CD1-CE2 3.9Å; L240-F266 HydrophobicContact CD1-CZ 4.29Å; H245-F266 HydrophobicContact CB-CD2 4.07Å; H245-F266 HydrophobicContact CB-CE1 4.14Å; H245-F266 HydrophobicContact CB-CE2 3.43Å; H245-F266 VanDerWaalsContact CB-CE2 3.43Å; H245-F266 HydrophobicContact CB-CZ 3.47Å; H245-F266 VanDerWaalsContact CB-CZ 3.47Å; H245-F266 AromaticContact CG-CE2 4Å; H245-F266 PolarHBondContact N-O 3.28Å; H245-F266 PolarHBondContact O-N 3.45Å; C247-F266 HydrophobicContact CB-CE1 4.35Å; I264-F266 HydrophobicContact CG2-CD1 4.24Å; F266-I268 HydrophobicContact CD2-CG1 4.43Å
267	L	71.1	Confident	75.9	Confident	71 Å²	71	56.5 Å²	56.5	37%	0.372	29%	0.286	S	S	.	.			trans	-117.8	140.1	178.5	-178.9	66.2	0	0	0	109.2
268	I	66.4	Low	75.9	Confident	14 Å²	14	60.8 Å²	60.8	7%	0.072	30%	0.301	C	S	.	.	S	Bend	trans	-102.9	125.4	-178.8	-56.1	-179.1	0	0	0	109.1	Q189 L240 F266	Q189-I268 WeakPolarHBondContact O-CG2 3.46Å; L240-I268 HydrophobicContact CB-CD1 3.44Å; L240-I268 VanDerWaalsContact CB-CD1 3.44Å; L240-I268 HydrophobicContact CD1-CD1 3.86Å; L240-I268 HydrophobicContact CG-CD1 4.3Å; F266-I268 HydrophobicContact CD2-CG1 4.43Å
269	N	53.6	Low	76.1	Confident	70 Å²	70	61.8 Å²	61.8	37%	0.374	30%	0.304	S	S	.	.			trans	95.2	70.4	177	-57.5	-65.4	0	0	0	119.4	Q189 S242	Q189-N269 VanDerWaalsContact CB-OD1 3.26Å; Q189-N269 WeakPolarHBondContact CB-OD1 3.46Å; Q189-N269 VanDerWaalsContact CG-OD1 3.24Å; Q189-N269 WeakPolarHBondContact CG-OD1 3.49Å; S242-N269 PolarHBondContact OG-ND2 2.88Å
270	Q	53.7	Low	76.3	Confident	129 Å²	129	66.4 Å²	66.4	60%	0.603	32%	0.324	S	S	*	.			trans	-142.7	164.9	151.2	-70.5	-160.4	-5.3	0	0	112.2	N351	Q270-N351 PolarHBondContact OE1-ND2 2.87Å
271	K	58.2	Low	76.3	Confident	175 Å²	175	67.1 Å²	67.1	76%	0.761	33%	0.33	S	S	*	.			trans	-108.7	132.6	177.5	-168.5	-167.7	-180	-155.3	0	109.3	E356	K271-E356 IonicContact NZ-OE1 3.29Å; K271-E356 PolarHBondContact NZ-OE1 2.89Å
272	G	63.8	Low	76.2	Confident	24 Å²	24	71.8 Å²	71.8	25%	0.247	35%	0.347	C	S	.	.	P	Polyproline II helix	trans	-68.5	167.5	-172.4	0	0	0	0	0	116.4
273	P	77.6	Confident	76.3	Confident	13 Å²	13	68.9 Å²	68.9	8%	0.084	33%	0.328	C	S	.	.	P	Polyproline II helix	trans	-90.2	159.8	-166.7	33.7	-29.1	0	0	0	113.8	I302 D349 N353 G355	P273-I302 HydrophobicContact CB-CG1 4.09Å; P273-I302 HydrophobicContact CG-CG1 4.11Å; P273-D349 HydrophobicContact CG-CB 4.08Å; P273-N353 WeakPolarHBondContact CD-O 3.38Å; P273-G355 WeakPolarHBondContact O-CA 3.35Å
274	P	82	Confident	76.1	Confident	51 Å²	51	66.9 Å²	66.9	33%	0.331	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-68.4	154.5	-175.1	27	-35.2	0	0	0	114.4	P296 S347	P274-P296 HydrophobicContact CG-CB 3.97Å; P274-P296 HydrophobicContact CG-CG 4.24Å; P274-S347 VanDerWaalsContact O-CB 3.27Å; P274-S347 WeakPolarHBondContact O-CB 3.25Å; P274-S347 PolarHBondContact O-OG 3.22Å
275	P	84.5	Confident	75.6	Confident	34 Å²	34	66.8 Å²	66.8	22%	0.221	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-73.8	162.8	179.7	28.1	-34.1	0	0	0	114.4	E356	P275-E356 WeakPolarHBondContact CB-O 3.33Å
276	P	84.3	Confident	74.9	Confident	6 Å²	6	65.4 Å²	65.4	4%	0.039	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-66.7	158.6	171.4	-20.5	34.9	0	0	0	114.1	W293 T294 L305 L345	P276-W293 HydrophobicContact CB-CB 4.25Å; P276-W293 HydrophobicContact CB-CG 4.16Å; P276-T294 WeakPolarHBondContact CA-O 3.37Å; P276-T294 WeakPolarHBondContact CB-O 3.47Å; P276-L305 HydrophobicContact CG-CD1 3.99Å; P276-L305 HydrophobicContact CG-CD2 3.87Å; P276-L345 HydrophobicContact CB-CD2 4.29Å; P276-L345 HydrophobicContact CG-CB 4.26Å; P276-L345 HydrophobicContact CG-CD2 3.95Å
277	F	85.7	Confident	74.9	Confident	90 Å²	90	65 Å²	65	40%	0.395	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	173.9	-179.4	62.1	-104.9	0	0	0	113.2	I279 T294 L295	F277-I279 VanDerWaalsContact C-N 3.35Å; F277-I279 PolarHBondContact O-N 2.83Å; F277-T294 HydrophobicContact CD2-CG2 4.14Å; F277-T294 HydrophobicContact CE2-CG2 3.41Å; F277-T294 VanDerWaalsContact CE2-CG2 3.41Å; F277-T294 HydrophobicContact CZ-CG2 3.66Å; F277-T294 PolarHBondContact N-O 3.15Å; F277-T294 PolarHBondContact O-N 2.92Å; F277-L295 WeakPolarHBondContact CE1-O 3.48Å
278	H	84.7	Confident	75.3	Confident	139 Å²	139	62.1 Å²	62.1	64%	0.644	30%	0.301	S	S	*	.	E	Extended strand (participates in β ladder)	trans	49.5	47.1	-173.1	-61.7	141.9	0	0	0	114.1	Q280	H278-Q280 PolarHBondContact O-N 3.3Å
279	I	86.7	Confident	76.1	Confident	28 Å²	28	61.5 Å²	61.5	14%	0.144	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	128.4	-179.1	-56.3	151	0	0	0	109.6	F277 V281 I291 E292 W293 L345 I361	F277-I279 VanDerWaalsContact C-N 3.35Å; F277-I279 PolarHBondContact O-N 2.83Å; I279-V281 HydrophobicContact CG2-CG2 4.44Å; I279-I291 HydrophobicContact CG2-CG2 3.86Å; I279-E292 CarbonylContact C-O 3.47Å; I279-E292 VanDerWaalsContact CA-O 3.22Å; I279-E292 WeakPolarHBondContact CA-O 3.43Å; I279-W293 HydrophobicContact CB-CB 4.45Å; I279-W293 HydrophobicContact CG1-CB 3.83Å; I279-L345 HydrophobicContact CD1-CD1 4.08Å; I279-L345 HydrophobicContact CG1-CD1 4.46Å; I279-L345 HydrophobicContact CG2-CD1 4.31Å; I279-I361 HydrophobicContact CB-CD1 3.52Å; I279-I361 HydrophobicContact CG2-CD1 3.55Å; I279-I361 WeakPolarHBondContact O-CD1 3.47Å
280	Q	84.7	Confident	77.6	Confident	122 Å²	122	58.2 Å²	58.2	57%	0.57	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.9	152	175.7	-62.1	-167.8	10.4	0	0	110.8	H278 I291 E292	H278-Q280 PolarHBondContact O-N 3.3Å; Q280-I291 CarbonylContact O-C 3.52Å; Q280-I291 WeakPolarHBondContact O-CA 3.16Å; Q280-E292 PolarHBondContact N-O 3.43Å; Q280-E292 PolarHBondContact O-N 3.14Å
281	V	84	Confident	79.3	Confident	34 Å²	34	52 Å²	52	21%	0.206	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	130	-172.6	-170.8	0	0	0	0	111.3	I279 L289 T290 I291 I343 I361 T363	I279-V281 HydrophobicContact CG2-CG2 4.44Å; V281-L289 HydrophobicContact CG1-CD1 3.74Å; V281-L289 HydrophobicContact CG1-CD2 3.55Å; V281-L289 HydrophobicContact CG1-CG 3.49Å; V281-L289 VanDerWaalsContact CG1-CG 3.49Å; V281-T290 WeakPolarHBondContact CA-O 3.5Å; V281-I291 HydrophobicContact CG1-CG1 4.35Å; V281-I291 HydrophobicContact CG2-CG1 4.39Å; V281-I291 HydrophobicContact CG2-CG2 4.24Å; V281-I343 HydrophobicContact CG1-CD1 4.06Å; V281-I343 HydrophobicContact CG2-CD1 4.4Å; V281-I361 HydrophobicContact CB-CG2 4.39Å; V281-I361 HydrophobicContact CG2-CG2 3.8Å; V281-T363 HydrophobicContact CB-CG2 4.32Å; V281-T363 HydrophobicContact CG1-CG2 3.55Å
282	Y	84.6	Confident	80.7	Confident	103 Å²	103	46.8 Å²	46.8	40%	0.404	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	155.8	177.5	59.2	-92.9	0	0	0	113.8	L289 T290 E292	Y282-L289 CarbonylContact O-C 3.57Å; Y282-L289 WeakPolarHBondContact O-CA 3.25Å; Y282-T290 HydrophobicContact CE1-CG2 4.23Å; Y282-T290 HydrophobicContact CE2-CG2 4.25Å; Y282-T290 PolarHBondContact N-O 3.18Å; Y282-T290 PolarHBondContact O-N 3.2Å; Y282-E292 HydrophobicContact CE1-CG 4.19Å; Y282-E292 VanDerWaalsContact CE1-OE1 3.27Å; Y282-E292 WeakPolarHBondContact CE1-OE1 3.42Å; Y282-E292 PolarHBondContact OH-OE1 3.28Å
283	W	77.7	Confident	82	Confident	48 Å²	48	46 Å²	46	18%	0.182	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	119.3	176.8	-68	99.9	0	0	0	112	T285 L289 L335 S336 N364 Y366	W283-T285 VanDerWaalsContact CE3-O 3.32Å; W283-L289 HydrophobicContact CD2-CD1 3.69Å; W283-L289 HydrophobicContact CE3-CB 4.32Å; W283-L289 HydrophobicContact CE3-CD1 4.1Å; W283-L289 HydrophobicContact CG-CD1 3.99Å; W283-L289 HydrophobicContact CZ2-CD1 4.23Å; W283-L289 HydrophobicContact CZ3-CB 4.48Å; W283-L335 HydrophobicContact CH2-CB 4.08Å; W283-L335 HydrophobicContact CZ3-CB 4.08Å; W283-S336 WeakPolarHBondContact CH2-O 2.57Å; W283-N364 PolarHBondContact NE1-O 2.92Å; W283-Y366 HydrophobicContact CB-CD2 4.22Å
284	K	75.7	Confident	82.5	Confident	114 Å²	114	48.2 Å²	48.2	50%	0.496	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-27.4	176.8	-176.8	164.6	176.5	179.1	0	112.6	I288 T290 D331	K284-I288 HydrophobicContact CB-CB 4.39Å; K284-I288 HydrophobicContact CB-CG2 4.22Å; K284-I288 HydrophobicContact CD-CG2 4.44Å; K284-I288 PolarHBondContact N-O 3.08Å; K284-T290 WeakPolarHBondContact CD-OG1 3.48Å; K284-D331 WeakPolarHBondContact CD-OD1 3.46Å; K284-D331 WeakPolarHBondContact CE-OD2 3.08Å; K284-D331 IonicContact NZ-OD1 2.72Å; K284-D331 PolarHBondContact NZ-OD1 3.1Å; K284-D331 IonicContact NZ-OD2 2.74Å; K284-D331 PolarHBondContact NZ-OD2 3.46Å
285	T	70.8	Confident	82.6	Confident	27 Å²	27	47.6 Å²	47.6	17%	0.166	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	176.4	159.8	70.4	0	0	0	0	107.7	W283 Y287 I288	W283-T285 VanDerWaalsContact CE3-O 3.32Å; T285-Y287 PolarHBondContact O-N 2.9Å; T285-Y287 PolarHBondContact OG1-N 2.97Å; T285-I288 HydrophobicContact CG2-CD1 3.98Å; T285-I288 PolarHBondContact N-O 3.34Å; T285-I288 PolarHBondContact O-N 3.31Å; T285-I288 WeakPolarHBondContact OG1-CG1 3.35Å; T285-I288 PolarHBondContact OG1-N 3.43Å
286	Q	67.9	Low	82.3	Confident	60 Å²	60	46.6 Å²	46.6	28%	0.28	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	0.7	173.3	75.6	-171.7	3.8	0	0	114.8	P337 Y366 I840	Q286-P337 HydrophobicContact CB-CB 4.21Å; Q286-P337 HydrophobicContact CG-CB 4.42Å; Q286-P337 WeakPolarHBondContact O-CA 3.12Å; Q286-P337 VanDerWaalsContact O-CB 3.27Å; Q286-P337 WeakPolarHBondContact O-CB 3.46Å; Q286-Y366 HydrophobicContact CB-CD1 3.66Å; Q286-Y366 HydrophobicContact CB-CD2 4.21Å; Q286-Y366 HydrophobicContact CB-CE1 3.87Å; Q286-Y366 HydrophobicContact CB-CE2 4.41Å; Q286-Y366 HydrophobicContact CB-CG 3.85Å; Q286-I840 HydrophobicContact CG-CD1 4.18Å
287	Y	75.1	Confident	81.9	Confident	13 Å²	13	55.1 Å²	55.1	5%	0.051	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-140	4.7	-179.1	-46.9	-68.1	0	0	0	114.9	T285 N334 L335 P337 F833 I836 L837 I840	T285-Y287 PolarHBondContact O-N 2.9Å; T285-Y287 PolarHBondContact OG1-N 2.97Å; Y287-N334 PolarHBondContact O-N 2.76Å; Y287-L335 VanDerWaalsContact CA-O 3.27Å; Y287-L335 WeakPolarHBondContact CA-O 3.2Å; Y287-L335 PolarHBondContact O-N 2.91Å; Y287-P337 HydrophobicContact CD1-CB 4.22Å; Y287-P337 HydrophobicContact CD1-CG 4.17Å; Y287-P337 HydrophobicContact CE1-CB 4.04Å; Y287-P337 HydrophobicContact CE1-CG 3.7Å; Y287-F833 AromaticContact CD1-CE2 3.76Å; Y287-F833 HydrophobicContact CD1-CE2 3.76Å; Y287-F833 HydrophobicContact CD1-CZ 4.25Å; Y287-F833 HydrophobicContact CE1-CE2 4.38Å; Y287-I836 HydrophobicContact CE1-CB 3.83Å; Y287-I836 HydrophobicContact CE1-CD1 4.31Å; Y287-I836 HydrophobicContact CE1-CG2 4.27Å; Y287-I836 WeakPolarHBondContact OH-CB 3.41Å; Y287-I836 WeakPolarHBondContact OH-CG2 3.44Å; Y287-L837 HydrophobicContact CD1-CB 4.41Å; Y287-L837 HydrophobicContact CD2-CB 3.37Å; Y287-L837 HydrophobicContact CD2-CD1 3.79Å; Y287-L837 HydrophobicContact CD2-CG 4.14Å; Y287-L837 HydrophobicContact CE2-CB 4.05Å; Y287-L837 HydrophobicContact CG-CB 3.57Å; Y287-L837 HydrophobicContact CG-CD1 4.33Å; Y287-L837 HydrophobicContact CG-CG 4.39Å; Y287-I840 HydrophobicContact CD2-CD1 3.93Å; Y287-I840 HydrophobicContact CE2-CB 4.36Å; Y287-I840 HydrophobicContact CE2-CD1 3.61Å; Y287-I840 HydrophobicContact CE2-CG1 3.98Å
288	I	79.3	Confident	81.1	Confident	11 Å²	11	55.1 Å²	55.1	6%	0.056	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	120.4	180	-55.3	169.7	0	0	0	107.5	K284 T285 D331 D398 L837	K284-I288 HydrophobicContact CB-CB 4.39Å; K284-I288 HydrophobicContact CB-CG2 4.22Å; K284-I288 HydrophobicContact CD-CG2 4.44Å; K284-I288 PolarHBondContact N-O 3.08Å; T285-I288 HydrophobicContact CG2-CD1 3.98Å; T285-I288 PolarHBondContact N-O 3.34Å; T285-I288 PolarHBondContact O-N 3.31Å; T285-I288 WeakPolarHBondContact OG1-CG1 3.35Å; T285-I288 PolarHBondContact OG1-N 3.43Å; I288-D331 HydrophobicContact CG2-CB 3.85Å; I288-D398 HydrophobicContact CD1-CB 3.63Å; I288-D398 WeakPolarHBondContact CD1-OD2 3.49Å; I288-D398 HydrophobicContact CG1-CB 4.34Å; I288-L837 HydrophobicContact CD1-CD1 4.28Å; I288-L837 HydrophobicContact CG1-CD1 4.28Å; I288-L837 HydrophobicContact CG1-CD2 4.07Å
289	L	84	Confident	80.5	Confident	0 Å²	0	54 Å²	54	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	119.5	177	-168.2	82.1	0	0	0	107.6	V281 Y282 W283 L332 L335 I343 T363	V281-L289 HydrophobicContact CG1-CD1 3.74Å; V281-L289 HydrophobicContact CG1-CD2 3.55Å; V281-L289 HydrophobicContact CG1-CG 3.49Å; V281-L289 VanDerWaalsContact CG1-CG 3.49Å; Y282-L289 CarbonylContact O-C 3.57Å; Y282-L289 WeakPolarHBondContact O-CA 3.25Å; W283-L289 HydrophobicContact CD2-CD1 3.69Å; W283-L289 HydrophobicContact CE3-CB 4.32Å; W283-L289 HydrophobicContact CE3-CD1 4.1Å; W283-L289 HydrophobicContact CG-CD1 3.99Å; W283-L289 HydrophobicContact CZ2-CD1 4.23Å; W283-L289 HydrophobicContact CZ3-CB 4.48Å; L289-L332 PolarHBondContact N-O 3.41Å; L289-L332 PolarHBondContact O-N 3.2Å; L289-L335 HydrophobicContact CB-CD1 3.44Å; L289-L335 VanDerWaalsContact CB-CD1 3.44Å; L289-L335 HydrophobicContact CD2-CD1 3.63Å; L289-L335 HydrophobicContact CG-CD1 4.2Å; L289-I343 HydrophobicContact CD2-CD1 3.48Å; L289-I343 VanDerWaalsContact CD2-CD1 3.48Å; L289-T363 HydrophobicContact CD1-CG2 3.96Å; L289-T363 HydrophobicContact CD2-CG2 3.94Å
290	T	85.7	Confident	79.7	Confident	1 Å²	1	59.8 Å²	59.8	1%	0.006	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	130.1	174.7	-58.2	0	0	0	0	108.6	V281 Y282 K284 E292 T329 D331	V281-T290 WeakPolarHBondContact CA-O 3.5Å; Y282-T290 HydrophobicContact CE1-CG2 4.23Å; Y282-T290 HydrophobicContact CE2-CG2 4.25Å; Y282-T290 PolarHBondContact N-O 3.18Å; Y282-T290 PolarHBondContact O-N 3.2Å; K284-T290 WeakPolarHBondContact CD-OG1 3.48Å; T290-E292 HydrophobicContact CG2-CG 4.17Å; T290-T329 WeakPolarHBondContact CG2-OG1 3.19Å; T290-D331 PolarHBondContact OG1-OD1 3.22Å
291	I	89.1	Confident	79.1	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	136.8	172.4	-51.7	170.8	0	0	0	106.9	I279 Q280 V281 W293 I307 T329 E330 L332 I343	I279-I291 HydrophobicContact CG2-CG2 3.86Å; Q280-I291 CarbonylContact O-C 3.52Å; Q280-I291 WeakPolarHBondContact O-CA 3.16Å; V281-I291 HydrophobicContact CG1-CG1 4.35Å; V281-I291 HydrophobicContact CG2-CG1 4.39Å; V281-I291 HydrophobicContact CG2-CG2 4.24Å; I291-W293 HydrophobicContact CB-CE3 4.31Å; I291-W293 HydrophobicContact CB-CZ3 4.02Å; I291-W293 HydrophobicContact CG2-CE3 3.68Å; I291-W293 HydrophobicContact CG2-CZ3 3.82Å; I291-I307 HydrophobicContact CD1-CD1 4.21Å; I291-I307 HydrophobicContact CD1-CG2 3.88Å; I291-T329 CarbonylContact O-C 3.59Å; I291-T329 WeakPolarHBondContact O-CA 3.39Å; I291-T329 PolarHBondContact O-OG1 2.77Å; I291-T329 VanDerWaalsContact O-OG1 3.14Å; I291-E330 PolarHBondContact N-O 3.48Å; I291-E330 PolarHBondContact O-N 3.26Å; I291-L332 HydrophobicContact CD1-CD1 3.65Å; I291-L332 HydrophobicContact CD1-CG 3.86Å; I291-I343 HydrophobicContact CD1-CD1 3.92Å; I291-I343 HydrophobicContact CD1-CG1 4.49Å; I291-I343 HydrophobicContact CD1-CG2 4.01Å; I291-I343 HydrophobicContact CG1-CD1 4.27Å
292	E	87.4	Confident	78.8	Confident	64 Å²	64	57 Å²	57	30%	0.299	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	147.6	176.2	-56.2	-174	175.5	0	0	109.3	I279 Q280 Y282 T290 V328	I279-E292 CarbonylContact C-O 3.47Å; I279-E292 VanDerWaalsContact CA-O 3.22Å; I279-E292 WeakPolarHBondContact CA-O 3.43Å; Q280-E292 PolarHBondContact N-O 3.43Å; Q280-E292 PolarHBondContact O-N 3.14Å; Y282-E292 HydrophobicContact CE1-CG 4.19Å; Y282-E292 VanDerWaalsContact CE1-OE1 3.27Å; Y282-E292 WeakPolarHBondContact CE1-OE1 3.42Å; Y282-E292 PolarHBondContact OH-OE1 3.28Å; T290-E292 HydrophobicContact CG2-CG 4.17Å; E292-V328 CarbonylContact C-O 3.28Å; E292-V328 WeakPolarHBondContact CA-O 3.46Å
293	W	91.1	Very high	78.6	Confident	8 Å²	8	53.8 Å²	53.8	3%	0.03	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	165.3	-179.5	61.1	81.4	0	0	0	113.1	P276 I279 I291 L305 I307 V323 K327 V328 E330 L345	P276-W293 HydrophobicContact CB-CB 4.25Å; P276-W293 HydrophobicContact CB-CG 4.16Å; I279-W293 HydrophobicContact CB-CB 4.45Å; I279-W293 HydrophobicContact CG1-CB 3.83Å; I291-W293 HydrophobicContact CB-CE3 4.31Å; I291-W293 HydrophobicContact CB-CZ3 4.02Å; I291-W293 HydrophobicContact CG2-CE3 3.68Å; I291-W293 HydrophobicContact CG2-CZ3 3.82Å; W293-L305 HydrophobicContact CZ2-CD1 3.95Å; W293-L305 VanDerWaalsContact NE1-CD1 3.28Å; W293-I307 HydrophobicContact CH2-CD1 3.86Å; W293-I307 HydrophobicContact CH2-CG1 4.43Å; W293-I307 HydrophobicContact CZ3-CD1 3.93Å; W293-V323 HydrophobicContact CH2-CG2 4.18Å; W293-V323 HydrophobicContact CZ2-CG1 4.32Å; W293-V323 HydrophobicContact CZ2-CG2 4.44Å; W293-K327 WeakPolarHBondContact CZ2-O 3.47Å; W293-K327 PolarHBondContact NE1-O 2.85Å; W293-V328 PolarHBondContact N-O 3.08Å; W293-V328 WeakPolarHBondContact O-CB 3.48Å; W293-E330 HydrophobicContact CH2-CB 3.66Å; W293-E330 HydrophobicContact CZ3-CB 4.08Å; W293-L345 HydrophobicContact CD2-CD2 3.7Å; W293-L345 HydrophobicContact CE3-CD2 3.85Å; W293-L345 HydrophobicContact CG-CD2 4.04Å; W293-L345 HydrophobicContact CZ3-CD2 4.31Å
294	T	86.9	Confident	78.9	Confident	60 Å²	60	54.9 Å²	54.9	37%	0.368	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	141.2	174	-48.9	0	0	0	0	110.9	P276 F277	P276-T294 WeakPolarHBondContact CA-O 3.37Å; P276-T294 WeakPolarHBondContact CB-O 3.47Å; F277-T294 HydrophobicContact CD2-CG2 4.14Å; F277-T294 HydrophobicContact CE2-CG2 3.41Å; F277-T294 VanDerWaalsContact CE2-CG2 3.41Å; F277-T294 HydrophobicContact CZ-CG2 3.66Å; F277-T294 PolarHBondContact N-O 3.15Å; F277-T294 PolarHBondContact O-N 2.92Å
295	L	84	Confident	79.4	Confident	38 Å²	38	49.4 Å²	49.4	20%	0.199	25%	0.246	C	C	.	.			trans	-81.6	149	179.5	-63.7	173.9	0	0	0	112.2	F277 L305	F277-L295 WeakPolarHBondContact CE1-O 3.48Å; L295-L305 HydrophobicContact CD2-CD1 3.86Å
296	P	79.5	Confident	80.2	Confident	12 Å²	12	48.3 Å²	48.3	8%	0.078	24%	0.239	C	C	.	.			trans	-68	166	171.6	32	-37.4	0	0	0	112.6	P274 D298 K299 I302	P274-P296 HydrophobicContact CG-CB 3.97Å; P274-P296 HydrophobicContact CG-CG 4.24Å; P296-D298 VanDerWaalsContact C-N 3.3Å; P296-D298 PolarHBondContact O-N 2.85Å; P296-K299 PolarHBondContact O-N 3.33Å; P296-I302 HydrophobicContact CG-CD1 3.62Å
297	E	74.9	Confident	81.3	Confident	186 Å²	186	45.5 Å²	45.5	87%	0.869	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-37.7	179.9	-60.6	-169	148.9	0	0	112.1	K299	E297-K299 PolarHBondContact O-N 3.02Å
298	D	70.2	Confident	82	Confident	90 Å²	90	45.2 Å²	45.2	48%	0.481	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	22.7	176.9	-65.5	-43.7	0	0	0	115.2	P296 E300 N301	P296-D298 VanDerWaalsContact C-N 3.3Å; P296-D298 PolarHBondContact O-N 2.85Å; D298-E300 PolarHBondContact O-N 3.4Å; D298-N301 PolarHBondContact O-N 2.94Å
299	K	71.4	Confident	82.4	Confident	115 Å²	115	47.2 Å²	47.2	50%	0.5	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.1	-23.3	-178.8	70.6	-168.5	178.2	-172.2	0	115.2	P296 E297 N301	P296-K299 PolarHBondContact O-N 3.33Å; E297-K299 PolarHBondContact O-N 3.02Å; K299-N301 VanDerWaalsContact C-N 3.35Å
300	E	70.6	Confident	82.5	Confident	149 Å²	149	47.2 Å²	47.2	70%	0.696	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-24.6	-177.2	-57	-165.1	166.4	0	0	112.8	D298	D298-E300 PolarHBondContact O-N 3.4Å
301	N	72	Confident	82.4	Confident	94 Å²	94	48.7 Å²	48.7	50%	0.503	24%	0.239	S	C	.	.	S	Bend	trans	-87.7	-10.2	177.2	-73.6	-32.4	0	0	0	113.6	D298 K299 D349 L350	D298-N301 PolarHBondContact O-N 2.94Å; K299-N301 VanDerWaalsContact C-N 3.35Å; N301-D349 CarbonylContact O-C 3.59Å; N301-D349 WeakPolarHBondContact O-CA 3.29Å; N301-L350 PolarHBondContact O-N 3.01Å; N301-L350 VanDerWaalsContact O-N 3.09Å
302	I	77.6	Confident	82	Confident	5 Å²	5	51.8 Å²	51.8	3%	0.026	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	123.9	-174.8	-56.3	177.9	0	0	0	110.4	P273 P296 Y304 L305 L326 V348	P273-I302 HydrophobicContact CB-CG1 4.09Å; P273-I302 HydrophobicContact CG-CG1 4.11Å; P296-I302 HydrophobicContact CG-CD1 3.62Å; I302-Y304 WeakPolarHBondContact CG2-O 3.5Å; I302-L305 HydrophobicContact CG2-CD2 3.99Å; I302-L326 HydrophobicContact CB-CD2 4.23Å; I302-L326 HydrophobicContact CG2-CD2 3.77Å; I302-V348 CarbonylContact C-O 3.58Å; I302-V348 WeakPolarHBondContact CA-O 3.36Å; I302-V348 WeakPolarHBondContact CG2-O 3.48Å
303	A	79.6	Confident	81.4	Confident	34 Å²	34	54.7 Å²	54.7	28%	0.281	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	-40.7	175.7	0	0	0	0	0	112.8	V348 D349 L350	A303-V348 PolarHBondContact N-O 3.29Å; A303-D349 VanDerWaalsContact CB-O 3.3Å; A303-D349 WeakPolarHBondContact CB-O 3.49Å; A303-L350 HydrophobicContact CB-CD2 4.22Å
304	Y	84.2	Confident	80.6	Confident	71 Å²	71	57.8 Å²	57.8	28%	0.278	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	164.6	177.8	57.9	-86.6	0	0	0	111.3	I302 I306 F322 V323 V348	I302-Y304 WeakPolarHBondContact CG2-O 3.5Å; Y304-I306 HydrophobicContact CD2-CG1 4.19Å; Y304-I306 HydrophobicContact CE2-CD1 4.16Å; Y304-I306 HydrophobicContact CE2-CG1 4.06Å; Y304-F322 AromaticContact CD2-CD1 4Å; Y304-F322 HydrophobicContact CD2-CD1 4Å; Y304-F322 AromaticContact CE2-CD1 3.67Å; Y304-F322 HydrophobicContact CE2-CD1 3.67Å; Y304-F322 HydrophobicContact CE2-CE1 4.03Å; Y304-V323 WeakPolarHBondContact CB-O 3.32Å; Y304-V348 HydrophobicContact CD1-CB 4.31Å; Y304-V348 HydrophobicContact CD2-CB 4.17Å; Y304-V348 HydrophobicContact CD2-CG2 3.98Å; Y304-V348 HydrophobicContact CE1-CB 4.05Å; Y304-V348 HydrophobicContact CE1-CG1 3.82Å; Y304-V348 HydrophobicContact CE2-CB 3.91Å; Y304-V348 HydrophobicContact CE2-CG1 4.23Å; Y304-V348 HydrophobicContact CE2-CG2 3.55Å; Y304-V348 HydrophobicContact CG-CB 4.37Å; Y304-V348 PolarHBondContact O-N 3.01Å
305	L	86.6	Confident	79.9	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	157	173.8	-58.4	176.1	0	0	0	111.1	P276 W293 L295 I302 V323 S347	P276-L305 HydrophobicContact CG-CD1 3.99Å; P276-L305 HydrophobicContact CG-CD2 3.87Å; W293-L305 HydrophobicContact CZ2-CD1 3.95Å; W293-L305 VanDerWaalsContact NE1-CD1 3.28Å; L295-L305 HydrophobicContact CD2-CD1 3.86Å; I302-L305 HydrophobicContact CG2-CD2 3.99Å; L305-V323 HydrophobicContact CB-CB 4.32Å; L305-V323 PolarHBondContact N-O 3.24Å; L305-V323 PolarHBondContact O-N 3.39Å; L305-S347 WeakPolarHBondContact CD2-OG 3.47Å
306	I	88.4	Confident	79.5	Confident	4 Å²	4	62.8 Å²	62.8	2%	0.021	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	119.5	173.7	-55.6	177.6	0	0	0	108.7	Y304 H308 K320 Y321 F322 L345 S346 V348 E354	Y304-I306 HydrophobicContact CD2-CG1 4.19Å; Y304-I306 HydrophobicContact CE2-CD1 4.16Å; Y304-I306 HydrophobicContact CE2-CG1 4.06Å; I306-H308 WeakPolarHBondContact CG2-NE2 3.37Å; I306-H308 PolarHBondContact O-CD2 2.75Å; I306-K320 HydrophobicContact CD1-CD 4.48Å; I306-K320 HydrophobicContact CG2-CB 3.82Å; I306-K320 HydrophobicContact CG2-CD 3.8Å; I306-K320 HydrophobicContact CG2-CG 3.74Å; I306-Y321 WeakPolarHBondContact CA-O 3.38Å; I306-F322 HydrophobicContact CD1-CD1 4.2Å; I306-F322 HydrophobicContact CD1-CE1 3.8Å; I306-F322 HydrophobicContact CG1-CD1 3.85Å; I306-F322 HydrophobicContact CG1-CE1 3.96Å; I306-L345 CarbonylContact O-C 3.57Å; I306-L345 VanDerWaalsContact O-CA 3.31Å; I306-L345 WeakPolarHBondContact O-CA 3.26Å; I306-S346 PolarHBondContact N-O 3.28Å; I306-S346 PolarHBondContact O-N 3.3Å; I306-V348 HydrophobicContact CD1-CG2 3.73Å; I306-V348 HydrophobicContact CG1-CG2 4.06Å; I306-E354 HydrophobicContact CD1-CG 4.39Å
307	I	89.5	Confident	79.4	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	128.2	167.3	-50.3	172.4	0	0	0	107.5	I291 W293 K320 Y321 V323 E330 L332 I343 L345	I291-I307 HydrophobicContact CD1-CD1 4.21Å; I291-I307 HydrophobicContact CD1-CG2 3.88Å; W293-I307 HydrophobicContact CH2-CD1 3.86Å; W293-I307 HydrophobicContact CH2-CG1 4.43Å; W293-I307 HydrophobicContact CZ3-CD1 3.93Å; I307-K320 CarbonylContact O-C 3.57Å; I307-K320 WeakPolarHBondContact O-CA 3.38Å; I307-Y321 HydrophobicContact CD1-CD1 4.2Å; I307-Y321 PolarHBondContact N-O 2.95Å; I307-Y321 PolarHBondContact O-N 3.33Å; I307-V323 HydrophobicContact CD1-CG2 3.88Å; I307-V323 HydrophobicContact CG1-CG2 4.13Å; I307-E330 HydrophobicContact CD1-CB 4.29Å; I307-E330 HydrophobicContact CD1-CG 4.43Å; I307-L332 HydrophobicContact CG2-CD1 4.48Å; I307-I343 HydrophobicContact CG2-CG2 4.12Å; I307-L345 HydrophobicContact CG1-CD2 4.39Å; I307-L345 HydrophobicContact CG1-CG 4.15Å; I307-L345 HydrophobicContact CG2-CD1 4.28Å
308	H	89.4	Confident	79.8	Confident	8 Å²	8	58.1 Å²	58.1	4%	0.037	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	124.6	174.3	-53	-130.8	0	0	0	107.7	I306 W318 H319 K320 I343 R344 S346 E354 L357	I306-H308 WeakPolarHBondContact CG2-NE2 3.37Å; I306-H308 PolarHBondContact O-CD2 2.75Å; H308-W318 HydrophobicContact CB-CE3 3.71Å; H308-W318 HydrophobicContact CB-CZ3 4.22Å; H308-H319 WeakPolarHBondContact CA-O 3.42Å; H308-K320 VanDerWaalsContact CE1-CE 3.41Å; H308-K320 WeakPolarHBondContact CE1-CE 3.27Å; H308-I343 WeakPolarHBondContact O-CA 3.42Å; H308-R344 HydrophobicContact CB-CG 3.81Å; H308-R344 PolarHBondContact N-O 3.09Å; H308-R344 PolarHBondContact O-N 3.48Å; H308-S346 PolarHBondContact NE2-OG 3.28Å; H308-E354 IonicContact CE1-OE1 2.69Å; H308-E354 PolarHBondContact CE1-OE1 3.41Å; H308-E354 IonicContact NE2-OE1 2.7Å; H308-E354 PolarHBondContact NE2-OE1 3.31Å; H308-L357 WeakPolarHBondContact NE2-CD2 3.4Å
309	Y	88.8	Confident	80.3	Confident	52 Å²	52	57 Å²	57	20%	0.204	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	149.1	178.2	69.2	-84.7	0	0	0	112.4	H319 L332 L335 Y341 L342	Y309-H319 HydrophobicContact CD1-CB 4.07Å; Y309-H319 WeakPolarHBondContact CD1-O 3.47Å; Y309-H319 HydrophobicContact CD2-CB 4.34Å; Y309-H319 HydrophobicContact CE1-CB 3.58Å; Y309-H319 HydrophobicContact CE2-CB 3.88Å; Y309-H319 AromaticContact CE2-CD2 3.89Å; Y309-H319 HydrophobicContact CG-CB 4.42Å; Y309-H319 VanDerWaalsContact CZ-CB 3.47Å; Y309-H319 PolarHBondContact N-O 2.96Å; Y309-H319 PolarHBondContact O-N 2.97Å; Y309-L332 HydrophobicContact CD1-CD1 3.92Å; Y309-L332 HydrophobicContact CD1-CD2 4.46Å; Y309-L332 HydrophobicContact CE1-CD1 4.48Å; Y309-L332 HydrophobicContact CE1-CD2 4.33Å; Y309-L332 HydrophobicContact CG-CD1 4.01Å; Y309-L335 HydrophobicContact CD2-CD2 4.31Å; Y309-L335 HydrophobicContact CE2-CD2 4.21Å; Y309-Y341 HydrophobicContact CD2-CD1 4.44Å; Y309-L342 CarbonylContact C-O 3.57Å; Y309-L342 VanDerWaalsContact CA-O 3.26Å; Y309-L342 WeakPolarHBondContact CA-O 3.26Å
310	A	86.2	Confident	81.1	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	154.7	177.2	0	0	0	0	0	110.4	V317 W318 Y341 L342	A310-V317 WeakPolarHBondContact CB-O 3.26Å; A310-W318 HydrophobicContact CB-CD2 4.06Å; A310-W318 HydrophobicContact CB-CE3 4.1Å; A310-W318 HydrophobicContact CB-CG 4.48Å; A310-W318 HydrophobicContact CB-CZ3 4.42Å; A310-Y341 WeakPolarHBondContact O-CA 3.41Å; A310-L342 PolarHBondContact N-O 2.84Å; A310-L342 PolarHBondContact O-N 3.32Å
311	K	82.3	Confident	81.9	Confident	32 Å²	32	52 Å²	52	14%	0.139	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	138.4	168	-66.3	-169.6	-178.7	-161.6	0	108.9	N313 N314 S336 D339 Y341 S829	K311-N313 PolarHBondContact O-N 2.99Å; K311-N314 CarbonylContact O-C 3.5Å; K311-N314 PolarHBondContact O-N 3.47Å; K311-S336 PolarHBondContact NZ-OG 3.31Å; K311-D339 HydrophobicContact CD-CB 4.45Å; K311-D339 WeakPolarHBondContact CD-OD2 3.41Å; K311-D339 WeakPolarHBondContact CE-OD2 3.2Å; K311-D339 IonicContact NZ-OD2 3.91Å; K311-D339 PolarHBondContact NZ-OD2 3.2Å; K311-Y341 HydrophobicContact CD-CE1 4.44Å; K311-Y341 WeakPolarHBondContact CE-OH 3.46Å; K311-Y341 HydrophobicContact CG-CD1 4.06Å; K311-Y341 HydrophobicContact CG-CE1 3.57Å; K311-S829 WeakPolarHBondContact CE-OG 3.42Å; K311-S829 PolarHBondContact NZ-O 3.23Å; K311-S829 VanDerWaalsContact NZ-O 3.13Å
312	Q	80.5	Confident	82.6	Confident	65 Å²	65	52.7 Å²	52.7	30%	0.304	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-32.3	175.3	-175.1	175.1	-87.5	0	0	112	N314 E340 L342 N362	Q312-N314 PolarHBondContact O-N 3.35Å; Q312-E340 HydrophobicContact CB-CB 4.07Å; Q312-E340 WeakPolarHBondContact CB-O 3.3Å; Q312-E340 PolarHBondContact N-O 3.42Å; Q312-E340 PolarHBondContact NE2-OE2 2.74Å; Q312-L342 HydrophobicContact CB-CG 4.38Å; Q312-N362 PolarHBondContact OE1-ND2 2.92Å; Q312-N362 PolarHBondContact OE1-OD1 2.95Å
313	N	75.7	Confident	82.9	Confident	125 Å²	125	52.6 Å²	52.6	67%	0.668	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-7.5	175.1	-65.9	-24.4	0	0	0	114.2	K311	K311-N313 PolarHBondContact O-N 2.99Å
314	N	74.2	Confident	82.6	Confident	73 Å²	73	58.6 Å²	58.6	39%	0.39	28%	0.276	S	S	.	.			trans	-152.7	69.7	175.7	-167	0	0	0	0	111.9	K311 Q312 N316 V317	K311-N314 CarbonylContact O-C 3.5Å; K311-N314 PolarHBondContact O-N 3.47Å; Q312-N314 PolarHBondContact O-N 3.35Å; N314-N316 PolarHBondContact O-N 3.05Å; N314-V317 PolarHBondContact O-N 3.17Å
315	P	73.3	Confident	81.8	Confident	59 Å²	59	60.3 Å²	60.3	38%	0.383	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-1.7	-170.1	31.1	-37.4	0	0	0	114.6	W318 L342	P315-W318 PolarHBondContact O-NE1 2.71Å; P315-L342 HydrophobicContact CB-CD1 4.05Å
316	N	74.3	Confident	81.1	Confident	145 Å²	145	62.7 Å²	62.7	78%	0.775	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-17	178.4	-66.5	-20.1	0	0	0	112.8	N314	N314-N316 PolarHBondContact O-N 3.05Å
317	V	77.4	Confident	80.4	Confident	31 Å²	31	66.5 Å²	66.5	19%	0.188	32%	0.319	C	S	.	.			trans	-104.2	96.2	-178.4	-176	0	0	0	0	109.6	A310 N314	A310-V317 WeakPolarHBondContact CB-O 3.26Å; N314-V317 PolarHBondContact O-N 3.17Å
318	W	83	Confident	80.2	Confident	68 Å²	68	70.4 Å²	70.4	26%	0.258	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-94.2	122.5	176.5	-69	85.2	0	0	0	111.1	H308 A310 P315 L342 R344 I360	H308-W318 HydrophobicContact CB-CE3 3.71Å; H308-W318 HydrophobicContact CB-CZ3 4.22Å; A310-W318 HydrophobicContact CB-CD2 4.06Å; A310-W318 HydrophobicContact CB-CE3 4.1Å; A310-W318 HydrophobicContact CB-CG 4.48Å; A310-W318 HydrophobicContact CB-CZ3 4.42Å; P315-W318 PolarHBondContact O-NE1 2.71Å; W318-L342 HydrophobicContact CH2-CB 4.42Å; W318-R344 HydrophobicContact CE3-CG 4.41Å; W318-R344 HydrophobicContact CH2-CG 4.14Å; W318-R344 HydrophobicContact CZ3-CG 3.74Å; W318-I360 HydrophobicContact CH2-CD1 4.18Å; W318-I360 HydrophobicContact CH2-CG1 4.32Å; W318-I360 HydrophobicContact CZ2-CD1 4.28Å
319	H	82.3	Confident	80	Confident	68 Å²	68	72.9 Å²	72.9	32%	0.315	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	132	172.7	-58.6	-81	0	0	0	110	H308 Y309	H308-H319 WeakPolarHBondContact CA-O 3.42Å; Y309-H319 HydrophobicContact CD1-CB 4.07Å; Y309-H319 WeakPolarHBondContact CD1-O 3.47Å; Y309-H319 HydrophobicContact CD2-CB 4.34Å; Y309-H319 HydrophobicContact CE1-CB 3.58Å; Y309-H319 HydrophobicContact CE2-CB 3.88Å; Y309-H319 AromaticContact CE2-CD2 3.89Å; Y309-H319 HydrophobicContact CG-CB 4.42Å; Y309-H319 VanDerWaalsContact CZ-CB 3.47Å; Y309-H319 PolarHBondContact N-O 2.96Å; Y309-H319 PolarHBondContact O-N 2.97Å
320	K	87.6	Confident	79.9	Confident	92 Å²	92	71.8 Å²	71.8	40%	0.4	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	135.7	174.2	-72.2	-169.8	175.5	-143.1	0	111.2	I306 I307 H308 F322 E354	I306-K320 HydrophobicContact CD1-CD 4.48Å; I306-K320 HydrophobicContact CG2-CB 3.82Å; I306-K320 HydrophobicContact CG2-CD 3.8Å; I306-K320 HydrophobicContact CG2-CG 3.74Å; I307-K320 CarbonylContact O-C 3.57Å; I307-K320 WeakPolarHBondContact O-CA 3.38Å; H308-K320 VanDerWaalsContact CE1-CE 3.41Å; H308-K320 WeakPolarHBondContact CE1-CE 3.27Å; K320-F322 HydrophobicContact CB-CE2 4.35Å; K320-F322 HydrophobicContact CB-CZ 4.42Å; K320-E354 IonicContact NZ-OE1 3.25Å; K320-E354 PolarHBondContact NZ-OE1 3.43Å; K320-E354 IonicContact NZ-OE2 3.55Å; K320-E354 PolarHBondContact NZ-OE2 3.47Å
321	Y	86.4	Confident	79.9	Confident	67 Å²	67	73.7 Å²	73.7	26%	0.263	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	129	173.5	-176.1	-80.6	0	0	0	109.4	I306 I307 V323 E330 L332	I306-Y321 WeakPolarHBondContact CA-O 3.38Å; I307-Y321 HydrophobicContact CD1-CD1 4.2Å; I307-Y321 PolarHBondContact N-O 2.95Å; I307-Y321 PolarHBondContact O-N 3.33Å; Y321-V323 HydrophobicContact CD1-CG2 4.09Å; Y321-V323 HydrophobicContact CE1-CG2 4.16Å; Y321-E330 HydrophobicContact CD1-CG 4.5Å; Y321-E330 HydrophobicContact CE1-CG 3.64Å; Y321-E330 WeakPolarHBondContact CE1-OE1 3.47Å; Y321-E330 PolarHBondContact OH-OE1 3.22Å; Y321-L332 HydrophobicContact CD1-CD2 4.49Å; Y321-L332 HydrophobicContact CD2-CD2 3.93Å; Y321-L332 HydrophobicContact CE2-CD2 4.28Å; Y321-L332 HydrophobicContact CG-CD2 4.03Å
322	F	87.4	Confident	79.9	Confident	108 Å²	108	72.3 Å²	72.3	47%	0.474	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	121.6	-168.3	-62.8	-91.3	0	0	0	112.1	Y304 I306 K320	Y304-F322 AromaticContact CD2-CD1 4Å; Y304-F322 HydrophobicContact CD2-CD1 4Å; Y304-F322 AromaticContact CE2-CD1 3.67Å; Y304-F322 HydrophobicContact CE2-CD1 3.67Å; Y304-F322 HydrophobicContact CE2-CE1 4.03Å; I306-F322 HydrophobicContact CD1-CD1 4.2Å; I306-F322 HydrophobicContact CD1-CE1 3.8Å; I306-F322 HydrophobicContact CG1-CD1 3.85Å; I306-F322 HydrophobicContact CG1-CE1 3.96Å; K320-F322 HydrophobicContact CB-CE2 4.35Å; K320-F322 HydrophobicContact CB-CZ 4.42Å
323	V	83.8	Confident	79.7	Confident	3 Å²	3	69.7 Å²	69.7	2%	0.018	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	99	179.3	-174.2	0	0	0	0	109.5	W293 Y304 L305 I307 Y321 K327 E330	W293-V323 HydrophobicContact CH2-CG2 4.18Å; W293-V323 HydrophobicContact CZ2-CG1 4.32Å; W293-V323 HydrophobicContact CZ2-CG2 4.44Å; Y304-V323 WeakPolarHBondContact CB-O 3.32Å; L305-V323 HydrophobicContact CB-CB 4.32Å; L305-V323 PolarHBondContact N-O 3.24Å; L305-V323 PolarHBondContact O-N 3.39Å; I307-V323 HydrophobicContact CD1-CG2 3.88Å; I307-V323 HydrophobicContact CG1-CG2 4.13Å; Y321-V323 HydrophobicContact CD1-CG2 4.09Å; Y321-V323 HydrophobicContact CE1-CG2 4.16Å; V323-K327 HydrophobicContact CG1-CB 4.14Å; V323-K327 HydrophobicContact CG1-CD 4.4Å; V323-E330 HydrophobicContact CG2-CG 4.26Å
324	K	72.7	Confident	79.6	Confident	159 Å²	159	64.7 Å²	64.7	69%	0.691	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-15.5	-173.9	-65.6	-171.7	176.2	-173.2	0	115.3
325	D	67.7	Low	79.7	Confident	108 Å²	108	61.4 Å²	61.4	58%	0.578	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.6	9.5	-169	-49.2	-39.6	0	0	0	113.6	K327	D325-K327 HydrophobicContact CB-CD 4.11Å; D325-K327 HydrophobicContact CB-CG 4.04Å; D325-K327 PolarHBondContact O-N 3.39Å; D325-K327 VanDerWaalsContact O-N 3.09Å; D325-K327 WeakPolarHBondContact OD2-CE 3.41Å; D325-K327 IonicContact OD2-NZ 2.83Å; D325-K327 PolarHBondContact OD2-NZ 3.37Å
326	L	71.6	Confident	79.6	Confident	50 Å²	50	59 Å²	59	26%	0.262	29%	0.291	S	S	.	.			trans	49.1	31.8	-172.2	-62.5	175.8	0	0	0	114.3	I302	I302-L326 HydrophobicContact CB-CD2 4.23Å; I302-L326 HydrophobicContact CG2-CD2 3.77Å
327	K	74.3	Confident	79.1	Confident	83 Å²	83	53.1 Å²	53.1	36%	0.361	26%	0.26	S	S	.	.			trans	-58.6	153.1	174.5	-72.5	157.3	177.4	157.7	0	111.3	W293 V323 D325 T329 E330	W293-K327 WeakPolarHBondContact CZ2-O 3.47Å; W293-K327 PolarHBondContact NE1-O 2.85Å; V323-K327 HydrophobicContact CG1-CB 4.14Å; V323-K327 HydrophobicContact CG1-CD 4.4Å; D325-K327 HydrophobicContact CB-CD 4.11Å; D325-K327 HydrophobicContact CB-CG 4.04Å; D325-K327 PolarHBondContact O-N 3.39Å; D325-K327 VanDerWaalsContact O-N 3.09Å; D325-K327 WeakPolarHBondContact OD2-CE 3.41Å; D325-K327 IonicContact OD2-NZ 2.83Å; D325-K327 PolarHBondContact OD2-NZ 3.37Å; K327-T329 WeakPolarHBondContact CB-O 3.37Å; K327-E330 VanDerWaalsContact CD-OE2 3.29Å; K327-E330 WeakPolarHBondContact CD-OE2 3.31Å; K327-E330 IonicContact NZ-OE2 3.8Å
328	V	84.4	Confident	78.5	Confident	83 Å²	83	58.4 Å²	58.4	50%	0.503	29%	0.288	S	S	.	.	S	Bend	trans	-97.7	-2	172.3	-66.8	0	0	0	0	113	E292 W293	E292-V328 CarbonylContact C-O 3.28Å; E292-V328 WeakPolarHBondContact CA-O 3.46Å; W293-V328 PolarHBondContact N-O 3.08Å; W293-V328 WeakPolarHBondContact O-CB 3.48Å
329	T	86.2	Confident	78.1	Confident	59 Å²	59	56.8 Å²	56.8	36%	0.362	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	142.7	176.2	178.3	0	0	0	0	110.2	T290 I291 K327	T290-T329 WeakPolarHBondContact CG2-OG1 3.19Å; I291-T329 CarbonylContact O-C 3.59Å; I291-T329 WeakPolarHBondContact O-CA 3.39Å; I291-T329 PolarHBondContact O-OG1 2.77Å; I291-T329 VanDerWaalsContact O-OG1 3.14Å; K327-T329 WeakPolarHBondContact CB-O 3.37Å
330	E	86.9	Confident	77.9	Confident	29 Å²	29	56.5 Å²	56.5	14%	0.136	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	134.3	176.2	-172.6	76.6	-170.6	0	0	109.6	I291 W293 I307 Y321 V323 K327 L332	I291-E330 PolarHBondContact N-O 3.48Å; I291-E330 PolarHBondContact O-N 3.26Å; W293-E330 HydrophobicContact CH2-CB 3.66Å; W293-E330 HydrophobicContact CZ3-CB 4.08Å; I307-E330 HydrophobicContact CD1-CB 4.29Å; I307-E330 HydrophobicContact CD1-CG 4.43Å; Y321-E330 HydrophobicContact CD1-CG 4.5Å; Y321-E330 HydrophobicContact CE1-CG 3.64Å; Y321-E330 WeakPolarHBondContact CE1-OE1 3.47Å; Y321-E330 PolarHBondContact OH-OE1 3.22Å; V323-E330 HydrophobicContact CG2-CG 4.26Å; K327-E330 VanDerWaalsContact CD-OE2 3.29Å; K327-E330 WeakPolarHBondContact CD-OE2 3.31Å; K327-E330 IonicContact NZ-OE2 3.8Å; E330-L332 PolarHBondContact O-N 3.41Å
331	D	85.1	Confident	77.8	Confident	40 Å²	40	52.5 Å²	52.5	21%	0.214	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	112.1	174	-75.1	-20.2	0	0	0	109.6	K284 I288 T290 G333 R400	K284-D331 WeakPolarHBondContact CD-OD1 3.46Å; K284-D331 WeakPolarHBondContact CE-OD2 3.08Å; K284-D331 IonicContact NZ-OD1 2.72Å; K284-D331 PolarHBondContact NZ-OD1 3.1Å; K284-D331 IonicContact NZ-OD2 2.74Å; K284-D331 PolarHBondContact NZ-OD2 3.46Å; I288-D331 HydrophobicContact CG2-CB 3.85Å; T290-D331 PolarHBondContact OG1-OD1 3.22Å; D331-G333 PolarHBondContact O-N 3Å; D331-R400 PolarHBondContact O-NH1 3.25Å; D331-R400 PolarHBondContact O-NH2 3.27Å
332	L	82.8	Confident	77.9	Confident	4 Å²	4	50.6 Å²	50.6	2%	0.021	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	92	156	-76.2	-173.7	0	0	0	108.8	L289 I291 I307 Y309 Y321 E330 L335	L289-L332 PolarHBondContact N-O 3.41Å; L289-L332 PolarHBondContact O-N 3.2Å; I291-L332 HydrophobicContact CD1-CD1 3.65Å; I291-L332 HydrophobicContact CD1-CG 3.86Å; I307-L332 HydrophobicContact CG2-CD1 4.48Å; Y309-L332 HydrophobicContact CD1-CD1 3.92Å; Y309-L332 HydrophobicContact CD1-CD2 4.46Å; Y309-L332 HydrophobicContact CE1-CD1 4.48Å; Y309-L332 HydrophobicContact CE1-CD2 4.33Å; Y309-L332 HydrophobicContact CG-CD1 4.01Å; Y321-L332 HydrophobicContact CD1-CD2 4.49Å; Y321-L332 HydrophobicContact CD2-CD2 3.93Å; Y321-L332 HydrophobicContact CE2-CD2 4.28Å; Y321-L332 HydrophobicContact CG-CD2 4.03Å; E330-L332 PolarHBondContact O-N 3.41Å; L332-L335 HydrophobicContact CB-CD1 3.68Å; L332-L335 HydrophobicContact CB-CG 4.35Å; L332-L335 HydrophobicContact CD1-CD1 4.37Å; L332-L335 WeakPolarHBondContact O-CD1 3.43Å
333	G	77.4	Confident	78	Confident	10 Å²	10	45.5 Å²	45.5	10%	0.103	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	168	160.3	0	0	0	0	0	110.6	D331 R400	D331-G333 PolarHBondContact O-N 3Å; G333-R400 VanDerWaalsContact CA-CZ 3.46Å; G333-R400 VanDerWaalsContact N-NH1 3.16Å; G333-R400 WeakPolarHBondContact O-CD 3.33Å
334	N	72.3	Confident	78.4	Confident	20 Å²	20	47.9 Å²	47.9	11%	0.107	25%	0.246	C	C	.	.	S	Bend	trans	64.6	57.1	-158.5	-78.9	0.7	0	0	0	114.1	Y287 R400 D401 F833 F834	Y287-N334 PolarHBondContact O-N 2.76Å; N334-R400 HydrophobicContact CB-CB 4.21Å; N334-R400 VanDerWaalsContact ND2-CB 3.35Å; N334-R400 WeakPolarHBondContact ND2-CB 3.5Å; N334-R400 PolarHBondContact ND2-O 3.12Å; N334-R400 WeakPolarHBondContact OD1-CB 3.46Å; N334-D401 PolarHBondContact OD1-N 3.36Å; N334-D401 PolarHBondContact OD1-OD2 3.21Å; N334-F833 HydrophobicContact CB-CD1 3.99Å; N334-F833 HydrophobicContact CB-CE1 3.42Å; N334-F833 VanDerWaalsContact CB-CE1 3.42Å; N334-F833 HydrophobicContact CB-CZ 4.37Å; N334-F834 HydrophobicContact CB-CD2 4.41Å; N334-F834 HydrophobicContact CB-CE2 4.22Å; N334-F834 WeakPolarHBondContact ND2-CD1 3.34Å; N334-F834 VanDerWaalsContact ND2-CD2 3.3Å; N334-F834 WeakPolarHBondContact ND2-CD2 2.46Å; N334-F834 WeakPolarHBondContact ND2-CE1 3.27Å; N334-F834 WeakPolarHBondContact ND2-CE2 2.9Å; N334-F834 WeakPolarHBondContact ND2-CG 3.49Å; N334-F834 WeakPolarHBondContact ND2-CZ 3.45Å
335	L	76.2	Confident	79.2	Confident	3 Å²	3	40.3 Å²	40.3	2%	0.016	21%	0.213	C	C	.	.			trans	-127.5	146.5	170.6	-62.2	175.6	0	0	0	111.7	W283 Y287 L289 Y309 L332 Y341 F833	W283-L335 HydrophobicContact CH2-CB 4.08Å; W283-L335 HydrophobicContact CZ3-CB 4.08Å; Y287-L335 VanDerWaalsContact CA-O 3.27Å; Y287-L335 WeakPolarHBondContact CA-O 3.2Å; Y287-L335 PolarHBondContact O-N 2.91Å; L289-L335 HydrophobicContact CB-CD1 3.44Å; L289-L335 VanDerWaalsContact CB-CD1 3.44Å; L289-L335 HydrophobicContact CD2-CD1 3.63Å; L289-L335 HydrophobicContact CG-CD1 4.2Å; Y309-L335 HydrophobicContact CD2-CD2 4.31Å; Y309-L335 HydrophobicContact CE2-CD2 4.21Å; L332-L335 HydrophobicContact CB-CD1 3.68Å; L332-L335 HydrophobicContact CB-CG 4.35Å; L332-L335 HydrophobicContact CD1-CD1 4.37Å; L332-L335 WeakPolarHBondContact O-CD1 3.43Å; L335-Y341 HydrophobicContact CB-CD2 4.49Å; L335-Y341 HydrophobicContact CB-CE2 3.9Å; L335-Y341 HydrophobicContact CD2-CD1 3.87Å; L335-Y341 HydrophobicContact CD2-CE1 3.41Å; L335-Y341 VanDerWaalsContact CD2-CE1 3.41Å; L335-Y341 HydrophobicContact CD2-CE2 4.16Å; L335-Y341 HydrophobicContact CD2-CG 4.4Å; L335-F833 WeakPolarHBondContact O-CE2 3.44Å; L335-F833 WeakPolarHBondContact O-CZ 3.13Å
336	S	72.2	Confident	80.3	Confident	10 Å²	10	35.1 Å²	35.1	7%	0.07	19%	0.185	C	C	.	.			trans	-78	135.9	-168.7	-43.2	0	0	0	0	112.7	W283 K311 N338 D339 Y341 F833	W283-S336 WeakPolarHBondContact CH2-O 2.57Å; K311-S336 PolarHBondContact NZ-OG 3.31Å; S336-N338 PolarHBondContact O-N 2.56Å; S336-N338 VanDerWaalsContact O-N 3.12Å; S336-D339 VanDerWaalsContact CB-OD2 3.24Å; S336-D339 WeakPolarHBondContact CB-OD2 3.35Å; S336-D339 PolarHBondContact O-N 3.07Å; S336-D339 PolarHBondContact OG-OD2 3.41Å; S336-D339 VanDerWaalsContact OG-OD2 3.09Å; S336-Y341 PolarHBondContact N-OH 2.89Å; S336-Y341 PolarHBondContact OG-OH 3.31Å; S336-Y341 VanDerWaalsContact OG-OH 3.07Å; S336-F833 WeakPolarHBondContact OG-CD2 3.38Å; S336-F833 WeakPolarHBondContact OG-CG 3.46Å
337	P	62.8	Low	81	Confident	20 Å²	20	32.8 Å²	32.8	13%	0.13	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-20.7	-174.4	30.1	-36.4	0	0	0	113	Q286 Y287	Q286-P337 HydrophobicContact CB-CB 4.21Å; Q286-P337 HydrophobicContact CG-CB 4.42Å; Q286-P337 WeakPolarHBondContact O-CA 3.12Å; Q286-P337 VanDerWaalsContact O-CB 3.27Å; Q286-P337 WeakPolarHBondContact O-CB 3.46Å; Y287-P337 HydrophobicContact CD1-CB 4.22Å; Y287-P337 HydrophobicContact CD1-CG 4.17Å; Y287-P337 HydrophobicContact CE1-CB 4.04Å; Y287-P337 HydrophobicContact CE1-CG 3.7Å
338	N	64.9	Low	81.4	Confident	142 Å²	142	28.9 Å²	28.9	76%	0.759	16%	0.156	S	C	*	.	T	Hydrogen-bonded Turn	trans	-116.1	-1.2	-171.3	-60.6	5.3	0	0	0	112.9	S336	S336-N338 PolarHBondContact O-N 2.56Å; S336-N338 VanDerWaalsContact O-N 3.12Å
339	D	74.8	Confident	81.1	Confident	34 Å²	34	25.3 Å²	25.3	18%	0.182	13%	0.134	C	C	.	.			trans	-103.6	140.5	175.9	-68.6	-40.6	0	0	0	110.1	K311 S336 Y341	K311-D339 HydrophobicContact CD-CB 4.45Å; K311-D339 WeakPolarHBondContact CD-OD2 3.41Å; K311-D339 WeakPolarHBondContact CE-OD2 3.2Å; K311-D339 IonicContact NZ-OD2 3.91Å; K311-D339 PolarHBondContact NZ-OD2 3.2Å; S336-D339 VanDerWaalsContact CB-OD2 3.24Å; S336-D339 WeakPolarHBondContact CB-OD2 3.35Å; S336-D339 PolarHBondContact O-N 3.07Å; S336-D339 PolarHBondContact OG-OD2 3.41Å; S336-D339 VanDerWaalsContact OG-OD2 3.09Å; D339-Y341 HydrophobicContact CB-CD2 4.38Å; D339-Y341 HydrophobicContact CB-CE2 3.79Å; D339-Y341 WeakPolarHBondContact O-CD2 3.19Å
340	E	79.3	Confident	80.4	Confident	63 Å²	63	27.8 Å²	27.8	29%	0.294	15%	0.145	S	C	.	.			trans	-87.9	142.2	169.4	-60.1	-176.1	153.7	0	0	109.8	Q312	Q312-E340 HydrophobicContact CB-CB 4.07Å; Q312-E340 WeakPolarHBondContact CB-O 3.3Å; Q312-E340 PolarHBondContact N-O 3.42Å; Q312-E340 PolarHBondContact NE2-OE2 2.74Å
341	Y	84.9	Confident	79.1	Confident	8 Å²	8	29.6 Å²	29.6	3%	0.031	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	140.6	-172.4	-73.2	-94.3	0	0	0	113	Y309 A310 K311 L335 S336 D339 N362 T363	Y309-Y341 HydrophobicContact CD2-CD1 4.44Å; A310-Y341 WeakPolarHBondContact O-CA 3.41Å; K311-Y341 HydrophobicContact CD-CE1 4.44Å; K311-Y341 WeakPolarHBondContact CE-OH 3.46Å; K311-Y341 HydrophobicContact CG-CD1 4.06Å; K311-Y341 HydrophobicContact CG-CE1 3.57Å; L335-Y341 HydrophobicContact CB-CD2 4.49Å; L335-Y341 HydrophobicContact CB-CE2 3.9Å; L335-Y341 HydrophobicContact CD2-CD1 3.87Å; L335-Y341 HydrophobicContact CD2-CE1 3.41Å; L335-Y341 VanDerWaalsContact CD2-CE1 3.41Å; L335-Y341 HydrophobicContact CD2-CE2 4.16Å; L335-Y341 HydrophobicContact CD2-CG 4.4Å; S336-Y341 PolarHBondContact N-OH 2.89Å; S336-Y341 PolarHBondContact OG-OH 3.31Å; S336-Y341 VanDerWaalsContact OG-OH 3.07Å; D339-Y341 HydrophobicContact CB-CD2 4.38Å; D339-Y341 HydrophobicContact CB-CE2 3.79Å; D339-Y341 WeakPolarHBondContact O-CD2 3.19Å; Y341-N362 PolarHBondContact O-OD1 2.98Å; Y341-T363 WeakPolarHBondContact CA-OG1 3.33Å; Y341-T363 WeakPolarHBondContact CB-OG1 3.46Å; Y341-T363 PolarHBondContact N-OG1 2.8Å; Y341-T363 PolarHBondContact O-N 3.14Å; Y341-T363 PolarHBondContact O-OG1 3.18Å
342	L	89.1	Confident	78.1	Confident	27 Å²	27	29.9 Å²	29.9	14%	0.141	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	134.2	176.7	-57.8	175.7	0	0	0	110.2	Y309 A310 Q312 P315 W318 I360 I361 N362	Y309-L342 CarbonylContact C-O 3.57Å; Y309-L342 VanDerWaalsContact CA-O 3.26Å; Y309-L342 WeakPolarHBondContact CA-O 3.26Å; A310-L342 PolarHBondContact N-O 2.84Å; A310-L342 PolarHBondContact O-N 3.32Å; Q312-L342 HydrophobicContact CB-CG 4.38Å; P315-L342 HydrophobicContact CB-CD1 4.05Å; W318-L342 HydrophobicContact CH2-CB 4.42Å; L342-I360 HydrophobicContact CB-CG2 3.98Å; L342-I360 HydrophobicContact CD2-CG2 4.15Å; L342-I361 CarbonylContact C-O 3.28Å; L342-I361 WeakPolarHBondContact CA-O 3.43Å; L342-N362 HydrophobicContact CD2-CB 4.14Å
343	I	89.1	Confident	77.4	Confident	1 Å²	1	32 Å²	32	1%	0.005	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	141.8	-172.9	-69.1	159.4	0	0	0	111.6	V281 L289 I291 I307 H308 L345 I360 I361 T363	V281-I343 HydrophobicContact CG1-CD1 4.06Å; V281-I343 HydrophobicContact CG2-CD1 4.4Å; L289-I343 HydrophobicContact CD2-CD1 3.48Å; L289-I343 VanDerWaalsContact CD2-CD1 3.48Å; I291-I343 HydrophobicContact CD1-CD1 3.92Å; I291-I343 HydrophobicContact CD1-CG1 4.49Å; I291-I343 HydrophobicContact CD1-CG2 4.01Å; I291-I343 HydrophobicContact CG1-CD1 4.27Å; I307-I343 HydrophobicContact CG2-CG2 4.12Å; H308-I343 WeakPolarHBondContact O-CA 3.42Å; I343-L345 HydrophobicContact CG2-CD1 4.15Å; I343-I360 CarbonylContact O-C 3.54Å; I343-I360 WeakPolarHBondContact O-CA 3.42Å; I343-I361 PolarHBondContact N-O 2.89Å; I343-I361 PolarHBondContact O-N 2.82Å; I343-T363 HydrophobicContact CD1-CG2 4.31Å
344	R	90.7	Very high	77.4	Confident	52 Å²	52	35.5 Å²	35.5	20%	0.196	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	161.8	169	66.8	-175.2	179.7	-167.9	-5.1	111.2	H308 W318 L357 S358	H308-R344 HydrophobicContact CB-CG 3.81Å; H308-R344 PolarHBondContact N-O 3.09Å; H308-R344 PolarHBondContact O-N 3.48Å; W318-R344 HydrophobicContact CE3-CG 4.41Å; W318-R344 HydrophobicContact CH2-CG 4.14Å; W318-R344 HydrophobicContact CZ3-CG 3.74Å; R344-L357 HydrophobicContact CG-CD2 4.31Å; R344-S358 WeakPolarHBondContact CA-OG 3.08Å
345	L	90.8	Very high	77.8	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	153.8	-177.6	-79	75.1	0	0	0	112.9	P276 I279 W293 I306 I307 I343 L357 S358	P276-L345 HydrophobicContact CB-CD2 4.29Å; P276-L345 HydrophobicContact CG-CB 4.26Å; P276-L345 HydrophobicContact CG-CD2 3.95Å; I279-L345 HydrophobicContact CD1-CD1 4.08Å; I279-L345 HydrophobicContact CG1-CD1 4.46Å; I279-L345 HydrophobicContact CG2-CD1 4.31Å; W293-L345 HydrophobicContact CD2-CD2 3.7Å; W293-L345 HydrophobicContact CE3-CD2 3.85Å; W293-L345 HydrophobicContact CG-CD2 4.04Å; W293-L345 HydrophobicContact CZ3-CD2 4.31Å; I306-L345 CarbonylContact O-C 3.57Å; I306-L345 VanDerWaalsContact O-CA 3.31Å; I306-L345 WeakPolarHBondContact O-CA 3.26Å; I307-L345 HydrophobicContact CG1-CD2 4.39Å; I307-L345 HydrophobicContact CG1-CG 4.15Å; I307-L345 HydrophobicContact CG2-CD1 4.28Å; I343-L345 HydrophobicContact CG2-CD1 4.15Å; L345-L357 CarbonylContact O-C 3.4Å; L345-L357 WeakPolarHBondContact O-CA 3.49Å; L345-S358 PolarHBondContact N-OG 3.25Å; L345-S358 PolarHBondContact O-N 2.9Å
346	S	89.5	Confident	78.2	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	159.6	164.7	53	0	0	0	0	111.8	I306 H308 E354	I306-S346 PolarHBondContact N-O 3.28Å; I306-S346 PolarHBondContact O-N 3.3Å; H308-S346 PolarHBondContact NE2-OG 3.28Å; S346-E354 PolarHBondContact OG-OE1 2.82Å
347	S	87.1	Confident	78.8	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	149.6	178.4	-57.6	0	0	0	0	111.3	P274 L305 G355	P274-S347 VanDerWaalsContact O-CB 3.27Å; P274-S347 WeakPolarHBondContact O-CB 3.25Å; P274-S347 PolarHBondContact O-OG 3.22Å; L305-S347 WeakPolarHBondContact CD2-OG 3.47Å; S347-G355 PolarHBondContact O-N 2.68Å
348	V	82.3	Confident	80	Confident	1 Å²	1	44.4 Å²	44.4	1%	0.006	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	135.8	176.1	-173.3	0	0	0	0	110.6	I302 A303 Y304 I306 G352 N353 E354	I302-V348 CarbonylContact C-O 3.58Å; I302-V348 WeakPolarHBondContact CA-O 3.36Å; I302-V348 WeakPolarHBondContact CG2-O 3.48Å; A303-V348 PolarHBondContact N-O 3.29Å; Y304-V348 HydrophobicContact CD1-CB 4.31Å; Y304-V348 HydrophobicContact CD2-CB 4.17Å; Y304-V348 HydrophobicContact CD2-CG2 3.98Å; Y304-V348 HydrophobicContact CE1-CB 4.05Å; Y304-V348 HydrophobicContact CE1-CG1 3.82Å; Y304-V348 HydrophobicContact CE2-CB 3.91Å; Y304-V348 HydrophobicContact CE2-CG1 4.23Å; Y304-V348 HydrophobicContact CE2-CG2 3.55Å; Y304-V348 HydrophobicContact CG-CB 4.37Å; Y304-V348 PolarHBondContact O-N 3.01Å; I306-V348 HydrophobicContact CD1-CG2 3.73Å; I306-V348 HydrophobicContact CG1-CG2 4.06Å; V348-G352 VanDerWaalsContact CG1-C 3.5Å; V348-N353 WeakPolarHBondContact CA-O 3.31Å; V348-E354 HydrophobicContact CG2-CB 4.17Å; V348-E354 HydrophobicContact CG2-CG 4.25Å
349	D	77.6	Confident	81	Confident	9 Å²	9	44.5 Å²	44.5	5%	0.048	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	173.8	179.7	76.4	5.8	0	0	0	114.5	P273 N301 A303 N351 G352 N353	P273-D349 HydrophobicContact CG-CB 4.08Å; N301-D349 CarbonylContact O-C 3.59Å; N301-D349 WeakPolarHBondContact O-CA 3.29Å; A303-D349 VanDerWaalsContact CB-O 3.3Å; A303-D349 WeakPolarHBondContact CB-O 3.49Å; D349-N351 PolarHBondContact O-N 3.02Å; D349-N351 VanDerWaalsContact OD1-C 3.32Å; D349-N351 VanDerWaalsContact OD1-CA 3.29Å; D349-N351 WeakPolarHBondContact OD1-CA 3.3Å; D349-N351 WeakPolarHBondContact OD1-CB 3.49Å; D349-N351 PolarHBondContact OD1-N 2.87Å; D349-N351 PolarHBondContact OD2-ND2 2.91Å; D349-G352 PolarHBondContact O-N 3.39Å; D349-G352 VanDerWaalsContact O-N 3.12Å; D349-G352 PolarHBondContact OD1-N 2.79Å; D349-N353 PolarHBondContact N-O 3.3Å; D349-N353 PolarHBondContact OD1-N 3.15Å; D349-N353 PolarHBondContact OD1-ND2 2.77Å; D349-N353 PolarHBondContact OD2-ND2 3.5Å
350	L	72.4	Confident	81.5	Confident	110 Å²	110	47.4 Å²	47.4	58%	0.576	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-16.2	173.7	-66.5	171.6	0	0	0	114.7	N301 A303	N301-L350 PolarHBondContact O-N 3.01Å; N301-L350 VanDerWaalsContact O-N 3.09Å; A303-L350 HydrophobicContact CB-CD2 4.22Å
351	N	60.1	Low	81.8	Confident	68 Å²	68	46.7 Å²	46.7	36%	0.364	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-9.7	177.5	-51.6	-62.8	0	0	0	112.8	Q270 D349	Q270-N351 PolarHBondContact OE1-ND2 2.87Å; D349-N351 PolarHBondContact O-N 3.02Å; D349-N351 VanDerWaalsContact OD1-C 3.32Å; D349-N351 VanDerWaalsContact OD1-CA 3.29Å; D349-N351 WeakPolarHBondContact OD1-CA 3.3Å; D349-N351 WeakPolarHBondContact OD1-CB 3.49Å; D349-N351 PolarHBondContact OD1-N 2.87Å; D349-N351 PolarHBondContact OD2-ND2 2.91Å
352	G	64.2	Low	81.6	Confident	46 Å²	46	49.9 Å²	49.9	47%	0.474	27%	0.27	S	S	.	.	S	Bend	trans	98.5	7.7	-178.1	0	0	0	0	0	115.8	V348 D349	V348-G352 VanDerWaalsContact CG1-C 3.5Å; D349-G352 PolarHBondContact O-N 3.39Å; D349-G352 VanDerWaalsContact O-N 3.12Å; D349-G352 PolarHBondContact OD1-N 2.79Å
353	N	66.7	Low	80.9	Confident	49 Å²	49	48.9 Å²	48.9	26%	0.262	27%	0.266	S	S	.	.			trans	-80.4	118	179.8	-55.4	-61.1	0	0	0	111.3	P273 V348 D349	P273-N353 WeakPolarHBondContact CD-O 3.38Å; V348-N353 WeakPolarHBondContact CA-O 3.31Å; D349-N353 PolarHBondContact N-O 3.3Å; D349-N353 PolarHBondContact OD1-N 3.15Å; D349-N353 PolarHBondContact OD1-ND2 2.77Å; D349-N353 PolarHBondContact OD2-ND2 3.5Å
354	E	79.1	Confident	79.7	Confident	82 Å²	82	55.2 Å²	55.2	38%	0.383	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	133.6	171.6	-171.6	173.1	-172.7	0	0	110.6	I306 H308 K320 S346 V348	I306-E354 HydrophobicContact CD1-CG 4.39Å; H308-E354 IonicContact CE1-OE1 2.69Å; H308-E354 PolarHBondContact CE1-OE1 3.41Å; H308-E354 IonicContact NE2-OE1 2.7Å; H308-E354 PolarHBondContact NE2-OE1 3.31Å; K320-E354 IonicContact NZ-OE1 3.25Å; K320-E354 PolarHBondContact NZ-OE1 3.43Å; K320-E354 IonicContact NZ-OE2 3.55Å; K320-E354 PolarHBondContact NZ-OE2 3.47Å; S346-E354 PolarHBondContact OG-OE1 2.82Å; V348-E354 HydrophobicContact CG2-CB 4.17Å; V348-E354 HydrophobicContact CG2-CG 4.25Å
355	G	80.1	Confident	78.1	Confident	19 Å²	19	55.1 Å²	55.1	20%	0.196	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	-161.7	179.3	0	0	0	0	0	114.5	P273 S347	P273-G355 WeakPolarHBondContact O-CA 3.35Å; S347-G355 PolarHBondContact O-N 2.68Å
356	E	83.4	Confident	76.1	Confident	126 Å²	126	59.3 Å²	59.3	59%	0.589	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.7	159.3	-178.6	-66.9	172.8	-158.7	0	0	112	K271 P275	K271-E356 IonicContact NZ-OE1 3.29Å; K271-E356 PolarHBondContact NZ-OE1 2.89Å; P275-E356 WeakPolarHBondContact CB-O 3.33Å
357	L	85.3	Confident	74.2	Confident	77 Å²	77	67.6 Å²	67.6	40%	0.403	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	146.6	-175.2	-74.6	160.3	0	0	0	111.6	H308 R344 L345	H308-L357 WeakPolarHBondContact NE2-CD2 3.4Å; R344-L357 HydrophobicContact CG-CD2 4.31Å; L345-L357 CarbonylContact O-C 3.4Å; L345-L357 WeakPolarHBondContact O-CA 3.49Å
358	S	87.7	Confident	71.9	Confident	18 Å²	18	74.2 Å²	74.2	13%	0.126	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-71.7	167.7	172	80.2	0	0	0	0	113.3	R344 L345	R344-S358 WeakPolarHBondContact CA-OG 3.08Å; L345-S358 PolarHBondContact N-OG 3.25Å; L345-S358 PolarHBondContact O-N 2.9Å
359	D	86.5	Confident	69.6	Low	144 Å²	144	79.4 Å²	79.4	77%	0.77	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-55.3	159.9	163.4	-68.1	-51.1	0	0	0	112.7
360	I	85.4	Confident	67.4	Low	95 Å²	95	84.1 Å²	84.1	49%	0.487	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-93.3	128.2	-178.9	-57.6	175	0	0	0	110.3	W318 L342 I343	W318-I360 HydrophobicContact CH2-CD1 4.18Å; W318-I360 HydrophobicContact CH2-CG1 4.32Å; W318-I360 HydrophobicContact CZ2-CD1 4.28Å; L342-I360 HydrophobicContact CB-CG2 3.98Å; L342-I360 HydrophobicContact CD2-CG2 4.15Å; I343-I360 CarbonylContact O-C 3.54Å; I343-I360 WeakPolarHBondContact O-CA 3.42Å
361	I	85.5	Confident	65.5	Low	48 Å²	48	86.8 Å²	86.8	25%	0.246	47%	0.472	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	142.3	174.4	-68.5	166.4	0	0	0	109.9	I279 V281 L342 I343	I279-I361 HydrophobicContact CB-CD1 3.52Å; I279-I361 HydrophobicContact CG2-CD1 3.55Å; I279-I361 WeakPolarHBondContact O-CD1 3.47Å; V281-I361 HydrophobicContact CB-CG2 4.39Å; V281-I361 HydrophobicContact CG2-CG2 3.8Å; L342-I361 CarbonylContact C-O 3.28Å; L342-I361 WeakPolarHBondContact CA-O 3.43Å; I343-I361 PolarHBondContact N-O 2.89Å; I343-I361 PolarHBondContact O-N 2.82Å
362	N	81.1	Confident	64.3	Low	75 Å²	75	88.8 Å²	88.8	40%	0.401	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	162.3	177.8	-162.5	13.2	0	0	0	111.8	Q312 Y341 L342	Q312-N362 PolarHBondContact OE1-ND2 2.92Å; Q312-N362 PolarHBondContact OE1-OD1 2.95Å; Y341-N362 PolarHBondContact O-OD1 2.98Å; L342-N362 HydrophobicContact CD2-CB 4.14Å
363	T	73.9	Confident	62.8	Low	7 Å²	7	93.4 Å²	93.4	4%	0.043	50%	0.495	C	S	.	.			trans	-132.2	124.9	-171.6	49.3	0	0	0	0	112.6	V281 L289 Y341 I343	V281-T363 HydrophobicContact CB-CG2 4.32Å; V281-T363 HydrophobicContact CG1-CG2 3.55Å; L289-T363 HydrophobicContact CD1-CG2 3.96Å; L289-T363 HydrophobicContact CD2-CG2 3.94Å; Y341-T363 WeakPolarHBondContact CA-OG1 3.33Å; Y341-T363 WeakPolarHBondContact CB-OG1 3.46Å; Y341-T363 PolarHBondContact N-OG1 2.8Å; Y341-T363 PolarHBondContact O-N 3.14Å; Y341-T363 PolarHBondContact O-OG1 3.18Å; I343-T363 HydrophobicContact CD1-CG2 4.31Å
364	N	65.3	Low	61.3	Low	134 Å²	134	98.2 Å²	98.2	72%	0.717	52%	0.521	S	S	*	.			trans	-71.8	145.7	178.3	-60.8	-7.4	0	0	0	111.2	W283	W283-N364 PolarHBondContact NE1-O 2.92Å
365	S	56.9	Low	59.2	Low	50 Å²	50	98.1 Å²	98.1	35%	0.35	53%	0.53	S	S	.	.			trans	-64.1	154.1	174.7	48.4	0	0	0	0	114.6	Q367	S365-Q367 PolarHBondContact O-N 2.92Å
366	Y	48.7	Very low	56.9	Low	88 Å²	88	105 Å²	105	35%	0.345	56%	0.562	S	S	.	*			trans	-76.3	106.5	-173.6	-178.3	-95.6	0	0	0	112.7	W283 Q286 H368	W283-Y366 HydrophobicContact CB-CD2 4.22Å; Q286-Y366 HydrophobicContact CB-CD1 3.66Å; Q286-Y366 HydrophobicContact CB-CD2 4.21Å; Q286-Y366 HydrophobicContact CB-CE1 3.87Å; Q286-Y366 HydrophobicContact CB-CE2 4.41Å; Q286-Y366 HydrophobicContact CB-CG 3.85Å; Y366-H368 HydrophobicContact CE1-CB 4.22Å; Y366-H368 AromaticContact CE1-ND1 3.83Å; Y366-H368 AromaticContact CZ-ND1 3.91Å; Y366-H368 PolarHBondContact OH-ND1 3.22Å
367	Q	49.6	Very low	54.8	Low	173 Å²	173	102.2 Å²	102.2	81%	0.808	57%	0.567	S	S	*	*			trans	-101	123	176.5	-63.4	-171.7	4.2	0	0	111.9	S365	S365-Q367 PolarHBondContact O-N 2.92Å
368	H	37.2	Very low	52.2	Low	139 Å²	139	105.4 Å²	105.4	64%	0.644	59%	0.585	S	S	*	*			trans	-94.3	101.8	-177.9	-158.2	72.3	0	0	0	110.8	Y366 T370	Y366-H368 HydrophobicContact CE1-CB 4.22Å; Y366-H368 AromaticContact CE1-ND1 3.83Å; Y366-H368 AromaticContact CZ-ND1 3.91Å; Y366-H368 PolarHBondContact OH-ND1 3.22Å; H368-T370 PolarHBondContact O-N 2.83Å
369	S	34.7	Very low	49.5	Very low	111 Å²	111	111 Å²	111	78%	0.776	61%	0.612	S	S	*	*			trans	-69.4	101.3	-178.3	46.3	0	0	0	0	111.8	L371	S369-L371 PolarHBondContact O-N 3.06Å; S369-L371 VanDerWaalsContact O-N 3.1Å
370	T	31.2	Very low	47.1	Very low	107 Å²	107	111.2 Å²	111.2	66%	0.656	61%	0.608	S	S	*	*			trans	-80	88.6	177.7	34.4	0	0	0	0	110.7	H368 I372	H368-T370 PolarHBondContact O-N 2.83Å; T370-I372 PolarHBondContact O-N 3.24Å
371	L	31.9	Very low	44.7	Very low	166 Å²	166	113.6 Å²	113.6	87%	0.869	62%	0.622	S	S	*	*			trans	-70	81.2	163.8	-86.9	172.1	0	0	0	110	S369 D373	S369-L371 PolarHBondContact O-N 3.06Å; S369-L371 VanDerWaalsContact O-N 3.1Å; L371-D373 PolarHBondContact O-N 3.48Å
372	I	35.2	Very low	42.2	Very low	111 Å²	111	114.7 Å²	114.7	57%	0.569	64%	0.644	S	S	*	*			trans	-82.1	96.4	164.8	-61.2	169.6	0	0	0	106.7	T370 N374	T370-I372 PolarHBondContact O-N 3.24Å; I372-N374 HydrophobicContact CG2-CB 3.92Å; I372-N374 WeakPolarHBondContact CG2-ND2 3.44Å; I372-N374 WeakPolarHBondContact CG2-OD1 3.34Å; I372-N374 PolarHBondContact O-N 3.19Å
373	D	33	Very low	40.1	Very low	143 Å²	143	118.2 Å²	118.2	77%	0.765	66%	0.663	S	S	*	*			trans	-73.6	73.4	166.6	-103.3	-36.1	0	0	0	109.8	L371 S375	L371-D373 PolarHBondContact O-N 3.48Å; D373-S375 PolarHBondContact O-N 3.25Å
374	N	35.3	Very low	38.4	Very low	150 Å²	150	124 Å²	124	80%	0.802	69%	0.694	S	S	*	*			trans	-76.1	70.5	173.2	-97.1	-6.6	0	0	0	110.2	I372	I372-N374 HydrophobicContact CG2-CB 3.92Å; I372-N374 WeakPolarHBondContact CG2-ND2 3.44Å; I372-N374 WeakPolarHBondContact CG2-OD1 3.34Å; I372-N374 PolarHBondContact O-N 3.19Å
375	S	34.6	Very low	37	Very low	80 Å²	80	123.9 Å²	123.9	56%	0.559	69%	0.693	S	S	*	*			trans	-146.3	107	162	58.9	0	0	0	0	112.3	D373	D373-S375 PolarHBondContact O-N 3.25Å
376	N	31.6	Very low	35.8	Very low	162 Å²	162	129 Å²	129	87%	0.866	72%	0.716	S	S	*	*			trans	-166	64.8	150.6	-107.2	-68	0	0	0	108.9
377	G	40.5	Very low	35.4	Very low	69 Å²	69	132.5 Å²	132.5	71%	0.711	74%	0.741	S	S	*	*	S	Bend	trans	-158.9	84.4	174.6	0	0	0	0	0	104.8
378	D	30	Very low	34.6	Very low	143 Å²	143	129.4 Å²	129.4	77%	0.765	73%	0.73	S	S	*	*	S	Bend	trans	64	126.6	-153.4	-63.1	-23.9	0	0	0	113.5
379	I	31.7	Very low	34.6	Very low	136 Å²	136	130.6 Å²	130.6	70%	0.697	73%	0.733	S	S	*	*	S	Bend	cis	-145.2	139.1	-1.6	-94.5	150.9	0	0	0	110.4
380	H	35.3	Very low	34.5	Very low	148 Å²	148	133.7 Å²	133.7	69%	0.685	73%	0.728	S	S	*	*			trans	63.4	118.2	162	-78.9	-50.1	0	0	0	124.2
381	N	35.4	Very low	34.4	Very low	146 Å²	146	136.1 Å²	136.1	78%	0.781	74%	0.737	S	S	*	*			trans	64.9	126.5	135.9	-52	-8.2	0	0	0	120
382	G	32.6	Very low	34.4	Very low	70 Å²	70	133.7 Å²	133.7	72%	0.722	72%	0.721	S	S	*	*			cis	164.3	166.7	-7.1	0	0	0	0	0	114.6
383	N	37.8	Very low	34	Very low	150 Å²	150	133.3 Å²	133.3	80%	0.802	72%	0.72	S	S	*	*			trans	73.8	107.9	166.4	-65.8	-14.9	0	0	0	121.1
384	N	37.7	Very low	33.9	Very low	127 Å²	127	127.7 Å²	127.7	68%	0.679	69%	0.689	S	S	*	*			trans	79.5	97.8	134.2	-56.1	-22.6	0	0	0	119.1
385	N	36.8	Very low	33.9	Very low	132 Å²	132	123 Å²	123	71%	0.706	66%	0.663	S	S	*	*				83.3	86.6	84.2	-70	-20.4	0	0	0	113.3
386	L	30.9	Very low	34	Very low	157 Å²	157	124 Å²	124	82%	0.822	66%	0.658	S	S	*	*				54.6	85.9	87.2	-79.4	149.8	0	0	0	115
387	N	40.5	Very low	34.6	Very low	162 Å²	162	117 Å²	117	87%	0.866	62%	0.619	S	S	*	*			trans	-165.2	80	154.1	-94.6	-49	0	0	0	107.4
388	D	33.3	Very low	34.9	Very low	109 Å²	109	113.9 Å²	113.9	58%	0.583	59%	0.587	S	S	*	*				87.1	147.7	61.9	-166.9	19.7	0	0	0	113.8
389	K	35.9	Very low	36.1	Very low	163 Å²	163	107.7 Å²	107.7	71%	0.709	55%	0.553	S	S	*	*			trans	55.8	69.6	171.2	-71.3	138	-172.5	149.5	0	118.8
390	R	34.2	Very low	37	Very low	176 Å²	176	103.8 Å²	103.8	66%	0.664	53%	0.53	S	S	*	.				-171.5	33.7	108.2	-104.2	177.5	-108.7	-155.2	-6.3	116.3	H392	R390-H392 PolarHBondContact O-N 2.77Å
391	N	27.7	Very low	37.6	Very low	158 Å²	158	96.9 Å²	96.9	85%	0.845	50%	0.498	S	S	*	.			trans	-68.6	96.8	160.7	-97.6	-4.6	0	0	0	110.1
392	H	31.7	Very low	38.6	Very low	115 Å²	115	92.4 Å²	92.4	53%	0.532	47%	0.472	S	S	.	.			trans	-121.4	114.7	154.8	-86.1	-11.2	0	0	0	107.8	R390 F394 R847	R390-H392 PolarHBondContact O-N 2.77Å; H392-F394 HydrophobicContact CB-CE2 4.26Å; H392-F394 VanDerWaalsContact O-CD2 3.27Å; H392-F394 WeakPolarHBondContact O-CD2 3.5Å; H392-R847 HydrophobicContact CB-CB 4.34Å
393	N	27.5	Very low	39.7	Very low	104 Å²	104	90.6 Å²	90.6	56%	0.556	45%	0.448	S	S	*	.			trans	-76.9	116.2	173.6	34.8	-39.4	0	0	0	108.6	I395 R847	N393-I395 HydrophobicContact CB-CG1 4.48Å; N393-R847 WeakPolarHBondContact O-CD 3.4Å; N393-R847 PolarHBondContact O-NH1 2.91Å
394	F	31.6	Very low	40.9	Very low	25 Å²	25	89.7 Å²	89.7	11%	0.11	44%	0.439	C	S	.	.			trans	-79.4	129.9	164.9	-73.6	-123.1	0	0	0	105.6	H392 C843 I844 L845 R846 R847 R848 K849 Q850	H392-F394 HydrophobicContact CB-CE2 4.26Å; H392-F394 VanDerWaalsContact O-CD2 3.27Å; H392-F394 WeakPolarHBondContact O-CD2 3.5Å; F394-C843 WeakPolarHBondContact CA-O 3.31Å; F394-I844 HydrophobicContact CB-CB 4.48Å; F394-I844 HydrophobicContact CB-CG1 3.81Å; F394-I844 VanDerWaalsContact CD1-O 3.22Å; F394-I844 WeakPolarHBondContact CD1-O 3.27Å; F394-I844 WeakPolarHBondContact O-CD1 3.19Å; F394-I844 WeakPolarHBondContact O-CG1 3.35Å; F394-L845 WeakPolarHBondContact CE1-O 3.32Å; F394-R846 WeakPolarHBondContact CE1-O 3.44Å; F394-R846 VanDerWaalsContact CZ-C 3.48Å; F394-R846 WeakPolarHBondContact CZ-O 3.43Å; F394-R847 HydrophobicContact CB-CB 3.81Å; F394-R847 HydrophobicContact CD1-CB 3.62Å; F394-R847 HydrophobicContact CD2-CB 2.59Å; F394-R847 HydrophobicContact CD2-CG 4.14Å; F394-R847 WeakPolarHBondContact CD2-O 3.33Å; F394-R847 HydrophobicContact CE1-CB 3.94Å; F394-R847 WeakPolarHBondContact CE1-O 3.2Å; F394-R847 HydrophobicContact CE2-CB 2.96Å; F394-R847 HydrophobicContact CE2-CG 4.32Å; F394-R847 WeakPolarHBondContact CE2-O 3.34Å; F394-R847 HydrophobicContact CG-CB 2.95Å; F394-R847 HydrophobicContact CG-CG 4.32Å; F394-R847 WeakPolarHBondContact CG-O 3.39Å; F394-R847 HydrophobicContact CZ-CB 3.65Å; F394-R847 VanDerWaalsContact CZ-N 3.3Å; F394-R847 WeakPolarHBondContact CZ-O 3.49Å; F394-R848 HydrophobicContact CB-CG 4.36Å; F394-R848 HydrophobicContact CD1-CB 4.27Å; F394-R848 VanDerWaalsContact CD2-N 3.28Å; F394-K849 HydrophobicContact CE1-CB 3.91Å; F394-Q850 HydrophobicContact CE2-CB 4.11Å; F394-Q850 HydrophobicContact CZ-CB 3.58Å; F394-Q850 HydrophobicContact CZ-CG 3.75Å
395	I	35.5	Very low	42.3	Very low	52 Å²	52	87 Å²	87	27%	0.267	42%	0.421	S	S	.	.			trans	-121.1	125.6	-160.8	-67.6	153	0	0	0	112.3	N393 I840 C843 I844 R847	N393-I395 HydrophobicContact CB-CG1 4.48Å; I395-I840 HydrophobicContact CG2-CG2 4.22Å; I395-I840 VanDerWaalsContact O-O 3.06Å; I395-C843 HydrophobicContact CB-CB 3.71Å; I395-C843 HydrophobicContact CD1-CB 3.99Å; I395-C843 HydrophobicContact CG1-CB 4.35Å; I395-C843 HydrophobicContact CG2-CB 4.44Å; I395-C843 PolarHBondContact N-O 3.3Å; I395-C843 CarbonylContact O-C 3.55Å; I395-I844 VanDerWaalsContact C-CB 3.42Å; I395-I844 VanDerWaalsContact N-CA 3.3Å; I395-I844 VanDerWaalsContact O-CA 3.31Å; I395-I844 WeakPolarHBondContact O-CA 3.45Å; I395-I844 WeakPolarHBondContact O-CB 3.5Å; I395-I844 PolarHBondContact O-N 2.67Å; I395-R847 VanDerWaalsContact CD1-NH1 3.28Å
396	F	36.3	Very low	43.8	Very low	101 Å²	101	80.8 Å²	80.8	44%	0.443	39%	0.388	S	S	.	.			trans	-43.4	131	-151.4	-92.9	-103	0	0	0	118.8	I530 I840 I844	F396-I530 HydrophobicContact CE1-CD1 4.26Å; F396-I530 HydrophobicContact CE1-CG1 4.16Å; F396-I530 HydrophobicContact CZ-CG1 4.21Å; F396-I840 WeakPolarHBondContact O-CG2 3.42Å; F396-I844 VanDerWaalsContact CA-CD1 3.46Å; F396-I844 HydrophobicContact CB-CD1 4.23Å; F396-I844 HydrophobicContact CD1-CD1 4.37Å; F396-I844 HydrophobicContact CD2-CD1 3.61Å; F396-I844 HydrophobicContact CE2-CD1 4.02Å; F396-I844 HydrophobicContact CG-CD1 3.81Å
397	M	42.9	Very low	45.8	Very low	13 Å²	13	74.4 Å²	74.4	6%	0.064	36%	0.355	C	S	.	.			trans	-87	111.1	169.9	-89.3	-147.1	-169.4	0	0	112.9	F406 H430 K538 L841 I844 L845	M397-F406 HydrophobicContact CE-CZ 4.49Å; M397-F406 HydrophobicContact SD-CE1 3.9Å; M397-F406 HydrophobicContact SD-CZ 3.79Å; M397-H430 WeakPolarHBondContact CE-NE2 3.46Å; M397-K538 PolarHBondContact O-NZ 2.88Å; M397-L841 HydrophobicContact CB-CD1 3.44Å; M397-L841 VanDerWaalsContact CB-CD1 3.44Å; M397-L841 HydrophobicContact CB-CG 4.28Å; M397-L841 HydrophobicContact CE-CD1 4.45Å; M397-L841 HydrophobicContact CE-CG 4.09Å; M397-L841 WeakPolarHBondContact CE-O 3.28Å; M397-L841 HydrophobicContact CG-CB 3.94Å; M397-L841 HydrophobicContact CG-CD1 3.25Å; M397-L841 HydrophobicContact CG-CG 3.6Å; M397-L841 WeakPolarHBondContact CG-O 3.22Å; M397-L841 HydrophobicContact SD-CB 4.46Å; M397-L841 HydrophobicContact SD-CD1 3.26Å; M397-L841 WeakPolarHBondContact SD-CD1 3.46Å; M397-L841 HydrophobicContact SD-CG 3.54Å; M397-L841 VanDerWaalsContact SD-CG 3.54Å; M397-I844 HydrophobicContact CB-CG2 3.54Å; M397-I844 HydrophobicContact CG-CB 4.44Å; M397-I844 HydrophobicContact CG-CG2 3.75Å; M397-I844 VanDerWaalsContact N-CG2 3.28Å; M397-L845 HydrophobicContact CB-CD1 4.46Å; M397-L845 HydrophobicContact CB-CG 4.37Å; M397-L845 HydrophobicContact CE-CB 3.71Å; M397-L845 HydrophobicContact CE-CD1 3.76Å; M397-L845 HydrophobicContact CE-CG 3.61Å; M397-L845 HydrophobicContact CG-CD1 4.03Å; M397-L845 HydrophobicContact CG-CD2 4.49Å; M397-L845 HydrophobicContact CG-CG 3.81Å; M397-L845 HydrophobicContact SD-CB 4.14Å; M397-L845 HydrophobicContact SD-CD1 3.04Å; M397-L845 WeakPolarHBondContact SD-CD1 3.48Å; M397-L845 HydrophobicContact SD-CD2 4.45Å; M397-L845 HydrophobicContact SD-CG 3.33Å; M397-L845 WeakPolarHBondContact SD-CG 3.05Å
398	D	48.6	Very low	47.4	Very low	5 Å²	5	67 Å²	67	3%	0.027	32%	0.316	C	S	.	.			trans	-113.3	121.9	159.7	-158.1	21.5	0	0	0	112.2	I288 R400 K538 L837 L841	I288-D398 HydrophobicContact CD1-CB 3.63Å; I288-D398 WeakPolarHBondContact CD1-OD2 3.49Å; I288-D398 HydrophobicContact CG1-CB 4.34Å; D398-R400 PolarHBondContact O-N 3.06Å; D398-R400 VanDerWaalsContact O-N 3.11Å; D398-R400 IonicContact OD1-NE 2.7Å; D398-R400 PolarHBondContact OD1-NE 3.21Å; D398-R400 IonicContact OD1-NH2 2.75Å; D398-R400 IonicContact OD2-CZ 2.72Å; D398-R400 IonicContact OD2-NE 3.26Å; D398-R400 PolarHBondContact OD2-NE 2.89Å; D398-R400 IonicContact OD2-NH2 3.35Å; D398-R400 PolarHBondContact OD2-NH2 3.15Å; D398-K538 IonicContact OD1-NZ 2.76Å; D398-K538 PolarHBondContact OD1-NZ 2.82Å; D398-L837 HydrophobicContact CB-CD1 4.03Å; D398-L837 HydrophobicContact CB-CD2 3.94Å; D398-L837 HydrophobicContact CB-CG 4.18Å; D398-L841 VanDerWaalsContact C-CD1 3.41Å; D398-L841 WeakPolarHBondContact O-CD1 3.44Å
399	I	54	Low	49.2	Very low	12 Å²	12	64.6 Å²	64.6	6%	0.062	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-9.5	-157	-79.9	176.2	0	0	0	113.8	D401 F406 Y526 K538 E539 L841	I399-D401 PolarHBondContact O-N 3.38Å; I399-F406 HydrophobicContact CD1-CD1 4.28Å; I399-F406 HydrophobicContact CG1-CD1 3.85Å; I399-F406 HydrophobicContact CG1-CE1 4.22Å; I399-F406 HydrophobicContact CG1-CG 4.37Å; I399-F406 HydrophobicContact CG2-CB 3.81Å; I399-F406 HydrophobicContact CG2-CD1 4.33Å; I399-F406 HydrophobicContact CG2-CG 4.07Å; I399-Y526 HydrophobicContact CD1-CD2 3.95Å; I399-K538 HydrophobicContact CD1-CB 4.4Å; I399-K538 HydrophobicContact CD1-CD 3.9Å; I399-K538 HydrophobicContact CD1-CG 3.82Å; I399-K538 HydrophobicContact CG1-CD 4.33Å; I399-E539 WeakPolarHBondContact CD1-O 3.23Å; I399-L841 HydrophobicContact CG1-CD1 4.34Å
400	R	51.8	Low	51.1	Low	55 Å²	55	61.5 Å²	61.5	21%	0.208	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	-25.3	-152.5	-53	-176	-152.9	-142.8	9.1	113.5	D331 G333 N334 D398 F834	D331-R400 PolarHBondContact O-NH1 3.25Å; D331-R400 PolarHBondContact O-NH2 3.27Å; G333-R400 VanDerWaalsContact CA-CZ 3.46Å; G333-R400 VanDerWaalsContact N-NH1 3.16Å; G333-R400 WeakPolarHBondContact O-CD 3.33Å; N334-R400 HydrophobicContact CB-CB 4.21Å; N334-R400 VanDerWaalsContact ND2-CB 3.35Å; N334-R400 WeakPolarHBondContact ND2-CB 3.5Å; N334-R400 PolarHBondContact ND2-O 3.12Å; N334-R400 WeakPolarHBondContact OD1-CB 3.46Å; D398-R400 PolarHBondContact O-N 3.06Å; D398-R400 VanDerWaalsContact O-N 3.11Å; D398-R400 IonicContact OD1-NE 2.7Å; D398-R400 PolarHBondContact OD1-NE 3.21Å; D398-R400 IonicContact OD1-NH2 2.75Å; D398-R400 IonicContact OD2-CZ 2.72Å; D398-R400 IonicContact OD2-NE 3.26Å; D398-R400 PolarHBondContact OD2-NE 2.89Å; D398-R400 IonicContact OD2-NH2 3.35Å; D398-R400 PolarHBondContact OD2-NH2 3.15Å; R400-F834 VanDerWaalsContact O-CD1 3.28Å; R400-F834 WeakPolarHBondContact O-CD1 3.38Å; R400-F834 WeakPolarHBondContact O-CE1 3.45Å
401	D	46.7	Very low	53.3	Low	3 Å²	3	54.2 Å²	54.2	2%	0.016	27%	0.266	C	S	.	.	S	Bend	trans	-72.8	-54	-169.6	-71.7	-101.9	0	0	0	117.1	N334 I399 P403 F834 I836 L837 S838	N334-D401 PolarHBondContact OD1-N 3.36Å; N334-D401 PolarHBondContact OD1-OD2 3.21Å; I399-D401 PolarHBondContact O-N 3.38Å; D401-P403 WeakPolarHBondContact O-CD 3.47Å; D401-F834 CarbonylContact C-O 3.54Å; D401-F834 VanDerWaalsContact CA-O 3.29Å; D401-F834 WeakPolarHBondContact CA-O 3.17Å; D401-F834 WeakPolarHBondContact CB-O 3.12Å; D401-F834 WeakPolarHBondContact O-CB 3.29Å; D401-F834 VanDerWaalsContact O-CD1 3.23Å; D401-F834 WeakPolarHBondContact O-CD1 3.34Å; D401-I836 PolarHBondContact OD1-N 2.89Å; D401-L837 VanDerWaalsContact CG-CA 3.47Å; D401-L837 WeakPolarHBondContact OD1-CA 3.3Å; D401-L837 WeakPolarHBondContact OD1-CB 3.17Å; D401-L837 PolarHBondContact OD1-N 3.46Å; D401-L837 WeakPolarHBondContact OD2-CA 3.45Å; D401-L837 WeakPolarHBondContact OD2-CB 3.37Å; D401-L837 VanDerWaalsContact OD2-CD2 3.26Å; D401-L837 WeakPolarHBondContact OD2-CD2 3.45Å; D401-L837 WeakPolarHBondContact OD2-CG 3.41Å; D401-S838 VanDerWaalsContact CB-N 3.27Å; D401-S838 PolarHBondContact OD1-N 3.06Å; D401-S838 VanDerWaalsContact OD1-N 3.13Å; D401-S838 PolarHBondContact OD2-N 3.48Å
402	Q	56.8	Low	55.7	Low	51 Å²	51	50.6 Å²	50.6	24%	0.238	24%	0.243	C	C	.	.			trans	-114.6	70.7	-177.6	-71.6	178.6	19.8	0	0	105.7	E404 K405 F406 A835 S838	Q402-E404 PolarHBondContact O-N 2.91Å; Q402-K405 HydrophobicContact CB-CB 4.34Å; Q402-K405 HydrophobicContact CB-CD 3.87Å; Q402-K405 HydrophobicContact CB-CG 3.91Å; Q402-K405 WeakPolarHBondContact O-CA 3.26Å; Q402-K405 VanDerWaalsContact O-CB 3.3Å; Q402-K405 WeakPolarHBondContact O-CB 3.24Å; Q402-K405 PolarHBondContact O-N 2.68Å; Q402-F406 WeakPolarHBondContact O-CD2 3.25Å; Q402-A835 PolarHBondContact NE2-O 3.28Å; Q402-A835 VanDerWaalsContact NE2-O 3.13Å; Q402-S838 WeakPolarHBondContact CB-OG 3.38Å; Q402-S838 VanDerWaalsContact CD-CB 3.41Å; Q402-S838 WeakPolarHBondContact CG-OG 3.3Å; Q402-S838 PolarHBondContact OE1-OG 2.9Å
403	P	55.7	Low	57.6	Low	32 Å²	32	46.5 Å²	46.5	21%	0.208	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-58.2	-34	-173.9	26.1	-36.9	0	0	0	110.9	D401 K405 F406 T407 I541 F834	D401-P403 WeakPolarHBondContact O-CD 3.47Å; P403-K405 PolarHBondContact O-N 2.99Å; P403-K405 VanDerWaalsContact O-N 3.14Å; P403-F406 CarbonylContact O-C 3.53Å; P403-F406 VanDerWaalsContact O-C 3.31Å; P403-F406 WeakPolarHBondContact O-CA 3.44Å; P403-F406 PolarHBondContact O-N 3.23Å; P403-T407 WeakPolarHBondContact O-CB 3.24Å; P403-T407 WeakPolarHBondContact O-CG2 3.18Å; P403-T407 PolarHBondContact O-N 3.05Å; P403-I541 HydrophobicContact CB-CD1 3.14Å; P403-F834 HydrophobicContact CG-CD1 4.35Å; P403-F834 HydrophobicContact CG-CE1 4.29Å
404	E	62.8	Low	59.8	Low	131 Å²	131	45.4 Å²	45.4	61%	0.612	22%	0.22	S	C	*	.	G	3₁₀ helix	trans	-53.4	-27.1	170.3	-62.3	178.3	-115.5	0	0	114.3	Q402	Q402-E404 PolarHBondContact O-N 2.91Å
405	K	66.1	Low	61.4	Low	72 Å²	72	45.9 Å²	45.9	31%	0.313	22%	0.222	S	C	.	.	G	3₁₀ helix	trans	-86.7	-21.2	174.6	-59.3	-173.9	165.9	166.7	0	113	Q402 P403 P428 I429 H430	Q402-K405 HydrophobicContact CB-CB 4.34Å; Q402-K405 HydrophobicContact CB-CD 3.87Å; Q402-K405 HydrophobicContact CB-CG 3.91Å; Q402-K405 WeakPolarHBondContact O-CA 3.26Å; Q402-K405 VanDerWaalsContact O-CB 3.3Å; Q402-K405 WeakPolarHBondContact O-CB 3.24Å; Q402-K405 PolarHBondContact O-N 2.68Å; P403-K405 PolarHBondContact O-N 2.99Å; P403-K405 VanDerWaalsContact O-N 3.14Å; K405-P428 WeakPolarHBondContact O-CB 3.27Å; K405-I429 HydrophobicContact CB-CB 4.02Å; K405-I429 HydrophobicContact CG-CB 3.89Å; K405-I429 HydrophobicContact CG-CD1 3.92Å; K405-I429 HydrophobicContact CG-CG1 4.41Å; K405-I429 HydrophobicContact CG-CG2 4.29Å; K405-I429 PolarHBondContact O-N 3.45Å; K405-H430 HydrophobicContact CB-CB 3.97Å; K405-H430 WeakPolarHBondContact O-CA 3.34Å; K405-H430 VanDerWaalsContact O-CB 3.31Å; K405-H430 WeakPolarHBondContact O-CB 3.45Å; K405-H430 PolarHBondContact O-N 2.94Å
406	F	69.5	Low	62.9	Low	1 Å²	1	48.8 Å²	48.8	0%	0.004	23%	0.23	C	C	.	.	S	Bend	trans	-112.7	22.5	-178.3	-65.2	-100.1	0	0	0	112.5	M397 I399 Q402 P403 H430 P524 Y526 I541 L841	M397-F406 HydrophobicContact CE-CZ 4.49Å; M397-F406 HydrophobicContact SD-CE1 3.9Å; M397-F406 HydrophobicContact SD-CZ 3.79Å; I399-F406 HydrophobicContact CD1-CD1 4.28Å; I399-F406 HydrophobicContact CG1-CD1 3.85Å; I399-F406 HydrophobicContact CG1-CE1 4.22Å; I399-F406 HydrophobicContact CG1-CG 4.37Å; I399-F406 HydrophobicContact CG2-CB 3.81Å; I399-F406 HydrophobicContact CG2-CD1 4.33Å; I399-F406 HydrophobicContact CG2-CG 4.07Å; Q402-F406 WeakPolarHBondContact O-CD2 3.25Å; P403-F406 CarbonylContact O-C 3.53Å; P403-F406 VanDerWaalsContact O-C 3.31Å; P403-F406 WeakPolarHBondContact O-CA 3.44Å; P403-F406 PolarHBondContact O-N 3.23Å; F406-H430 HydrophobicContact CD1-CB 4.44Å; F406-H430 HydrophobicContact CD2-CB 4.23Å; F406-H430 HydrophobicContact CE1-CB 3.96Å; F406-H430 AromaticContact CE1-CD2 3.55Å; F406-H430 AromaticContact CE1-CG 3.83Å; F406-H430 HydrophobicContact CE2-CB 3.67Å; F406-H430 AromaticContact CE2-CG 3.93Å; F406-H430 HydrophobicContact CZ-CB 3.53Å; F406-H430 AromaticContact CZ-CD2 3.46Å; F406-H430 VanDerWaalsContact CZ-CD2 3.46Å; F406-H430 WeakPolarHBondContact CZ-CD2 3.42Å; F406-H430 AromaticContact CZ-CG 3.34Å; F406-P524 WeakPolarHBondContact O-CG 3.37Å; F406-Y526 WeakPolarHBondContact CA-OH 3.46Å; F406-Y526 HydrophobicContact CB-CE2 4.32Å; F406-Y526 HydrophobicContact CD1-CD1 4.21Å; F406-Y526 HydrophobicContact CD1-CD2 4.21Å; F406-Y526 AromaticContact CD1-CE1 3.7Å; F406-Y526 HydrophobicContact CD1-CE1 3.7Å; F406-Y526 AromaticContact CD1-CE2 3.73Å; F406-Y526 HydrophobicContact CD1-CE2 3.73Å; F406-Y526 HydrophobicContact CD1-CG 4.46Å; F406-Y526 AromaticContact CD1-CZ 3.45Å; F406-Y526 VanDerWaalsContact CD1-CZ 3.45Å; F406-Y526 HydrophobicContact CE1-CD1 4.22Å; F406-Y526 AromaticContact CE1-CE1 3.93Å; F406-Y526 HydrophobicContact CE1-CE1 3.93Å; F406-I541 PolarHBondContact O-N 3.48Å; F406-L841 HydrophobicContact CD2-CD2 4.33Å; F406-L841 HydrophobicContact CE1-CD1 4.05Å; F406-L841 HydrophobicContact CE2-CD1 4.16Å; F406-L841 HydrophobicContact CE2-CD2 3.42Å; F406-L841 VanDerWaalsContact CE2-CD2 3.42Å; F406-L841 HydrophobicContact CE2-CG 4.16Å; F406-L841 HydrophobicContact CZ-CD1 3.64Å; F406-L841 HydrophobicContact CZ-CD2 3.63Å; F406-L841 HydrophobicContact CZ-CG 3.83Å
407	T	73.5	Confident	64.4	Low	22 Å²	22	44.1 Å²	44.1	14%	0.135	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-131.8	158	175.6	-159.4	0	0	0	0	109.6	P403 P428 I541 V543	P403-T407 WeakPolarHBondContact O-CB 3.24Å; P403-T407 WeakPolarHBondContact O-CG2 3.18Å; P403-T407 PolarHBondContact O-N 3.05Å; T407-P428 WeakPolarHBondContact O-CA 3.38Å; T407-P428 WeakPolarHBondContact O-CB 2.85Å; T407-I541 PolarHBondContact OG1-O 3.34Å; T407-V543 WeakPolarHBondContact OG1-CG2 3.36Å
408	V	73.5	Confident	65.7	Low	6 Å²	6	43.5 Å²	43.5	4%	0.036	21%	0.207	C	C	.	.			trans	-77	150.1	176.1	-56.2	0	0	0	0	111	F411 W425 L426 P428 Y437 I522 V543	V408-F411 HydrophobicContact CG2-CB 4.15Å; V408-F411 HydrophobicContact CG2-CG 4.45Å; V408-W425 HydrophobicContact CB-CB 4.1Å; V408-W425 HydrophobicContact CB-CG 4.11Å; V408-W425 VanDerWaalsContact CG1-CD1 3.49Å; V408-W425 HydrophobicContact CG1-CG 4.32Å; V408-W425 HydrophobicContact CG2-CB 4Å; V408-W425 HydrophobicContact CG2-CG 4.28Å; V408-L426 WeakPolarHBondContact CB-O 3.31Å; V408-P428 HydrophobicContact CG1-CG 4.4Å; V408-Y437 HydrophobicContact CG1-CD1 4.04Å; V408-Y437 HydrophobicContact CG1-CE1 3.75Å; V408-I522 HydrophobicContact CB-CG2 4.48Å; V408-I522 HydrophobicContact CG1-CD1 4.3Å; V408-I522 HydrophobicContact CG1-CG1 4.43Å; V408-I522 HydrophobicContact CG1-CG2 4.38Å; V408-I522 HydrophobicContact CG2-CG2 3.35Å; V408-V543 HydrophobicContact CG2-CB 4.03Å; V408-V543 HydrophobicContact CG2-CG2 3.66Å
409	Q	71.8	Confident	67	Low	60 Å²	60	43.3 Å²	43.3	28%	0.28	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	161.7	177.3	-65	-172.9	-14.8	0	0	111.5	F411 W425 L426	Q409-F411 PolarHBondContact O-N 2.97Å; Q409-W425 CarbonylContact O-C 3.56Å; Q409-W425 VanDerWaalsContact O-C 3.32Å; Q409-W425 WeakPolarHBondContact O-CA 3.3Å; Q409-W425 VanDerWaalsContact O-CB 3.32Å; Q409-W425 WeakPolarHBondContact O-CB 3.47Å; Q409-L426 HydrophobicContact CB-CB 3.66Å; Q409-L426 PolarHBondContact N-O 3Å; Q409-L426 PolarHBondContact O-N 3.14Å
410	N	74.6	Confident	67.9	Low	98 Å²	98	42.7 Å²	42.7	52%	0.524	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	59.3	19.9	164.7	-133.5	2.2	0	0	0	116.5	K412 E424 L426	N410-K412 PolarHBondContact O-N 2.85Å; N410-E424 VanDerWaalsContact O-O 3.06Å; N410-L426 HydrophobicContact CB-CB 4.3Å; N410-L426 HydrophobicContact CB-CD1 4.03Å; N410-L426 HydrophobicContact CB-CG 4.31Å
411	F	81.3	Confident	69	Low	22 Å²	22	40.1 Å²	40.1	10%	0.096	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.6	118.5	-173.3	-166.1	-141.3	0	0	0	112.3	V408 Q409 I423 E424 W425 L439 I520 I522 V543 I545	V408-F411 HydrophobicContact CG2-CB 4.15Å; V408-F411 HydrophobicContact CG2-CG 4.45Å; Q409-F411 PolarHBondContact O-N 2.97Å; F411-I423 HydrophobicContact CD2-CB 4.43Å; F411-I423 HydrophobicContact CE2-CB 3.7Å; F411-I423 HydrophobicContact CE2-CD1 3.56Å; F411-I423 HydrophobicContact CE2-CG1 4.11Å; F411-I423 HydrophobicContact CE2-CG2 4.09Å; F411-I423 HydrophobicContact CZ-CB 4.38Å; F411-I423 HydrophobicContact CZ-CD1 3.88Å; F411-I423 HydrophobicContact CZ-CG2 4.3Å; F411-E424 CarbonylContact C-O 3.48Å; F411-E424 WeakPolarHBondContact CA-O 3.39Å; F411-W425 HydrophobicContact CB-CB 4.26Å; F411-W425 HydrophobicContact CD2-CB 3.86Å; F411-W425 HydrophobicContact CD2-CE3 4.36Å; F411-W425 HydrophobicContact CE2-CE3 4.16Å; F411-W425 HydrophobicContact CG-CB 4.47Å; F411-L439 HydrophobicContact CZ-CD1 4.36Å; F411-I520 HydrophobicContact CE1-CG2 4.44Å; F411-I520 HydrophobicContact CZ-CG2 3.87Å; F411-I522 HydrophobicContact CD1-CG2 3.61Å; F411-I522 HydrophobicContact CD2-CG2 4.04Å; F411-I522 HydrophobicContact CE1-CB 4.08Å; F411-I522 HydrophobicContact CE1-CG2 3.44Å; F411-I522 VanDerWaalsContact CE1-CG2 3.44Å; F411-I522 HydrophobicContact CE2-CB 4.33Å; F411-I522 HydrophobicContact CE2-CG2 3.83Å; F411-I522 HydrophobicContact CG-CG2 3.91Å; F411-I522 HydrophobicContact CZ-CB 3.86Å; F411-I522 HydrophobicContact CZ-CG2 3.54Å; F411-V543 HydrophobicContact CB-CB 4.4Å; F411-V543 HydrophobicContact CB-CG1 3.88Å; F411-V543 HydrophobicContact CD1-CB 3.99Å; F411-V543 HydrophobicContact CD1-CG1 3.91Å; F411-V543 WeakPolarHBondContact CD1-O 3.41Å; F411-V543 VanDerWaalsContact CE1-O 3.26Å; F411-V543 WeakPolarHBondContact CE1-O 3.16Å; F411-V543 HydrophobicContact CG-CG1 4.39Å; F411-I545 HydrophobicContact CB-CG2 4.47Å; F411-I545 HydrophobicContact CD1-CB 4.46Å; F411-I545 HydrophobicContact CD1-CG1 4.23Å; F411-I545 HydrophobicContact CD1-CG2 3.67Å; F411-I545 HydrophobicContact CE1-CD1 4.32Å; F411-I545 HydrophobicContact CE1-CG1 3.88Å; F411-I545 HydrophobicContact CE1-CG2 4.18Å; F411-I545 HydrophobicContact CE2-CD1 4.45Å; F411-I545 HydrophobicContact CG-CG2 4.12Å; F411-I545 HydrophobicContact CZ-CD1 4.31Å; F411-I545 HydrophobicContact CZ-CG1 4.24Å; F411-I545 WeakPolarHBondContact O-CG2 3.44Å
412	K	77.6	Confident	70.3	Confident	83 Å²	83	40.6 Å²	40.6	36%	0.361	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156	162.9	-171.4	69.4	-169.6	173.9	177.2	0	113.4	N410 I423 E424 I545	N410-K412 PolarHBondContact O-N 2.85Å; K412-I423 CarbonylContact O-C 3.55Å; K412-I423 VanDerWaalsContact O-CA 3.29Å; K412-I423 WeakPolarHBondContact O-CA 3.19Å; K412-E424 WeakPolarHBondContact CE-OE2 3.46Å; K412-E424 HydrophobicContact CG-CB 4.27Å; K412-E424 PolarHBondContact N-O 3.47Å; K412-E424 IonicContact NZ-OE2 2.72Å; K412-E424 PolarHBondContact NZ-OE2 2.96Å; K412-E424 PolarHBondContact O-N 2.92Å; K412-I545 VanDerWaalsContact C-CD1 3.46Å
413	C	72.3	Confident	71.3	Confident	29 Å²	29	38.2 Å²	38.2	20%	0.196	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	104.2	179.8	-158.2	0	0	0	0	109.8	I421 T422 I545 C547	C413-I421 WeakPolarHBondContact SG-CG2 3.13Å; C413-T422 CarbonylContact C-O 3.44Å; C413-I545 HydrophobicContact CB-CD1 4.07Å; C413-C547 HydrophobicContact CB-CB 4.46Å; C413-C547 WeakPolarHBondContact CB-SG 3.19Å; C413-C547 WeakPolarHBondContact SG-CB 2.88Å; C413-C547 CovalentContact SG-SG 2.04Å; C413-C547 PolarHBondContact SG-SG 2.79Å
414	I	72.6	Confident	72.3	Confident	80 Å²	80	37.5 Å²	37.5	41%	0.41	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	-61	180	-52.6	163.6	0	0	0	111.8	T422 E424 K506	I414-T422 HydrophobicContact CD1-CG2 4Å; I414-T422 PolarHBondContact N-O 3.14Å; I414-E424 HydrophobicContact CD1-CB 3.5Å; I414-E424 VanDerWaalsContact CD1-CB 3.5Å; I414-E424 HydrophobicContact CD1-CG 4.33Å; I414-E424 HydrophobicContact CG1-CB 3.87Å; I414-K506 HydrophobicContact CD1-CD 4.08Å; I414-K506 HydrophobicContact CD1-CG 4.42Å
415	H	64.5	Low	72.8	Confident	36 Å²	36	31.2 Å²	31.2	17%	0.167	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	117.3	-162.3	-158.5	-78.4	0	0	0	109.4	T417 I421 T422 R1085 Y1086	H415-T417 PolarHBondContact ND1-OG1 2.92Å; H415-I421 CarbonylContact O-C 3.51Å; H415-I421 WeakPolarHBondContact O-CA 3.49Å; H415-I421 WeakPolarHBondContact O-CB 3.46Å; H415-I421 WeakPolarHBondContact O-CG1 3.31Å; H415-I421 WeakPolarHBondContact O-CG2 3.19Å; H415-T422 WeakPolarHBondContact CB-OG1 3.08Å; H415-T422 PolarHBondContact O-N 2.82Å; H415-T422 VanDerWaalsContact O-N 3.08Å; H415-R1085 PolarHBondContact CE1-O 3.22Å; H415-R1085 PolarHBondContact NE2-O 2.95Å; H415-Y1086 AromaticContact CD2-CD1 3.92Å; H415-Y1086 AromaticContact CE1-CD1 3.72Å; H415-Y1086 AromaticContact CE1-CE1 3.75Å; H415-Y1086 AromaticContact ND1-CE1 3.84Å; H415-Y1086 AromaticContact NE2-CD1 3.56Å
416	R	68.1	Low	73.3	Confident	112 Å²	112	28.9 Å²	28.9	42%	0.423	14%	0.14	S	C	.	.			trans	-118.2	133.4	-172.3	-76.5	-169.6	-166.1	169.8	6.7	114.2	I421 E550	R416-I421 HydrophobicContact CG-CG2 4.19Å; R416-E550 WeakPolarHBondContact O-CG 3.48Å
417	T	67.8	Low	73.5	Confident	3 Å²	3	29.5 Å²	29.5	2%	0.018	14%	0.144	C	C	.	.			trans	-179.8	160.2	-148.9	43.4	0	0	0	0	106.6	H415 T420 I421 T549 M1172	H415-T417 PolarHBondContact ND1-OG1 2.92Å; T417-T420 PolarHBondContact OG1-O 2.87Å; T417-T420 VanDerWaalsContact OG1-O 3.08Å; T417-I421 VanDerWaalsContact O-CG1 3.3Å; T417-I421 WeakPolarHBondContact O-CG1 3.49Å; T417-T549 WeakPolarHBondContact O-CA 3.22Å; T417-M1172 WeakPolarHBondContact CB-SD 3.39Å; T417-M1172 HydrophobicContact CG2-CB 4.42Å; T417-M1172 HydrophobicContact CG2-CG 4.08Å; T417-M1172 HydrophobicContact CG2-SD 3.6Å; T417-M1172 VanDerWaalsContact CG2-SD 3.6Å; T417-M1172 PolarHBondContact O-N 2.87Å
418	M	71.1	Confident	73.4	Confident	1 Å²	1	28.5 Å²	28.5	1%	0.005	14%	0.138	C	C	.	.	S	Bend	trans	-64.3	-57.7	178.4	114.4	-152.9	-160.3	0	0	129.5	L512 P514 T549 S552 L1166 Q1171 M1172 C1174 D1175	M418-L512 CarbonylContact O-C 3.55Å; M418-L512 VanDerWaalsContact O-C 3.26Å; M418-L512 WeakPolarHBondContact O-CA 3.42Å; M418-L512 VanDerWaalsContact O-CB 3.3Å; M418-L512 WeakPolarHBondContact O-CB 3.43Å; M418-L512 PolarHBondContact O-N 2.93Å; M418-P514 HydrophobicContact CB-CB 4.46Å; M418-P514 HydrophobicContact CB-CG 4.25Å; M418-P514 HydrophobicContact CE-CG 3.83Å; M418-P514 HydrophobicContact CG-CG 3.88Å; M418-P514 HydrophobicContact SD-CG 3.82Å; M418-T549 HydrophobicContact CB-CG2 4.31Å; M418-T549 WeakPolarHBondContact O-CG2 3.38Å; M418-S552 WeakPolarHBondContact SD-CB 3.35Å; M418-L1166 HydrophobicContact CE-CD2 3.72Å; M418-L1166 WeakPolarHBondContact CE-O 3.44Å; M418-Q1171 CarbonylContact C-O 3.52Å; M418-Q1171 CarbonylContact O-C 3.56Å; M418-M1172 VanDerWaalsContact C-CB 3.5Å; M418-M1172 VanDerWaalsContact CA-CB 3.44Å; M418-M1172 HydrophobicContact CB-CB 4.42Å; M418-M1172 HydrophobicContact CB-CE 3.53Å; M418-M1172 HydrophobicContact CG-CE 3.43Å; M418-M1172 VanDerWaalsContact CG-CE 3.43Å; M418-M1172 PolarHBondContact N-SD 2.86Å; M418-M1172 HydrophobicContact SD-CE 3.46Å; M418-M1172 WeakPolarHBondContact SD-CE 3.33Å; M418-C1174 VanDerWaalsContact CE-O 3.24Å; M418-C1174 WeakPolarHBondContact CE-O 3.33Å; M418-D1175 HydrophobicContact SD-CB 4.46Å
419	N	74.3	Confident	73.3	Confident	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.155	C	C	.	.	S	Bend	trans	-110.2	0	172.7	59.4	-22.6	0	0	0	131.9	P510 K1165 L1166 Q1171 M1172 K1173 C1174	N419-P510 CarbonylContact C-O 3.51Å; N419-P510 CarbonylContact O-C 3.05Å; N419-P510 VanDerWaalsContact O-C 3.25Å; N419-K1165 PolarHBondContact ND2-O 3.37Å; N419-L1166 VanDerWaalsContact CB-C 3.46Å; N419-L1166 WeakPolarHBondContact CB-O 3.45Å; N419-L1166 PolarHBondContact ND2-O 2.95Å; N419-Q1171 CarbonylContact C-O 3.55Å; N419-Q1171 WeakPolarHBondContact CA-O 3.15Å; N419-Q1171 PolarHBondContact N-O 3.37Å; N419-M1172 VanDerWaalsContact C-N 3.26Å; N419-M1172 VanDerWaalsContact N-N 3.19Å; N419-M1172 WeakPolarHBondContact OD1-CB 3.11Å; N419-K1173 HydrophobicContact CB-CB 4.4Å; N419-K1173 VanDerWaalsContact CG-N 3.26Å; N419-K1173 WeakPolarHBondContact O-CG 3.02Å; N419-K1173 PolarHBondContact O-N 3.11Å; N419-K1173 WeakPolarHBondContact OD1-CA 3.26Å; N419-K1173 PolarHBondContact OD1-N 2.84Å; N419-C1174 PolarHBondContact ND2-N 3.35Å; N419-C1174 PolarHBondContact ND2-O 2.86Å; N419-C1174 PolarHBondContact OD1-N 2.87Å; N419-C1174 PolarHBondContact OD1-O 3.33Å
420	T	73.6	Confident	73	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	15%	0.15	C	C	.	.				0	134.3	0	104.5	0	0	0	0	136.8	T417 Q508 P510 Q1171 M1172 K1173	T417-T420 PolarHBondContact OG1-O 2.87Å; T417-T420 VanDerWaalsContact OG1-O 3.08Å; T420-Q508 HydrophobicContact CG2-CB 4.18Å; T420-Q508 PolarHBondContact OG1-OE1 3.24Å; T420-P510 WeakPolarHBondContact CA-O 3.27Å; T420-P510 HydrophobicContact CG2-CB 3.76Å; T420-P510 HydrophobicContact CG2-CG 3.65Å; T420-P510 PolarHBondContact N-O 2.81Å; T420-Q1171 VanDerWaalsContact C-CB 3.48Å; T420-Q1171 PolarHBondContact N-O 3.03Å; T420-M1172 CarbonylContact C-O 3.59Å; T420-M1172 WeakPolarHBondContact CA-O 3.28Å; T420-M1172 WeakPolarHBondContact CB-O 3.23Å; T420-M1172 PolarHBondContact N-O 3.21Å; T420-M1172 CarbonylContact O-C 3.45Å; T420-M1172 WeakPolarHBondContact O-CA 3.32Å; T420-M1172 PolarHBondContact O-N 3.15Å; T420-M1172 PolarHBondContact OG1-O 2.69Å; T420-K1173 HydrophobicContact CG2-CD 3.55Å; T420-K1173 HydrophobicContact CG2-CG 3.68Å
421	I	75.6	Confident	72.6	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.137	C	C	.	.			trans	-102.4	-158.1	179.6	-70	163.8	0	0	0	100.8	C413 H415 R416 T417 Q508 L512 C547 H548 Q1171 M1172	C413-I421 WeakPolarHBondContact SG-CG2 3.13Å; H415-I421 CarbonylContact O-C 3.51Å; H415-I421 WeakPolarHBondContact O-CA 3.49Å; H415-I421 WeakPolarHBondContact O-CB 3.46Å; H415-I421 WeakPolarHBondContact O-CG1 3.31Å; H415-I421 WeakPolarHBondContact O-CG2 3.19Å; R416-I421 HydrophobicContact CG-CG2 4.19Å; T417-I421 VanDerWaalsContact O-CG1 3.3Å; T417-I421 WeakPolarHBondContact O-CG1 3.49Å; I421-Q508 WeakPolarHBondContact O-CG 3.27Å; I421-L512 HydrophobicContact CD1-CD1 4.16Å; I421-L512 HydrophobicContact CD1-CD2 4.38Å; I421-L512 HydrophobicContact CD1-CG 4.13Å; I421-C547 HydrophobicContact CD1-CB 3.94Å; I421-C547 HydrophobicContact CG2-CB 4.14Å; I421-H548 WeakPolarHBondContact CD1-O 3.45Å; I421-Q1171 HydrophobicContact CB-CB 3.31Å; I421-Q1171 HydrophobicContact CB-CG 3.59Å; I421-Q1171 HydrophobicContact CD1-CB 3.86Å; I421-Q1171 HydrophobicContact CD1-CG 4.21Å; I421-Q1171 HydrophobicContact CG1-CB 3.5Å; I421-Q1171 VanDerWaalsContact CG1-CB 3.5Å; I421-Q1171 HydrophobicContact CG1-CG 4.13Å; I421-Q1171 HydrophobicContact CG2-CB 4.48Å; I421-Q1171 HydrophobicContact CG2-CG 4.28Å; I421-Q1171 VanDerWaalsContact N-OE1 3.09Å; I421-Q1171 PolarHBondContact O-OE1 3.02Å; I421-Q1171 VanDerWaalsContact O-OE1 3.11Å; I421-M1172 VanDerWaalsContact N-N 3.11Å
422	T	74.1	Confident	71.4	Confident	14 Å²	14	28.6 Å²	28.6	9%	0.086	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	127.6	163.9	-51.5	0	0	0	0	110	C413 I414 H415 K506 Q508	C413-T422 CarbonylContact C-O 3.44Å; I414-T422 HydrophobicContact CD1-CG2 4Å; I414-T422 PolarHBondContact N-O 3.14Å; H415-T422 WeakPolarHBondContact CB-OG1 3.08Å; H415-T422 PolarHBondContact O-N 2.82Å; H415-T422 VanDerWaalsContact O-N 3.08Å; T422-K506 HydrophobicContact CG2-CB 4.43Å; T422-Q508 HydrophobicContact CG2-CG 4.12Å; T422-Q508 WeakPolarHBondContact OG1-CG 3.23Å; T422-Q508 PolarHBondContact OG1-NE2 3.39Å; T422-Q508 VanDerWaalsContact OG1-NE2 3.13Å
423	I	77.3	Confident	70.7	Confident	0 Å²	0	25 Å²	25	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	143.2	164.5	55.7	170.6	0	0	0	110.2	F411 K412 W425 L439 K506 M507 I509 I520 I545 Q1171	F411-I423 HydrophobicContact CD2-CB 4.43Å; F411-I423 HydrophobicContact CE2-CB 3.7Å; F411-I423 HydrophobicContact CE2-CD1 3.56Å; F411-I423 HydrophobicContact CE2-CG1 4.11Å; F411-I423 HydrophobicContact CE2-CG2 4.09Å; F411-I423 HydrophobicContact CZ-CB 4.38Å; F411-I423 HydrophobicContact CZ-CD1 3.88Å; F411-I423 HydrophobicContact CZ-CG2 4.3Å; K412-I423 CarbonylContact O-C 3.55Å; K412-I423 VanDerWaalsContact O-CA 3.29Å; K412-I423 WeakPolarHBondContact O-CA 3.19Å; I423-W425 HydrophobicContact CD1-CE3 4.24Å; I423-W425 HydrophobicContact CD1-CZ3 3.76Å; I423-W425 HydrophobicContact CG1-CE3 4.35Å; I423-W425 HydrophobicContact CG1-CZ3 3.94Å; I423-L439 HydrophobicContact CD1-CD1 3.96Å; I423-L439 HydrophobicContact CD1-CD2 4.14Å; I423-K506 CarbonylContact O-C 3Å; I423-K506 VanDerWaalsContact O-CA 3.31Å; I423-K506 WeakPolarHBondContact O-CA 3.41Å; I423-M507 HydrophobicContact CD1-CB 4.04Å; I423-M507 HydrophobicContact CD1-CE 3.68Å; I423-M507 HydrophobicContact CG1-CB 3.83Å; I423-M507 VanDerWaalsContact CG1-O 3.23Å; I423-M507 WeakPolarHBondContact CG1-O 3.38Å; I423-M507 PolarHBondContact N-O 2.87Å; I423-M507 PolarHBondContact O-N 3.47Å; I423-I509 HydrophobicContact CD1-CD1 3.73Å; I423-I509 HydrophobicContact CD1-CG1 4.01Å; I423-I509 HydrophobicContact CG1-CD1 4.12Å; I423-I509 HydrophobicContact CG1-CG1 4.16Å; I423-I509 HydrophobicContact CG2-CD1 4.05Å; I423-I520 HydrophobicContact CD1-CG2 4.28Å; I423-I520 HydrophobicContact CG2-CD1 3.85Å; I423-I520 HydrophobicContact CG2-CG2 4.27Å; I423-I545 HydrophobicContact CB-CD1 4.42Å; I423-I545 HydrophobicContact CG2-CD1 3.55Å; I423-I545 HydrophobicContact CG2-CG1 4.5Å; I423-Q1171 VanDerWaalsContact CG2-NE2 3.32Å
424	E	75.5	Confident	70.5	Confident	17 Å²	17	23.7 Å²	23.7	8%	0.079	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	135.6	169.9	176.1	170.4	-137.7	0	0	109.6	N410 F411 K412 I414 T504 H505 K506	N410-E424 VanDerWaalsContact O-O 3.06Å; F411-E424 CarbonylContact C-O 3.48Å; F411-E424 WeakPolarHBondContact CA-O 3.39Å; K412-E424 WeakPolarHBondContact CE-OE2 3.46Å; K412-E424 HydrophobicContact CG-CB 4.27Å; K412-E424 PolarHBondContact N-O 3.47Å; K412-E424 IonicContact NZ-OE2 2.72Å; K412-E424 PolarHBondContact NZ-OE2 2.96Å; K412-E424 PolarHBondContact O-N 2.92Å; I414-E424 HydrophobicContact CD1-CB 3.5Å; I414-E424 VanDerWaalsContact CD1-CB 3.5Å; I414-E424 HydrophobicContact CD1-CG 4.33Å; I414-E424 HydrophobicContact CG1-CB 3.87Å; E424-T504 HydrophobicContact CG-CG2 4.3Å; E424-T504 WeakPolarHBondContact OE1-CB 3.2Å; E424-T504 WeakPolarHBondContact OE1-CG2 3.23Å; E424-T504 PolarHBondContact OE1-OG1 3.3Å; E424-H505 CarbonylContact C-O 3.58Å; E424-H505 WeakPolarHBondContact CA-O 3.42Å; E424-K506 HydrophobicContact CB-CG 3.98Å; E424-K506 HydrophobicContact CG-CG 3.94Å; E424-K506 WeakPolarHBondContact OE1-CE 3.36Å; E424-K506 IonicContact OE1-NZ 3.93Å
425	W	75.1	Confident	70.4	Confident	0 Å²	0	21 Å²	21	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	-168.6	168.8	64.8	107.3	0	0	0	110.9	V408 Q409 F411 I423 Y437 W482 T504 H505 M507 I522	V408-W425 HydrophobicContact CB-CB 4.1Å; V408-W425 HydrophobicContact CB-CG 4.11Å; V408-W425 VanDerWaalsContact CG1-CD1 3.49Å; V408-W425 HydrophobicContact CG1-CG 4.32Å; V408-W425 HydrophobicContact CG2-CB 4Å; V408-W425 HydrophobicContact CG2-CG 4.28Å; Q409-W425 CarbonylContact O-C 3.56Å; Q409-W425 VanDerWaalsContact O-C 3.32Å; Q409-W425 WeakPolarHBondContact O-CA 3.3Å; Q409-W425 VanDerWaalsContact O-CB 3.32Å; Q409-W425 WeakPolarHBondContact O-CB 3.47Å; F411-W425 HydrophobicContact CB-CB 4.26Å; F411-W425 HydrophobicContact CD2-CB 3.86Å; F411-W425 HydrophobicContact CD2-CE3 4.36Å; F411-W425 HydrophobicContact CE2-CE3 4.16Å; F411-W425 HydrophobicContact CG-CB 4.47Å; I423-W425 HydrophobicContact CD1-CE3 4.24Å; I423-W425 HydrophobicContact CD1-CZ3 3.76Å; I423-W425 HydrophobicContact CG1-CE3 4.35Å; I423-W425 HydrophobicContact CG1-CZ3 3.94Å; W425-Y437 HydrophobicContact CZ2-CD2 4.43Å; W425-Y437 AromaticContact NE1-CZ 3.91Å; W425-W482 HydrophobicContact CH2-CH2 4.19Å; W425-W482 AromaticContact CH2-CZ2 3.65Å; W425-W482 HydrophobicContact CH2-CZ2 3.65Å; W425-W482 HydrophobicContact CZ2-CH2 4.15Å; W425-W482 AromaticContact CZ2-CZ2 3.45Å; W425-W482 HydrophobicContact CZ2-CZ2 3.45Å; W425-W482 VanDerWaalsContact CZ2-CZ2 3.45Å; W425-T504 CarbonylContact O-C 3.49Å; W425-T504 WeakPolarHBondContact O-CA 3.25Å; W425-H505 AromaticContact CD1-CD2 3.89Å; W425-H505 AromaticContact CD1-CG 3.87Å; W425-H505 HydrophobicContact CD2-CB 3.44Å; W425-H505 VanDerWaalsContact CD2-CB 3.44Å; W425-H505 AromaticContact CE2-CD2 3.75Å; W425-H505 AromaticContact CE2-CG 3.93Å; W425-H505 HydrophobicContact CE3-CB 4.04Å; W425-H505 HydrophobicContact CG-CB 3.64Å; W425-H505 HydrophobicContact CH2-CB 4.42Å; W425-H505 HydrophobicContact CZ2-CB 3.9Å; W425-H505 HydrophobicContact CZ3-CB 4.47Å; W425-H505 PolarHBondContact N-O 3.42Å; W425-H505 AromaticContact NE1-CD2 3.25Å; W425-H505 PolarHBondContact NE1-CD2 3.18Å; W425-H505 AromaticContact NE1-CG 3.6Å; W425-H505 PolarHBondContact O-N 2.8Å; W425-M507 HydrophobicContact CH2-CB 3.74Å; W425-M507 HydrophobicContact CH2-CE 3.77Å; W425-M507 HydrophobicContact CH2-SD 4.41Å; W425-M507 HydrophobicContact CZ3-CB 3.57Å; W425-M507 HydrophobicContact CZ3-CE 4.15Å; W425-I522 HydrophobicContact CD2-CD1 3.61Å; W425-I522 HydrophobicContact CE3-CD1 4.04Å; W425-I522 HydrophobicContact CG-CD1 4.16Å; W425-I522 HydrophobicContact CH2-CD1 3.93Å; W425-I522 HydrophobicContact CZ2-CD1 3.45Å; W425-I522 VanDerWaalsContact CZ2-CD1 3.45Å; W425-I522 HydrophobicContact CZ3-CD1 4.21Å
426	L	75.4	Confident	70.8	Confident	23 Å²	23	20.9 Å²	20.9	12%	0.12	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	151.9	170.1	-95	170.4	0	0	0	106.7	V408 Q409 N410 Q502 T504	V408-L426 WeakPolarHBondContact CB-O 3.31Å; Q409-L426 HydrophobicContact CB-CB 3.66Å; Q409-L426 PolarHBondContact N-O 3Å; Q409-L426 PolarHBondContact O-N 3.14Å; N410-L426 HydrophobicContact CB-CB 4.3Å; N410-L426 HydrophobicContact CB-CD1 4.03Å; N410-L426 HydrophobicContact CB-CG 4.31Å; L426-Q502 HydrophobicContact CD2-CB 4.31Å; L426-T504 HydrophobicContact CD1-CG2 4.43Å; L426-T504 HydrophobicContact CD2-CG2 3.84Å; L426-T504 HydrophobicContact CG-CG2 3.8Å
427	P	73.1	Confident	71.2	Confident	13 Å²	13	15.7 Å²	15.7	8%	0.084	8%	0.084	C	C	.	.			trans	-64.9	158.3	-176.2	27.4	-32.2	0	0	0	111.8	L431 Q503	P427-L431 HydrophobicContact CB-CD2 4.01Å; P427-Q503 WeakPolarHBondContact CD-O 3.42Å
428	P	72.1	Confident	71.9	Confident	1 Å²	1	16.5 Å²	16.5	1%	0.006	9%	0.088	C	C	.	.			trans	-58.1	145.5	167.6	-19.1	31.1	0	0	0	111.2	K405 T407 V408 H430 L431 L434 Y437 P524	K405-P428 WeakPolarHBondContact O-CB 3.27Å; T407-P428 WeakPolarHBondContact O-CA 3.38Å; T407-P428 WeakPolarHBondContact O-CB 2.85Å; V408-P428 HydrophobicContact CG1-CG 4.4Å; P428-H430 PolarHBondContact O-N 2.84Å; P428-L431 WeakPolarHBondContact O-CD2 3.06Å; P428-L434 HydrophobicContact CG-CD2 4.48Å; P428-Y437 VanDerWaalsContact CD-OH 3.27Å; P428-Y437 WeakPolarHBondContact CD-OH 3.43Å; P428-Y437 HydrophobicContact CG-CE1 4.05Å; P428-P524 HydrophobicContact CG-CB 3.95Å; P428-P524 HydrophobicContact CG-CG 4.04Å
429	I	71.1	Confident	72.3	Confident	78 Å²	78	16.6 Å²	16.6	40%	0.4	9%	0.089	S	C	.	.	S	Bend	trans	-62.7	-31.4	178.2	-46.8	168.9	0	0	0	110.3	K405	K405-I429 HydrophobicContact CB-CB 4.02Å; K405-I429 HydrophobicContact CG-CB 3.89Å; K405-I429 HydrophobicContact CG-CD1 3.92Å; K405-I429 HydrophobicContact CG-CG1 4.41Å; K405-I429 HydrophobicContact CG-CG2 4.29Å; K405-I429 PolarHBondContact O-N 3.45Å
430	H	65.3	Low	72.7	Confident	36 Å²	36	19.5 Å²	19.5	17%	0.167	10%	0.102	C	C	.	.			trans	-93.7	109.3	174.5	-162.5	75.8	0	0	0	112	M397 K405 F406 P428 A432	M397-H430 WeakPolarHBondContact CE-NE2 3.46Å; K405-H430 HydrophobicContact CB-CB 3.97Å; K405-H430 WeakPolarHBondContact O-CA 3.34Å; K405-H430 VanDerWaalsContact O-CB 3.31Å; K405-H430 WeakPolarHBondContact O-CB 3.45Å; K405-H430 PolarHBondContact O-N 2.94Å; F406-H430 HydrophobicContact CD1-CB 4.44Å; F406-H430 HydrophobicContact CD2-CB 4.23Å; F406-H430 HydrophobicContact CE1-CB 3.96Å; F406-H430 AromaticContact CE1-CD2 3.55Å; F406-H430 AromaticContact CE1-CG 3.83Å; F406-H430 HydrophobicContact CE2-CB 3.67Å; F406-H430 AromaticContact CE2-CG 3.93Å; F406-H430 HydrophobicContact CZ-CB 3.53Å; F406-H430 AromaticContact CZ-CD2 3.46Å; F406-H430 VanDerWaalsContact CZ-CD2 3.46Å; F406-H430 WeakPolarHBondContact CZ-CD2 3.42Å; F406-H430 AromaticContact CZ-CG 3.34Å; P428-H430 PolarHBondContact O-N 2.84Å; H430-A432 VanDerWaalsContact NE2-CB 3.35Å; H430-A432 WeakPolarHBondContact NE2-CB 3.16Å; H430-A432 PolarHBondContact NE2-N 3.37Å; H430-A432 PolarHBondContact NE2-O 2.77Å
431	L	66.5	Low	73	Confident	49 Å²	49	19.5 Å²	19.5	26%	0.257	10%	0.102	S	C	.	.			trans	-104.7	-9.7	-175.2	-67.9	175	0	0	0	114.3	P427 P428 N433 L434 L484	P427-L431 HydrophobicContact CB-CD2 4.01Å; P428-L431 WeakPolarHBondContact O-CD2 3.06Å; L431-N433 PolarHBondContact O-N 2.96Å; L431-L434 HydrophobicContact CD2-CD2 4.29Å; L431-L484 HydrophobicContact CB-CD2 4.22Å; L431-L484 HydrophobicContact CD1-CD1 3.91Å; L431-L484 HydrophobicContact CD1-CD2 4.44Å; L431-L484 HydrophobicContact CD1-CG 4.44Å; L431-L484 HydrophobicContact CD2-CD1 3.86Å; L431-L484 HydrophobicContact CD2-CD2 3.86Å; L431-L484 HydrophobicContact CD2-CG 4.45Å; L431-L484 HydrophobicContact CG-CD1 4.45Å; L431-L484 HydrophobicContact CG-CD2 4.39Å
432	A	57.6	Low	73.1	Confident	25 Å²	25	20.8 Å²	20.8	21%	0.207	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	131.6	-176.5	0	0	0	0	0	110.2	H430 L434 L845	H430-A432 VanDerWaalsContact NE2-CB 3.35Å; H430-A432 WeakPolarHBondContact NE2-CB 3.16Å; H430-A432 PolarHBondContact NE2-N 3.37Å; H430-A432 PolarHBondContact NE2-O 2.77Å; A432-L434 PolarHBondContact O-N 2.95Å; A432-L434 VanDerWaalsContact O-N 3.08Å; A432-L845 HydrophobicContact CB-CB 3.85Å; A432-L845 WeakPolarHBondContact O-CD1 3.36Å
433	N	62.4	Low	73.2	Confident	7 Å²	7	20.2 Å²	20.2	4%	0.037	11%	0.108	C	C	.	.	T	Hydrogen-bonded Turn	trans	52.6	22.6	-176.3	-72.9	26.8	0	0	0	114.7	L431 L435 Y526 R527 L845	L431-N433 PolarHBondContact O-N 2.96Å; N433-L435 PolarHBondContact O-N 3.48Å; N433-Y526 CarbonylContact O-C 2.93Å; N433-Y526 WeakPolarHBondContact O-CA 3.49Å; N433-R527 HydrophobicContact CB-CB 3.98Å; N433-R527 PolarHBondContact ND2-O 2.74Å; N433-R527 PolarHBondContact O-N 2.83Å; N433-L845 HydrophobicContact CB-CB 3.83Å; N433-L845 HydrophobicContact CB-CD1 3.73Å; N433-L845 HydrophobicContact CB-CD2 3.59Å; N433-L845 HydrophobicContact CB-CG 3.82Å; N433-L845 VanDerWaalsContact ND2-CD2 3.31Å; N433-L845 WeakPolarHBondContact ND2-CD2 3.35Å
434	L	68.2	Low	73.3	Confident	3 Å²	3	22.2 Å²	22.2	2%	0.016	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.9	115.9	164.2	-179.5	72.3	0	0	0	107.9	P428 L431 A432 Y437 I468 P524 I525 Y526	P428-L434 HydrophobicContact CG-CD2 4.48Å; L431-L434 HydrophobicContact CD2-CD2 4.29Å; A432-L434 PolarHBondContact O-N 2.95Å; A432-L434 VanDerWaalsContact O-N 3.08Å; L434-Y437 HydrophobicContact CD2-CE1 4.18Å; L434-I468 HydrophobicContact CD2-CD1 3.48Å; L434-I468 VanDerWaalsContact CD2-CD1 3.48Å; L434-I468 HydrophobicContact CG-CD1 3.76Å; L434-P524 HydrophobicContact CD1-CB 3.43Å; L434-P524 VanDerWaalsContact CD1-CB 3.43Å; L434-I525 CarbonylContact C-O 3.49Å; L434-I525 WeakPolarHBondContact CD1-O 3.48Å; L434-Y526 HydrophobicContact CB-CD1 4Å; L434-Y526 HydrophobicContact CB-CE1 3.79Å; L434-Y526 HydrophobicContact CD1-CD1 4.04Å; L434-Y526 HydrophobicContact CD1-CD2 4.31Å; L434-Y526 HydrophobicContact CD1-CE1 3.51Å; L434-Y526 HydrophobicContact CD1-CE2 3.8Å; L434-Y526 HydrophobicContact CD1-CG 4.4Å; L434-Y526 HydrophobicContact CG-CE1 4.23Å
435	L	69.3	Low	73.3	Confident	22 Å²	22	21.5 Å²	21.5	12%	0.115	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	-49	179	-82	175.1	0	0	0	112	N433 N467 I468 D469 I525 R527 A537	N433-L435 PolarHBondContact O-N 3.48Å; L435-N467 CarbonylContact O-C 3.11Å; L435-N467 WeakPolarHBondContact O-CA 3.26Å; L435-N467 PolarHBondContact O-OD1 3.22Å; L435-I468 WeakPolarHBondContact O-CB 3.05Å; L435-I468 PolarHBondContact O-N 3.1Å; L435-D469 HydrophobicContact CD2-CB 4.16Å; L435-D469 WeakPolarHBondContact CD2-OD2 3.34Å; L435-I525 WeakPolarHBondContact CA-O 3.25Å; L435-I525 HydrophobicContact CB-CG2 4.43Å; L435-I525 PolarHBondContact N-O 2.99Å; L435-R527 HydrophobicContact CD1-CB 4Å; L435-R527 HydrophobicContact CD2-CB 3.88Å; L435-R527 HydrophobicContact CD2-CG 4.29Å; L435-R527 HydrophobicContact CG-CB 3.72Å; L435-A537 HydrophobicContact CD1-CB 3.88Å
436	E	73.3	Confident	73.3	Confident	35 Å²	35	24.1 Å²	24.1	16%	0.164	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.8	172.7	-171.4	62.9	-172.5	175.6	0	0	114.6	Q466 N467 P524 I525	E436-Q466 CarbonylContact C-O 3.58Å; E436-Q466 WeakPolarHBondContact CA-O 3.35Å; E436-Q466 WeakPolarHBondContact CB-O 3.2Å; E436-N467 HydrophobicContact CB-CB 4.35Å; E436-N467 PolarHBondContact OE2-ND2 3.41Å; E436-P524 CarbonylContact O-C 3.52Å; E436-P524 WeakPolarHBondContact O-CA 3.46Å; E436-I525 HydrophobicContact CG-CB 3.68Å; E436-I525 HydrophobicContact CG-CD1 3.99Å; E436-I525 HydrophobicContact CG-CG1 4.2Å; E436-I525 HydrophobicContact CG-CG2 4.09Å; E436-I525 PolarHBondContact N-O 3.36Å; E436-I525 PolarHBondContact O-N 3.44Å
437	Y	77.4	Confident	73.4	Confident	3 Å²	3	23.3 Å²	23.3	1%	0.012	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	125	162.6	-56.1	-71.5	0	0	0	111	V408 W425 P428 L434 H465 Q466 I468 W482 H505 R523 P524	V408-Y437 HydrophobicContact CG1-CD1 4.04Å; V408-Y437 HydrophobicContact CG1-CE1 3.75Å; W425-Y437 HydrophobicContact CZ2-CD2 4.43Å; W425-Y437 AromaticContact NE1-CZ 3.91Å; P428-Y437 VanDerWaalsContact CD-OH 3.27Å; P428-Y437 WeakPolarHBondContact CD-OH 3.43Å; P428-Y437 HydrophobicContact CG-CE1 4.05Å; L434-Y437 HydrophobicContact CD2-CE1 4.18Å; Y437-H465 CarbonylContact O-C 3.56Å; Y437-H465 WeakPolarHBondContact O-CA 3.31Å; Y437-Q466 PolarHBondContact N-O 3.36Å; Y437-Q466 VanDerWaalsContact O-CB 3.29Å; Y437-Q466 WeakPolarHBondContact O-CB 3.48Å; Y437-Q466 PolarHBondContact O-N 3.46Å; Y437-I468 HydrophobicContact CD2-CD1 4.38Å; Y437-I468 HydrophobicContact CE2-CD1 4.04Å; Y437-W482 AromaticContact CD2-NE1 3.91Å; Y437-W482 AromaticContact CE2-NE1 3.94Å; Y437-H505 AromaticContact CE2-CD2 3.69Å; Y437-H505 AromaticContact CE2-NE2 3.77Å; Y437-H505 AromaticContact CZ-CD2 3.91Å; Y437-H505 AromaticContact CZ-NE2 3.81Å; Y437-H505 PolarHBondContact OH-NE2 3.44Å; Y437-R523 CarbonylContact C-O 3.48Å; Y437-R523 WeakPolarHBondContact CA-O 3.32Å; Y437-P524 HydrophobicContact CD1-CB 3.93Å; Y437-P524 HydrophobicContact CE1-CB 4.08Å
438	Q	81	Confident	73.5	Confident	20 Å²	20	25.2 Å²	25.2	9%	0.093	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	117.6	167.9	174.1	175.5	37	0	0	110.6	L464 H465 I522 R523 I525	Q438-L464 CarbonylContact C-O 3.56Å; Q438-L464 VanDerWaalsContact CA-O 3.23Å; Q438-L464 WeakPolarHBondContact CA-O 3.06Å; Q438-H465 PolarHBondContact NE2-NE2 3.35Å; Q438-I522 CarbonylContact O-C 3.45Å; Q438-I522 WeakPolarHBondContact O-CA 3.39Å; Q438-R523 HydrophobicContact CB-CB 4.34Å; Q438-R523 PolarHBondContact N-O 2.69Å; Q438-R523 PolarHBondContact O-N 3.47Å; Q438-I525 HydrophobicContact CB-CD1 3.91Å
439	L	81.1	Confident	73.7	Confident	3 Å²	3	26.1 Å²	26.1	2%	0.016	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	149.6	164.1	-145.1	76.8	0	0	0	110.8	F411 I423 I441 Q463 L464 M507 I509 I520 T521 I522	F411-L439 HydrophobicContact CZ-CD1 4.36Å; I423-L439 HydrophobicContact CD1-CD1 3.96Å; I423-L439 HydrophobicContact CD1-CD2 4.14Å; L439-I441 HydrophobicContact CD2-CD1 3.89Å; L439-I441 HydrophobicContact CD2-CG1 3.87Å; L439-I441 HydrophobicContact CG-CG1 4.48Å; L439-Q463 VanDerWaalsContact O-CA 3.24Å; L439-Q463 WeakPolarHBondContact O-CA 3.38Å; L439-L464 HydrophobicContact CB-CB 3.91Å; L439-L464 HydrophobicContact CB-CD1 4.47Å; L439-L464 HydrophobicContact CD2-CD1 4.08Å; L439-L464 PolarHBondContact N-O 3.12Å; L439-L464 PolarHBondContact O-N 3.45Å; L439-M507 HydrophobicContact CB-CE 4.42Å; L439-M507 HydrophobicContact CD1-CE 3.8Å; L439-M507 HydrophobicContact CD2-CE 3.52Å; L439-M507 HydrophobicContact CG-CE 4.14Å; L439-I509 HydrophobicContact CD2-CD1 3.59Å; L439-I509 HydrophobicContact CD2-CG1 4.01Å; L439-I509 HydrophobicContact CD2-CG2 4.05Å; L439-I520 HydrophobicContact CD1-CG2 4.19Å; L439-I520 HydrophobicContact CD2-CG2 3.95Å; L439-I520 HydrophobicContact CG-CG2 4.14Å; L439-T521 CarbonylContact C-O 3.53Å; L439-T521 VanDerWaalsContact CA-O 3.23Å; L439-T521 WeakPolarHBondContact CA-O 3.22Å; L439-T521 VanDerWaalsContact CD1-O 3.29Å; L439-T521 WeakPolarHBondContact CD1-O 3.36Å; L439-T521 VanDerWaalsContact CG-O 3.3Å; L439-T521 WeakPolarHBondContact CG-O 3.31Å; L439-I522 HydrophobicContact CD1-CB 3.48Å; L439-I522 VanDerWaalsContact CD1-CB 3.48Å; L439-I522 HydrophobicContact CD1-CD1 3.96Å; L439-I522 HydrophobicContact CD1-CG1 3.71Å
440	Q	81.2	Confident	74	Confident	60 Å²	60	25.6 Å²	25.6	28%	0.28	14%	0.138	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	122.3	163	-179.5	179.5	0.9	0	0	109.2	D461 I462 Q463 T521	Q440-D461 PolarHBondContact NE2-OD2 2.91Å; Q440-I462 CarbonylContact C-O 3.47Å; Q440-I462 VanDerWaalsContact CA-O 3.25Å; Q440-I462 WeakPolarHBondContact CA-O 3.46Å; Q440-Q463 HydrophobicContact CB-CG 4.2Å; Q440-Q463 HydrophobicContact CG-CG 4.13Å; Q440-T521 PolarHBondContact N-O 2.75Å; Q440-T521 WeakPolarHBondContact O-CB 3.36Å; Q440-T521 PolarHBondContact O-N 2.92Å
441	I	80.7	Confident	74.4	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	145.2	173.1	-35.9	95.4	0	0	0	109.6	L439 D461 I462 L464 I509 Y518 K519 I520	L439-I441 HydrophobicContact CD2-CD1 3.89Å; L439-I441 HydrophobicContact CD2-CG1 3.87Å; L439-I441 HydrophobicContact CG-CG1 4.48Å; I441-D461 CarbonylContact O-C 3.29Å; I441-D461 VanDerWaalsContact O-CA 3.31Å; I441-D461 WeakPolarHBondContact O-CA 3.32Å; I441-I462 HydrophobicContact CB-CB 4.31Å; I441-I462 HydrophobicContact CD1-CB 3.56Å; I441-I462 HydrophobicContact CD1-CG2 3.35Å; I441-I462 PolarHBondContact N-O 3.03Å; I441-I462 PolarHBondContact O-N 3.41Å; I441-L464 HydrophobicContact CD1-CD1 4.46Å; I441-I509 HydrophobicContact CD1-CG2 3.62Å; I441-I509 HydrophobicContact CG1-CD1 4.14Å; I441-I509 HydrophobicContact CG1-CG2 4Å; I441-Y518 HydrophobicContact CG2-CD1 3.75Å; I441-Y518 HydrophobicContact CG2-CG 4.35Å; I441-K519 CarbonylContact C-O 3.4Å; I441-K519 WeakPolarHBondContact CA-O 3.48Å; I441-I520 HydrophobicContact CG1-CG1 4.38Å; I441-I520 HydrophobicContact CG1-CG2 4.26Å; I441-I520 HydrophobicContact CG2-CB 4.37Å; I441-I520 HydrophobicContact CG2-CG1 3.57Å
442	S	77.5	Confident	74.4	Confident	28 Å²	28	24 Å²	24	20%	0.196	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	138.3	172.1	-171.4	0	0	0	0	110	H458 D461 Y518 K519	S442-H458 PolarHBondContact OG-NE2 3.48Å; S442-D461 WeakPolarHBondContact CB-OD1 3.23Å; S442-D461 PolarHBondContact OG-OD1 3.4Å; S442-Y518 CarbonylContact O-C 3.59Å; S442-Y518 WeakPolarHBondContact O-CA 3.43Å; S442-Y518 VanDerWaalsContact O-CB 3.22Å; S442-Y518 WeakPolarHBondContact O-CB 3.38Å; S442-K519 PolarHBondContact N-O 2.82Å; S442-K519 PolarHBondContact O-N 3.06Å
443	G	75.8	Confident	74.9	Confident	2 Å²	2	26.6 Å²	26.6	2%	0.021	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	151.6	-169.3	0	0	0	0	0	117.2	H458 L459 G460	G443-H458 WeakPolarHBondContact O-CA 3.47Å; G443-H458 PolarHBondContact O-CD2 2.84Å; G443-L459 PolarHBondContact O-N 2.64Å; G443-G460 PolarHBondContact N-O 3.13Å
444	R	79.3	Confident	75.1	Confident	41 Å²	41	31 Å²	31	16%	0.155	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	147.1	173.5	65.3	-178.2	-174.7	176.1	7.2	113.7	W260 V457 L459 S516 Q517	W260-R444 VanDerWaalsContact O-CZ 3.3Å; W260-R444 PolarHBondContact O-NH1 3.3Å; W260-R444 PolarHBondContact O-NH2 2.88Å; R444-V457 CarbonylContact C-O 3.42Å; R444-V457 VanDerWaalsContact CA-O 3.3Å; R444-V457 WeakPolarHBondContact CA-O 3.42Å; R444-L459 VanDerWaalsContact C-CD1 3.5Å; R444-S516 CarbonylContact O-C 3.51Å; R444-S516 WeakPolarHBondContact O-CA 3.45Å; R444-S516 VanDerWaalsContact O-CB 3.22Å; R444-S516 WeakPolarHBondContact O-CB 3.49Å; R444-Q517 HydrophobicContact CG-CB 4.18Å; R444-Q517 WeakPolarHBondContact CG-O 3.45Å; R444-Q517 VanDerWaalsContact CZ-OE1 3.27Å; R444-Q517 PolarHBondContact N-O 2.81Å; R444-Q517 PolarHBondContact O-N 2.92Å
445	S	75.7	Confident	75.1	Confident	2 Å²	2	36 Å²	36	1%	0.014	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	150.3	166.6	-172.6	0	0	0	0	110.3	F447 S456 V457 N515 S516	S445-F447 WeakPolarHBondContact OG-CD1 3.48Å; S445-S456 CarbonylContact O-C 3.52Å; S445-S456 WeakPolarHBondContact O-CA 3.31Å; S445-S456 PolarHBondContact O-OG 3.47Å; S445-V457 PolarHBondContact N-O 3.46Å; S445-V457 PolarHBondContact O-N 3.2Å; S445-N515 PolarHBondContact OG-O 2.9Å; S445-S516 VanDerWaalsContact CB-OG 3.27Å; S445-S516 WeakPolarHBondContact CB-OG 3.46Å
446	E	76	Confident	75.2	Confident	56 Å²	56	38.6 Å²	38.6	26%	0.262	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	124.7	172.5	-68.7	-177.1	-166.2	0	0	109.4	K455 N515	E446-K455 WeakPolarHBondContact CA-O 3.29Å; E446-N515 PolarHBondContact O-ND2 3.41Å
447	F	77.1	Confident	75.1	Confident	6 Å²	6	38.7 Å²	38.7	3%	0.026	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	160.9	-172.5	60.7	-93.2	0	0	0	114.8	S445 K455 V457 E588 E589	S445-F447 WeakPolarHBondContact OG-CD1 3.48Å; F447-K455 HydrophobicContact CD2-CB 4.49Å; F447-K455 HydrophobicContact CE2-CB 4.22Å; F447-K455 HydrophobicContact CE2-CD 4.12Å; F447-K455 HydrophobicContact CZ-CB 4.36Å; F447-K455 HydrophobicContact CZ-CD 3.89Å; F447-K455 HydrophobicContact CZ-CG 4.32Å; F447-K455 PolarHBondContact N-O 2.96Å; F447-K455 PolarHBondContact O-N 2.83Å; F447-V457 HydrophobicContact CE1-CG2 3.62Å; F447-V457 HydrophobicContact CZ-CG2 4Å; F447-E588 VanDerWaalsContact CB-C 3.46Å; F447-E588 HydrophobicContact CB-CB 4.31Å; F447-E588 VanDerWaalsContact CB-O 3.3Å; F447-E588 WeakPolarHBondContact CB-O 3.47Å; F447-E589 HydrophobicContact CD1-CB 4.08Å; F447-E589 HydrophobicContact CD1-CG 3.99Å; F447-E589 HydrophobicContact CD2-CB 3.71Å; F447-E589 HydrophobicContact CD2-CG 4.4Å; F447-E589 HydrophobicContact CE1-CB 4Å; F447-E589 HydrophobicContact CE1-CG 3.6Å; F447-E589 HydrophobicContact CE2-CB 3.64Å; F447-E589 HydrophobicContact CE2-CG 4.05Å; F447-E589 VanDerWaalsContact CG-CA 3.43Å; F447-E589 HydrophobicContact CG-CB 3.92Å; F447-E589 HydrophobicContact CG-CG 4.36Å; F447-E589 HydrophobicContact CZ-CB 3.77Å; F447-E589 HydrophobicContact CZ-CG 3.61Å; F447-E589 VanDerWaalsContact CZ-OE2 3.28Å; F447-E589 WeakPolarHBondContact CZ-OE2 3.43Å
448	I	75.8	Confident	75	Confident	52 Å²	52	44 Å²	44	27%	0.267	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	128	172.7	-56.9	-175.7	0	0	0	110.5	V453 S587 E588	I448-V453 CarbonylContact C-O 3.53Å; I448-V453 WeakPolarHBondContact CA-O 3.33Å; I448-S587 WeakPolarHBondContact O-CA 3.36Å; I448-S587 PolarHBondContact O-OG 2.81Å; I448-E588 HydrophobicContact CB-CB 4.31Å; I448-E588 HydrophobicContact CB-CG 4.24Å; I448-E588 WeakPolarHBondContact CB-OE2 3.16Å; I448-E588 WeakPolarHBondContact CD1-OE2 3.34Å; I448-E588 WeakPolarHBondContact CG1-OE2 3.28Å; I448-E588 PolarHBondContact O-N 2.82Å
449	T	76.5	Confident	74.3	Confident	21 Å²	21	44.4 Å²	44.4	13%	0.129	25%	0.245	C	C	.	.			trans	-69.8	169.3	176.6	61.1	0	0	0	0	112.5	S451 G452 V453 K455 S587	T449-S451 PolarHBondContact O-N 2.8Å; T449-S451 PolarHBondContact OG1-N 2.93Å; T449-S451 PolarHBondContact OG1-OG 3.06Å; T449-G452 PolarHBondContact O-N 3.4Å; T449-G452 PolarHBondContact OG1-N 3.36Å; T449-V453 WeakPolarHBondContact CG2-O 3.29Å; T449-V453 PolarHBondContact N-O 2.83Å; T449-V453 PolarHBondContact OG1-N 3.1Å; T449-V453 PolarHBondContact OG1-O 2.82Å; T449-K455 HydrophobicContact CG2-CB 3.85Å; T449-K455 HydrophobicContact CG2-CD 4.14Å; T449-S587 WeakPolarHBondContact CA-OG 3.3Å
450	S	77.3	Confident	73	Confident	66 Å²	66	45.8 Å²	45.8	46%	0.462	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-25.4	165.8	52.4	0	0	0	0	113.5	G452 R585	S450-G452 VanDerWaalsContact C-N 3.33Å; S450-R585 WeakPolarHBondContact O-CD 3.3Å
451	S	71.9	Confident	72.2	Confident	42 Å²	42	47.2 Å²	47.2	29%	0.294	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-4	171.9	54.6	0	0	0	0	114.5	T449	T449-S451 PolarHBondContact O-N 2.8Å; T449-S451 PolarHBondContact OG1-N 2.93Å; T449-S451 PolarHBondContact OG1-OG 3.06Å
452	G	67	Low	71.6	Confident	11 Å²	11	48.2 Å²	48.2	11%	0.113	27%	0.274	C	S	.	.	S	Bend	trans	84	8	-179.7	0	0	0	0	0	115.2	T449 S450	T449-G452 PolarHBondContact O-N 3.4Å; T449-G452 PolarHBondContact OG1-N 3.36Å; S450-G452 VanDerWaalsContact C-N 3.33Å
453	V	68	Low	71	Confident	79 Å²	79	51.9 Å²	51.9	48%	0.479	29%	0.288	S	S	.	.			trans	-89.3	141.9	-179.6	-178.4	0	0	0	0	110.3	I448 T449 K455	I448-V453 CarbonylContact C-O 3.53Å; I448-V453 WeakPolarHBondContact CA-O 3.33Å; T449-V453 WeakPolarHBondContact CG2-O 3.29Å; T449-V453 PolarHBondContact N-O 2.83Å; T449-V453 PolarHBondContact OG1-N 3.1Å; T449-V453 PolarHBondContact OG1-O 2.82Å; V453-K455 PolarHBondContact O-N 3.12Å
454	L	66.2	Low	70.5	Confident	100 Å²	100	53.4 Å²	53.4	52%	0.524	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	116.8	173.4	-179.2	65.7	0	0	0	110.4
455	K	68.8	Low	69.4	Low	106 Å²	106	56.8 Å²	56.8	46%	0.461	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	135.2	178	-172.1	176.5	-179.7	-177	0	110.1	E446 F447 T449 V453 V457	E446-K455 WeakPolarHBondContact CA-O 3.29Å; F447-K455 HydrophobicContact CD2-CB 4.49Å; F447-K455 HydrophobicContact CE2-CB 4.22Å; F447-K455 HydrophobicContact CE2-CD 4.12Å; F447-K455 HydrophobicContact CZ-CB 4.36Å; F447-K455 HydrophobicContact CZ-CD 3.89Å; F447-K455 HydrophobicContact CZ-CG 4.32Å; F447-K455 PolarHBondContact N-O 2.96Å; F447-K455 PolarHBondContact O-N 2.83Å; T449-K455 HydrophobicContact CG2-CB 3.85Å; T449-K455 HydrophobicContact CG2-CD 4.14Å; V453-K455 PolarHBondContact O-N 3.12Å; K455-V457 HydrophobicContact CD-CG2 4.15Å; K455-V457 HydrophobicContact CG-CG2 3.94Å
456	S	71.5	Confident	68.3	Low	78 Å²	78	58.1 Å²	58.1	55%	0.545	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	138.7	168.8	-172.6	0	0	0	0	109.2	S445	S445-S456 CarbonylContact O-C 3.52Å; S445-S456 WeakPolarHBondContact O-CA 3.31Å; S445-S456 PolarHBondContact O-OG 3.47Å
457	V	71.3	Confident	67.1	Low	36 Å²	36	58.7 Å²	58.7	22%	0.218	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	122.2	-175.1	-169.4	0	0	0	0	109.4	R444 S445 F447 K455 L459	R444-V457 CarbonylContact C-O 3.42Å; R444-V457 VanDerWaalsContact CA-O 3.3Å; R444-V457 WeakPolarHBondContact CA-O 3.42Å; S445-V457 PolarHBondContact N-O 3.46Å; S445-V457 PolarHBondContact O-N 3.2Å; F447-V457 HydrophobicContact CE1-CG2 3.62Å; F447-V457 HydrophobicContact CZ-CG2 4Å; K455-V457 HydrophobicContact CD-CG2 4.15Å; K455-V457 HydrophobicContact CG-CG2 3.94Å; V457-L459 HydrophobicContact CB-CD2 4.09Å; V457-L459 HydrophobicContact CG1-CD2 3.81Å; V457-L459 WeakPolarHBondContact O-CG 3.32Å
458	H	74.7	Confident	66.1	Low	116 Å²	116	59.4 Å²	59.4	54%	0.537	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	139.2	167.5	-174.4	-93.4	0	0	0	109.8	S442 G443 G460 D461	S442-H458 PolarHBondContact OG-NE2 3.48Å; G443-H458 WeakPolarHBondContact O-CA 3.47Å; G443-H458 PolarHBondContact O-CD2 2.84Å; H458-G460 VanDerWaalsContact CE1-C 3.45Å; H458-G460 PolarHBondContact CE1-N 3.06Å; H458-G460 PolarHBondContact ND1-N 2.53Å; H458-D461 IonicContact CE1-OD1 2.65Å; H458-D461 PolarHBondContact CE1-OD1 3.07Å; H458-D461 VanDerWaalsContact CE1-OD1 3.27Å; H458-D461 IonicContact NE2-OD1 3.36Å; H458-D461 PolarHBondContact NE2-OD1 3.36Å
459	L	67.1	Low	64.5	Low	28 Å²	28	59.7 Å²	59.7	15%	0.147	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	19.7	-163.8	-52.6	175.4	0	0	0	113.1	G443 R444 V457 K513 S516 Y518	G443-L459 PolarHBondContact O-N 2.64Å; R444-L459 VanDerWaalsContact C-CD1 3.5Å; V457-L459 HydrophobicContact CB-CD2 4.09Å; V457-L459 HydrophobicContact CG1-CD2 3.81Å; V457-L459 WeakPolarHBondContact O-CG 3.32Å; L459-K513 HydrophobicContact CD1-CB 3.85Å; L459-K513 HydrophobicContact CD1-CG 3.98Å; L459-K513 HydrophobicContact CD2-CD 4.04Å; L459-K513 HydrophobicContact CD2-CG 3.88Å; L459-K513 HydrophobicContact CG-CG 4.47Å; L459-S516 WeakPolarHBondContact CD1-OG 3.09Å; L459-Y518 HydrophobicContact CB-CE1 4.41Å; L459-Y518 HydrophobicContact CB-CE2 4.02Å; L459-Y518 WeakPolarHBondContact CB-OH 3.32Å; L459-Y518 HydrophobicContact CD1-CD2 4.43Å; L459-Y518 HydrophobicContact CD1-CE2 3.36Å; L459-Y518 WeakPolarHBondContact CD1-OH 3.35Å; L459-Y518 HydrophobicContact CG-CE2 4.31Å
460	G	53.8	Low	62.9	Low	31 Å²	31	66.8 Å²	66.8	32%	0.32	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	95.8	153.1	177.3	0	0	0	0	0	113.7	G443 H458	G443-G460 PolarHBondContact N-O 3.13Å; H458-G460 VanDerWaalsContact CE1-C 3.45Å; H458-G460 PolarHBondContact CE1-N 3.06Å; H458-G460 PolarHBondContact ND1-N 2.53Å
461	D	64.8	Low	61	Low	90 Å²	90	67.6 Å²	67.6	48%	0.481	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	139.6	168.3	-92.3	37.1	0	0	0	108.9	Q440 I441 S442 H458	Q440-D461 PolarHBondContact NE2-OD2 2.91Å; I441-D461 CarbonylContact O-C 3.29Å; I441-D461 VanDerWaalsContact O-CA 3.31Å; I441-D461 WeakPolarHBondContact O-CA 3.32Å; S442-D461 WeakPolarHBondContact CB-OD1 3.23Å; S442-D461 PolarHBondContact OG-OD1 3.4Å; H458-D461 IonicContact CE1-OD1 2.65Å; H458-D461 PolarHBondContact CE1-OD1 3.07Å; H458-D461 VanDerWaalsContact CE1-OD1 3.27Å; H458-D461 IonicContact NE2-OD1 3.36Å; H458-D461 PolarHBondContact NE2-OD1 3.36Å
462	I	66.9	Low	59.3	Low	22 Å²	22	72.2 Å²	72.2	11%	0.113	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	130.8	-171.9	-62.6	172.3	0	0	0	107.3	Q440 I441 L1169	Q440-I462 CarbonylContact C-O 3.47Å; Q440-I462 VanDerWaalsContact CA-O 3.25Å; Q440-I462 WeakPolarHBondContact CA-O 3.46Å; I441-I462 HydrophobicContact CB-CB 4.31Å; I441-I462 HydrophobicContact CD1-CB 3.56Å; I441-I462 HydrophobicContact CD1-CG2 3.35Å; I441-I462 PolarHBondContact N-O 3.03Å; I441-I462 PolarHBondContact O-N 3.41Å; I462-L1169 VanDerWaalsContact CD1-C 3.45Å; I462-L1169 HydrophobicContact CD1-CD2 3.8Å; I462-L1169 WeakPolarHBondContact CD1-O 3.17Å; I462-L1169 HydrophobicContact CG1-CD2 4.11Å; I462-L1169 HydrophobicContact CG2-CD2 3.65Å
463	Q	64.9	Low	57.8	Low	105 Å²	105	77.5 Å²	77.5	49%	0.491	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	144.2	168.8	-64.4	-169.1	21.9	0	0	110.5	L439 Q440	L439-Q463 VanDerWaalsContact O-CA 3.24Å; L439-Q463 WeakPolarHBondContact O-CA 3.38Å; Q440-Q463 HydrophobicContact CB-CG 4.2Å; Q440-Q463 HydrophobicContact CG-CG 4.13Å
464	L	65	Low	56	Low	33 Å²	33	77 Å²	77	17%	0.173	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	141.2	173.2	-63.5	169.5	0	0	0	108	Q438 L439 I441 M507 I509 L1169	Q438-L464 CarbonylContact C-O 3.56Å; Q438-L464 VanDerWaalsContact CA-O 3.23Å; Q438-L464 WeakPolarHBondContact CA-O 3.06Å; L439-L464 HydrophobicContact CB-CB 3.91Å; L439-L464 HydrophobicContact CB-CD1 4.47Å; L439-L464 HydrophobicContact CD2-CD1 4.08Å; L439-L464 PolarHBondContact N-O 3.12Å; L439-L464 PolarHBondContact O-N 3.45Å; I441-L464 HydrophobicContact CD1-CD1 4.46Å; L464-M507 HydrophobicContact CD1-SD 4.45Å; L464-I509 HydrophobicContact CD1-CG2 3.78Å; L464-L1169 HydrophobicContact CD2-CD1 4.08Å
465	H	56.6	Low	54.5	Low	112 Å²	112	74.8 Å²	74.8	52%	0.519	39%	0.387	S	S	.	.			trans	-118.4	151.7	172.7	-62	148.9	0	0	0	109.1	Y437 Q438	Y437-H465 CarbonylContact O-C 3.56Å; Y437-H465 WeakPolarHBondContact O-CA 3.31Å; Q438-H465 PolarHBondContact NE2-NE2 3.35Å
466	Q	53.5	Low	52.7	Low	30 Å²	30	71.6 Å²	71.6	14%	0.14	37%	0.374	C	S	.	.			trans	-150.8	84.1	-165.1	-174.5	161.5	81.8	0	0	112.1	E436 Y437	E436-Q466 CarbonylContact C-O 3.58Å; E436-Q466 WeakPolarHBondContact CA-O 3.35Å; E436-Q466 WeakPolarHBondContact CB-O 3.2Å; Y437-Q466 PolarHBondContact N-O 3.36Å; Y437-Q466 VanDerWaalsContact O-CB 3.29Å; Y437-Q466 WeakPolarHBondContact O-CB 3.48Å; Y437-Q466 PolarHBondContact O-N 3.46Å
467	N	51.1	Low	50.7	Low	68 Å²	68	68.3 Å²	68.3	36%	0.364	35%	0.35	S	S	.	.	B	Isolated β-bridge	trans	-75.5	151.7	-169.1	-136.9	-88.1	0	0	0	114.4	L435 E436 D469	L435-N467 CarbonylContact O-C 3.11Å; L435-N467 WeakPolarHBondContact O-CA 3.26Å; L435-N467 PolarHBondContact O-OD1 3.22Å; E436-N467 HydrophobicContact CB-CB 4.35Å; E436-N467 PolarHBondContact OE2-ND2 3.41Å; N467-D469 PolarHBondContact OD1-N 3.47Å
468	I	54.8	Low	48.8	Very low	22 Å²	22	68.4 Å²	68.4	11%	0.113	35%	0.349	C	S	.	.	S	Bend	trans	-123.2	-26	-170.8	-62.1	-178.9	0	0	0	111.3	L434 L435 Y437 Q470 L484	L434-I468 HydrophobicContact CD2-CD1 3.48Å; L434-I468 VanDerWaalsContact CD2-CD1 3.48Å; L434-I468 HydrophobicContact CG-CD1 3.76Å; L435-I468 WeakPolarHBondContact O-CB 3.05Å; L435-I468 PolarHBondContact O-N 3.1Å; Y437-I468 HydrophobicContact CD2-CD1 4.38Å; Y437-I468 HydrophobicContact CE2-CD1 4.04Å; I468-Q470 VanDerWaalsContact C-N 3.34Å; I468-L484 HydrophobicContact CG2-CD2 4.3Å
469	D	43.5	Very low	46.6	Very low	58 Å²	58	67.4 Å²	67.4	31%	0.31	35%	0.345	S	S	.	.	S	Bend	trans	-87.8	1.9	177.5	-92.9	-15.6	0	0	0	112.9	L435 N467 R527	L435-D469 HydrophobicContact CD2-CB 4.16Å; L435-D469 WeakPolarHBondContact CD2-OD2 3.34Å; N467-D469 PolarHBondContact OD1-N 3.47Å; D469-R527 IonicContact OD2-CZ 3.56Å; D469-R527 IonicContact OD2-NE 3.5Å; D469-R527 PolarHBondContact OD2-NE 2.87Å; D469-R527 IonicContact OD2-NH2 2.76Å; D469-R527 PolarHBondContact OD2-NH2 2.91Å
470	Q	42.7	Very low	44.8	Very low	169 Å²	169	68.9 Å²	68.9	79%	0.79	35%	0.353	S	S	*	.			trans	-103	63.6	176.6	-71.9	-167.8	-17.8	0	0	113.1	I468	I468-Q470 VanDerWaalsContact C-N 3.34Å
471	Q	36.7	Very low	43.7	Very low	83 Å²	83	69.4 Å²	69.4	39%	0.388	35%	0.348	S	S	.	.			trans	-150.6	48.7	164.3	-135.7	-179.5	32.9	0	0	113.2	E476 V485	Q471-E476 PolarHBondContact NE2-O 3.44Å; Q471-E476 VanDerWaalsContact NE2-O 3.16Å; Q471-V485 HydrophobicContact CB-CG2 4.44Å
472	I	36.5	Very low	42.3	Very low	140 Å²	140	66.9 Å²	66.9	72%	0.718	33%	0.332	S	S	*	.	S	Bend	trans	-132.3	43.1	164.7	-37.8	180	0	0	0	110.9
473	D	34.4	Very low	40.7	Very low	121 Å²	121	68 Å²	68	65%	0.647	34%	0.341	S	S	*	.	S	Bend	trans	-154.5	-171.3	149.3	-142.6	-37.9	0	0	0	108.9	N1050	D473-N1050 PolarHBondContact O-ND2 2.7Å
474	N	32.3	Very low	39.3	Very low	69 Å²	69	64.1 Å²	64.1	37%	0.369	32%	0.323	S	S	.	.	S	Bend	trans	-44	137.4	-169.6	-85.9	-91	0	0	0	116.9	R1047 N1048 N1050	N474-R1047 PolarHBondContact OD1-O 2.89Å; N474-R1047 VanDerWaalsContact OD1-O 3.12Å; N474-N1048 PolarHBondContact OD1-O 3.2Å; N474-N1050 PolarHBondContact N-ND2 3.06Å; N474-N1050 PolarHBondContact ND2-OD1 3.43Å; N474-N1050 PolarHBondContact OD1-N 2.85Å; N474-N1050 PolarHBondContact OD1-OD1 3.1Å
475	N	33.3	Very low	38	Very low	54 Å²	54	64 Å²	64	29%	0.289	32%	0.324	S	S	.	.	S	Bend	trans	85.6	105.3	141.9	-67.4	-9.7	0	0	0	120.3	R1047 N1050 Y1051	N475-R1047 PolarHBondContact ND2-O 2.9Å; N475-R1047 PolarHBondContact OD1-O 3.01Å; N475-N1050 WeakPolarHBondContact CA-O 3.06Å; N475-N1050 PolarHBondContact N-O 3.14Å; N475-Y1051 HydrophobicContact CB-CD2 3.09Å; N475-Y1051 HydrophobicContact CB-CE2 3.37Å; N475-Y1051 HydrophobicContact CB-CG 3.91Å; N475-Y1051 WeakPolarHBondContact OD1-CD2 3.32Å; N475-Y1051 VanDerWaalsContact OD1-CG 3.3Å; N475-Y1051 PolarHBondContact OD1-N 3.18Å
476	E	30.6	Very low	37.1	Very low	39 Å²	39	64 Å²	64	18%	0.182	33%	0.328	C	S	.	.			trans	94.1	133	167.1	-75.1	-66	66.9	0	0	119.8	Q471 Y1051 Q1283 E1284 Q1287	Q471-E476 PolarHBondContact NE2-O 3.44Å; Q471-E476 VanDerWaalsContact NE2-O 3.16Å; E476-Y1051 HydrophobicContact CB-CD2 4.47Å; E476-Y1051 HydrophobicContact CG-CD2 3.76Å; E476-Y1051 HydrophobicContact CG-CE2 4.04Å; E476-Q1283 PolarHBondContact OE1-NE2 2.92Å; E476-Q1283 VanDerWaalsContact OE2-O 3.14Å; E476-E1284 WeakPolarHBondContact OE2-CA 3.1Å; E476-E1284 PolarHBondContact OE2-N 2.87Å; E476-Q1287 PolarHBondContact OE1-NE2 3.42Å; E476-Q1287 WeakPolarHBondContact OE2-CB 3.32Å; E476-Q1287 VanDerWaalsContact OE2-CD 3.29Å; E476-Q1287 WeakPolarHBondContact OE2-CG 2.89Å; E476-Q1287 PolarHBondContact OE2-NE2 2.84Å
477	P	30	Very low	36.2	Very low	8 Å²	8	65.7 Å²	65.7	5%	0.052	34%	0.337	C	S	.	.			trans	-131.8	170.1	166.5	40.5	-24.6	0	0	0	114.7	Q1055 Q1283	P477-Q1055 HydrophobicContact CG-CB 4.23Å; P477-Q1055 HydrophobicContact CG-CG 3.84Å; P477-Q1055 VanDerWaalsContact CG-NE2 3.34Å; P477-Q1283 VanDerWaalsContact CD-CD 3.44Å; P477-Q1283 WeakPolarHBondContact O-CB 3.31Å
478	E	32.6	Very low	35.7	Very low	39 Å²	39	65.5 Å²	65.5	18%	0.182	34%	0.335	C	S	.	.			trans	63.8	69.8	152.2	-139.5	137.2	-102.8	0	0	113.5	M1 N481 Q1059 T1282 Q1283	M1-E478 PolarHBondContact N-OE1 2.85Å; M1-E478 PolarHBondContact N-OE2 3.16Å; E478-N481 HydrophobicContact CB-CB 4.03Å; E478-N481 VanDerWaalsContact CD-ND2 3.31Å; E478-N481 HydrophobicContact CG-CB 3.97Å; E478-N481 PolarHBondContact N-OD1 3.44Å; E478-N481 PolarHBondContact OE1-ND2 3.18Å; E478-Q1059 PolarHBondContact OE2-NE2 2.74Å; E478-Q1059 VanDerWaalsContact OE2-NE2 3.12Å; E478-T1282 WeakPolarHBondContact O-CA 3.31Å; E478-Q1283 PolarHBondContact O-N 3.4Å
479	M	28.1	Very low	35	Very low	94 Å²	94	69.3 Å²	69.3	46%	0.463	36%	0.356	S	S	.	.	S	Bend		-164.9	125.1	70.7	-78.1	167.2	44	0	0	112.5	E1281 T1282 E1284	M479-E1281 VanDerWaalsContact SD-O 3.37Å; M479-T1282 HydrophobicContact CB-CG2 3.78Å; M479-T1282 HydrophobicContact CE-CG2 3.95Å; M479-T1282 HydrophobicContact CG-CG2 4.27Å; M479-T1282 HydrophobicContact SD-CG2 3.87Å; M479-E1284 PolarHBondContact N-OE1 2.84Å; M479-E1284 PolarHBondContact N-OE2 3.1Å
480	L	28	Very low	34.8	Very low	59 Å²	59	69.9 Å²	69.9	31%	0.309	36%	0.364	S	S	.	.	S	Bend	cis	-93.3	95.2	19.3	-59.8	87.6	0	0	0	112.7	W482 K506 M507	L480-W482 HydrophobicContact CB-CZ2 4.18Å; L480-W482 HydrophobicContact CD2-CH2 3.72Å; L480-W482 HydrophobicContact CD2-CZ2 3.38Å; L480-W482 HydrophobicContact CG-CZ2 4.41Å; L480-W482 PolarHBondContact O-N 3.4Å; L480-W482 VanDerWaalsContact O-N 3.16Å; L480-K506 WeakPolarHBondContact CD2-O 3.26Å; L480-M507 HydrophobicContact CD1-SD 4.49Å; L480-M507 HydrophobicContact CD2-CB 3.88Å; L480-M507 HydrophobicContact CD2-CG 4.07Å; L480-M507 HydrophobicContact CD2-SD 4.17Å
481	N	31.6	Very low	34.6	Very low	42 Å²	42	68.4 Å²	68.4	23%	0.225	36%	0.359	C	S	.	.			trans	-66.5	114	163.5	-112.8	12.5	0	0	0	108.7	E478	E478-N481 HydrophobicContact CB-CB 4.03Å; E478-N481 VanDerWaalsContact CD-ND2 3.31Å; E478-N481 HydrophobicContact CG-CB 3.97Å; E478-N481 PolarHBondContact N-OD1 3.44Å; E478-N481 PolarHBondContact OE1-ND2 3.18Å
482	W	35.6	Very low	35.1	Very low	37 Å²	37	68.8 Å²	68.8	14%	0.14	37%	0.371	C	S	.	.			trans	-81.8	129.1	167.5	-73.3	130.9	0	0	0	111.3	W425 Y437 L480 L484 H505	W425-W482 HydrophobicContact CH2-CH2 4.19Å; W425-W482 AromaticContact CH2-CZ2 3.65Å; W425-W482 HydrophobicContact CH2-CZ2 3.65Å; W425-W482 HydrophobicContact CZ2-CH2 4.15Å; W425-W482 AromaticContact CZ2-CZ2 3.45Å; W425-W482 HydrophobicContact CZ2-CZ2 3.45Å; W425-W482 VanDerWaalsContact CZ2-CZ2 3.45Å; Y437-W482 AromaticContact CD2-NE1 3.91Å; Y437-W482 AromaticContact CE2-NE1 3.94Å; L480-W482 HydrophobicContact CB-CZ2 4.18Å; L480-W482 HydrophobicContact CD2-CH2 3.72Å; L480-W482 HydrophobicContact CD2-CZ2 3.38Å; L480-W482 HydrophobicContact CG-CZ2 4.41Å; L480-W482 PolarHBondContact O-N 3.4Å; L480-W482 VanDerWaalsContact O-N 3.16Å; W482-L484 PolarHBondContact O-N 3.24Å; W482-H505 AromaticContact CD2-CD2 3.49Å; W482-H505 VanDerWaalsContact CD2-CD2 3.49Å; W482-H505 AromaticContact CD2-NE2 3.73Å; W482-H505 AromaticContact CE2-CD2 3.61Å; W482-H505 HydrophobicContact CE3-CB 4.16Å; W482-H505 AromaticContact CE3-CD2 3.38Å; W482-H505 AromaticContact CE3-CE1 3.84Å; W482-H505 AromaticContact CE3-CG 3.53Å; W482-H505 AromaticContact CE3-ND1 3.82Å; W482-H505 AromaticContact CE3-NE2 3.64Å; W482-H505 VanDerWaalsContact CH2-CA 3.43Å; W482-H505 HydrophobicContact CH2-CB 3.35Å; W482-H505 AromaticContact CH2-CD2 3.82Å; W482-H505 AromaticContact CH2-CG 3.67Å; W482-H505 HydrophobicContact CZ2-CB 3.93Å; W482-H505 AromaticContact CZ2-CD2 3.75Å; W482-H505 HydrophobicContact CZ3-CB 3.47Å; W482-H505 VanDerWaalsContact CZ3-CB 3.47Å; W482-H505 AromaticContact CZ3-CD2 3.64Å; W482-H505 AromaticContact CZ3-CG 3.37Å; W482-H505 AromaticContact CZ3-ND1 3.88Å
483	P	33.9	Very low	35.2	Very low	47 Å²	47	67 Å²	67	31%	0.305	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	5.5	-172.1	-26.5	34.2	0	0	0	117.5	Q503	P483-Q503 HydrophobicContact CG-CB 4.07Å; P483-Q503 HydrophobicContact CG-CG 4.41Å
484	L	34.6	Very low	35.2	Very low	22 Å²	22	68.3 Å²	68.3	12%	0.115	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-34.7	-159.3	-131.9	84.2	0	0	0	115.1	L431 I468 W482 N486 M487	L431-L484 HydrophobicContact CB-CD2 4.22Å; L431-L484 HydrophobicContact CD1-CD1 3.91Å; L431-L484 HydrophobicContact CD1-CD2 4.44Å; L431-L484 HydrophobicContact CD1-CG 4.44Å; L431-L484 HydrophobicContact CD2-CD1 3.86Å; L431-L484 HydrophobicContact CD2-CD2 3.86Å; L431-L484 HydrophobicContact CD2-CG 4.45Å; L431-L484 HydrophobicContact CG-CD1 4.45Å; L431-L484 HydrophobicContact CG-CD2 4.39Å; I468-L484 HydrophobicContact CG2-CD2 4.3Å; W482-L484 PolarHBondContact O-N 3.24Å; L484-N486 VanDerWaalsContact C-N 3.32Å; L484-N486 PolarHBondContact O-N 2.87Å; L484-M487 WeakPolarHBondContact O-CB 3.44Å; L484-M487 PolarHBondContact O-N 3.42Å; L484-M487 VanDerWaalsContact O-N 3.11Å
485	V	38.5	Very low	35.5	Very low	32 Å²	32	74.5 Å²	74.5	19%	0.194	40%	0.404	C	S	.	.	H	α-helix	trans	-63.3	-38.9	-169.8	-176.8	0	0	0	0	111.5	Q471 M487 L488	Q471-V485 HydrophobicContact CB-CG2 4.44Å; V485-M487 VanDerWaalsContact C-N 3.27Å; V485-M487 PolarHBondContact O-N 3.3Å; V485-L488 PolarHBondContact O-N 2.7Å
486	N	37.2	Very low	35.6	Very low	111 Å²	111	79.3 Å²	79.3	59%	0.594	43%	0.43	S	S	*	.	H	α-helix	trans	-69.7	-18.9	179	-71.2	-40.5	0	0	0	114.2	L484 S490	L484-N486 VanDerWaalsContact C-N 3.32Å; L484-N486 PolarHBondContact O-N 2.87Å; N486-S490 PolarHBondContact O-OG 2.7Å
487	M	34.4	Very low	35.7	Very low	65 Å²	65	85.4 Å²	85.4	32%	0.32	46%	0.458	S	S	.	.	H	α-helix	trans	-78.3	-22.2	174.7	-175.1	172	176.6	0	0	112.5	L484 V485 S490 M491 L500	L484-M487 WeakPolarHBondContact O-CB 3.44Å; L484-M487 PolarHBondContact O-N 3.42Å; L484-M487 VanDerWaalsContact O-N 3.11Å; V485-M487 VanDerWaalsContact C-N 3.27Å; V485-M487 PolarHBondContact O-N 3.3Å; M487-S490 PolarHBondContact O-OG 2.8Å; M487-M491 WeakPolarHBondContact O-CG 3.34Å; M487-L500 HydrophobicContact CB-CD2 4.42Å; M487-L500 HydrophobicContact CE-CB 3.72Å; M487-L500 HydrophobicContact CE-CD1 4.18Å; M487-L500 HydrophobicContact CE-CD2 4.5Å; M487-L500 HydrophobicContact CE-CG 4.34Å; M487-L500 HydrophobicContact CG-CD1 4.25Å; M487-L500 HydrophobicContact CG-CD2 3.99Å; M487-L500 HydrophobicContact SD-CB 4.13Å; M487-L500 HydrophobicContact SD-CD2 3.97Å; M487-L500 HydrophobicContact SD-CG 4.44Å
488	L	40.3	Very low	35.9	Very low	64 Å²	64	90.2 Å²	90.2	34%	0.335	48%	0.479	S	S	.	.	H	α-helix	trans	-91.8	-32.6	-175.5	-76.9	161.6	0	0	0	113.4	V485 S490 M491 K849	V485-L488 PolarHBondContact O-N 2.7Å; L488-S490 VanDerWaalsContact C-N 3.27Å; L488-S490 PolarHBondContact O-N 3.17Å; L488-M491 PolarHBondContact O-N 3.05Å; L488-K849 VanDerWaalsContact CD1-NZ 3.34Å
489	N	40.4	Very low	36	Very low	102 Å²	102	93.9 Å²	93.9	55%	0.545	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-13.4	179	-69	-21.4	0	0	0	113.4	S492	N489-S492 PolarHBondContact O-OG 3.12Å
490	S	40.1	Very low	36.3	Very low	70 Å²	70	92.7 Å²	92.7	49%	0.49	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-15.4	174.6	40.7	0	0	0	0	113.9	N486 M487 L488 S492	N486-S490 PolarHBondContact O-OG 2.7Å; M487-S490 PolarHBondContact O-OG 2.8Å; L488-S490 VanDerWaalsContact C-N 3.27Å; L488-S490 PolarHBondContact O-N 3.17Å; S490-S492 PolarHBondContact O-N 3.23Å
491	M	38.4	Very low	36.9	Very low	138 Å²	138	93.9 Å²	93.9	68%	0.68	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.6	7.7	-176.9	-74.4	-175.7	70.1	0	0	115.3	M487 L488	M487-M491 WeakPolarHBondContact O-CG 3.34Å; L488-M491 PolarHBondContact O-N 3.05Å
492	S	46	Very low	37.5	Very low	92 Å²	92	98.2 Å²	98.2	64%	0.643	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.5	-3.1	-167.1	60.9	0	0	0	0	115.8	N489 S490	N489-S492 PolarHBondContact O-OG 3.12Å; S490-S492 PolarHBondContact O-N 3.23Å
493	S	40.1	Very low	38.4	Very low	101 Å²	101	99.2 Å²	99.2	71%	0.706	52%	0.52	S	S	*	.	S	Bend	trans	-142.4	-5.6	-172.7	52.2	0	0	0	0	116.5
494	L	34.1	Very low	39.7	Very low	150 Å²	150	100.1 Å²	100.1	79%	0.785	53%	0.525	S	S	*	.			trans	-130.3	105.8	174.4	-80.8	163.4	0	0	0	109.8	D496	L494-D496 PolarHBondContact O-N 3.17Å
495	E	37	Very low	41.2	Very low	198 Å²	198	99.2 Å²	99.2	93%	0.925	52%	0.52	S	S	*	.			trans	-84.1	84.2	167.9	-67.5	-175	127.2	0	0	109.2
496	D	35.8	Very low	42.8	Very low	155 Å²	155	102.9 Å²	102.9	83%	0.829	53%	0.534	S	S	*	.			trans	-161.6	160.5	156.6	-112.6	-35.3	0	0	0	112.2	L494	L494-D496 PolarHBondContact O-N 3.17Å
497	H	34.2	Very low	44.4	Very low	168 Å²	168	98 Å²	98	78%	0.778	51%	0.507	S	S	*	.			trans	-82.5	137.1	-168	-68	-77.5	0	0	0	114.7
498	H	33.5	Very low	46.2	Very low	109 Å²	109	97.8 Å²	97.8	51%	0.505	51%	0.506	S	S	.	.				-175.8	-179.5	115.6	-94.3	-61.8	0	0	0	112.4	L11	L11-H498 HydrophobicContact CD1-CB 4.03Å; L11-H498 VanDerWaalsContact CD2-CE1 3.46Å; L11-H498 WeakPolarHBondContact CD2-CE1 3.38Å
499	H	33.8	Very low	47.7	Very low	116 Å²	116	94.7 Å²	94.7	54%	0.537	49%	0.49	S	S	.	.			trans	-57.9	169.7	-158.2	-31	-118.7	0	0	0	117.6	L8	L8-H499 HydrophobicContact CD1-CB 4.09Å; L8-H499 WeakPolarHBondContact CD1-O 3.48Å; L8-H499 HydrophobicContact CD2-CB 3.79Å; L8-H499 VanDerWaalsContact CD2-O 3.29Å; L8-H499 WeakPolarHBondContact CD2-O 3.39Å; L8-H499 HydrophobicContact CG-CB 4.04Å
500	L	34.3	Very low	49.3	Very low	69 Å²	69	89.9 Å²	89.9	36%	0.361	46%	0.464	S	S	.	.			trans	-138.2	146.7	158.2	-107.9	117.9	0	0	0	111.4	T4 L5 M487	T4-L500 HydrophobicContact CG2-CD2 4.32Å; L5-L500 HydrophobicContact CD1-CD2 3.8Å; L5-L500 HydrophobicContact CD1-CG 4.08Å; M487-L500 HydrophobicContact CB-CD2 4.42Å; M487-L500 HydrophobicContact CE-CB 3.72Å; M487-L500 HydrophobicContact CE-CD1 4.18Å; M487-L500 HydrophobicContact CE-CD2 4.5Å; M487-L500 HydrophobicContact CE-CG 4.34Å; M487-L500 HydrophobicContact CG-CD1 4.25Å; M487-L500 HydrophobicContact CG-CD2 3.99Å; M487-L500 HydrophobicContact SD-CB 4.13Å; M487-L500 HydrophobicContact SD-CD2 3.97Å; M487-L500 HydrophobicContact SD-CG 4.44Å
501	Q	40.9	Very low	50.8	Low	83 Å²	83	87.7 Å²	87.7	39%	0.388	45%	0.446	S	S	.	.	P	Polyproline II helix	trans	-81.9	134.4	-174.7	-73.3	153.8	-24.3	0	0	112.3	Q6 L8	Q6-Q501 PolarHBondContact O-NE2 3.43Å; L8-Q501 HydrophobicContact CD1-CG 4.16Å
502	Q	45.2	Very low	52.6	Low	133 Å²	133	81.1 Å²	81.1	62%	0.621	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-80	123.9	173.7	-65.7	174.3	-26	0	0	110.6	L426	L426-Q502 HydrophobicContact CD2-CB 4.31Å
503	Q	54.4	Low	54.3	Low	58 Å²	58	79.7 Å²	79.7	27%	0.271	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-102.2	132.8	-179.3	-65.3	-162.6	-6.7	0	0	112.5	V3 T4 P427 P483 H505	V3-Q503 PolarHBondContact O-NE2 2.9Å; T4-Q503 PolarHBondContact OG1-NE2 3.02Å; P427-Q503 WeakPolarHBondContact CD-O 3.42Å; P483-Q503 HydrophobicContact CG-CB 4.07Å; P483-Q503 HydrophobicContact CG-CG 4.41Å; Q503-H505 PolarHBondContact O-ND1 2.65Å
504	T	60.8	Low	56	Low	66 Å²	66	75 Å²	75	41%	0.405	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-63.8	142.2	175	45.2	0	0	0	0	111.5	E424 W425 L426	E424-T504 HydrophobicContact CG-CG2 4.3Å; E424-T504 WeakPolarHBondContact OE1-CB 3.2Å; E424-T504 WeakPolarHBondContact OE1-CG2 3.23Å; E424-T504 PolarHBondContact OE1-OG1 3.3Å; W425-T504 CarbonylContact O-C 3.49Å; W425-T504 WeakPolarHBondContact O-CA 3.25Å; L426-T504 HydrophobicContact CD1-CG2 4.43Å; L426-T504 HydrophobicContact CD2-CG2 3.84Å; L426-T504 HydrophobicContact CG-CG2 3.8Å
505	H	66.5	Low	58.4	Low	3 Å²	3	69.5 Å²	69.5	1%	0.014	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	129.2	179.2	-71.7	36	0	0	0	109.2	E424 W425 Y437 W482 Q503	E424-H505 CarbonylContact C-O 3.58Å; E424-H505 WeakPolarHBondContact CA-O 3.42Å; W425-H505 AromaticContact CD1-CD2 3.89Å; W425-H505 AromaticContact CD1-CG 3.87Å; W425-H505 HydrophobicContact CD2-CB 3.44Å; W425-H505 VanDerWaalsContact CD2-CB 3.44Å; W425-H505 AromaticContact CE2-CD2 3.75Å; W425-H505 AromaticContact CE2-CG 3.93Å; W425-H505 HydrophobicContact CE3-CB 4.04Å; W425-H505 HydrophobicContact CG-CB 3.64Å; W425-H505 HydrophobicContact CH2-CB 4.42Å; W425-H505 HydrophobicContact CZ2-CB 3.9Å; W425-H505 HydrophobicContact CZ3-CB 4.47Å; W425-H505 PolarHBondContact N-O 3.42Å; W425-H505 AromaticContact NE1-CD2 3.25Å; W425-H505 PolarHBondContact NE1-CD2 3.18Å; W425-H505 AromaticContact NE1-CG 3.6Å; W425-H505 PolarHBondContact O-N 2.8Å; Y437-H505 AromaticContact CE2-CD2 3.69Å; Y437-H505 AromaticContact CE2-NE2 3.77Å; Y437-H505 AromaticContact CZ-CD2 3.91Å; Y437-H505 AromaticContact CZ-NE2 3.81Å; Y437-H505 PolarHBondContact OH-NE2 3.44Å; W482-H505 AromaticContact CD2-CD2 3.49Å; W482-H505 VanDerWaalsContact CD2-CD2 3.49Å; W482-H505 AromaticContact CD2-NE2 3.73Å; W482-H505 AromaticContact CE2-CD2 3.61Å; W482-H505 HydrophobicContact CE3-CB 4.16Å; W482-H505 AromaticContact CE3-CD2 3.38Å; W482-H505 AromaticContact CE3-CE1 3.84Å; W482-H505 AromaticContact CE3-CG 3.53Å; W482-H505 AromaticContact CE3-ND1 3.82Å; W482-H505 AromaticContact CE3-NE2 3.64Å; W482-H505 VanDerWaalsContact CH2-CA 3.43Å; W482-H505 HydrophobicContact CH2-CB 3.35Å; W482-H505 AromaticContact CH2-CD2 3.82Å; W482-H505 AromaticContact CH2-CG 3.67Å; W482-H505 HydrophobicContact CZ2-CB 3.93Å; W482-H505 AromaticContact CZ2-CD2 3.75Å; W482-H505 HydrophobicContact CZ3-CB 3.47Å; W482-H505 VanDerWaalsContact CZ3-CB 3.47Å; W482-H505 AromaticContact CZ3-CD2 3.64Å; W482-H505 AromaticContact CZ3-CG 3.37Å; W482-H505 AromaticContact CZ3-ND1 3.88Å; Q503-H505 PolarHBondContact O-ND1 2.65Å
506	K	70.6	Confident	60.5	Low	109 Å²	109	60.4 Å²	60.4	47%	0.474	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	141.7	177.1	-65	-177.7	-179.8	175.3	0	111.8	I414 T422 I423 E424 L480	I414-K506 HydrophobicContact CD1-CD 4.08Å; I414-K506 HydrophobicContact CD1-CG 4.42Å; T422-K506 HydrophobicContact CG2-CB 4.43Å; I423-K506 CarbonylContact O-C 3Å; I423-K506 VanDerWaalsContact O-CA 3.31Å; I423-K506 WeakPolarHBondContact O-CA 3.41Å; E424-K506 HydrophobicContact CB-CG 3.98Å; E424-K506 HydrophobicContact CG-CG 3.94Å; E424-K506 WeakPolarHBondContact OE1-CE 3.36Å; E424-K506 IonicContact OE1-NZ 3.93Å; L480-K506 WeakPolarHBondContact CD2-O 3.26Å
507	M	71.8	Confident	62.8	Low	8 Å²	8	54 Å²	54	4%	0.039	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	142.6	173	-174.4	159.1	55.5	0	0	111	I423 W425 L439 L464 L480 I509 Q1230	I423-M507 HydrophobicContact CD1-CB 4.04Å; I423-M507 HydrophobicContact CD1-CE 3.68Å; I423-M507 HydrophobicContact CG1-CB 3.83Å; I423-M507 VanDerWaalsContact CG1-O 3.23Å; I423-M507 WeakPolarHBondContact CG1-O 3.38Å; I423-M507 PolarHBondContact N-O 2.87Å; I423-M507 PolarHBondContact O-N 3.47Å; W425-M507 HydrophobicContact CH2-CB 3.74Å; W425-M507 HydrophobicContact CH2-CE 3.77Å; W425-M507 HydrophobicContact CH2-SD 4.41Å; W425-M507 HydrophobicContact CZ3-CB 3.57Å; W425-M507 HydrophobicContact CZ3-CE 4.15Å; L439-M507 HydrophobicContact CB-CE 4.42Å; L439-M507 HydrophobicContact CD1-CE 3.8Å; L439-M507 HydrophobicContact CD2-CE 3.52Å; L439-M507 HydrophobicContact CG-CE 4.14Å; L464-M507 HydrophobicContact CD1-SD 4.45Å; L480-M507 HydrophobicContact CD1-SD 4.49Å; L480-M507 HydrophobicContact CD2-CB 3.88Å; L480-M507 HydrophobicContact CD2-CG 4.07Å; L480-M507 HydrophobicContact CD2-SD 4.17Å; M507-I509 HydrophobicContact CG-CG1 4.45Å; M507-Q1230 PolarHBondContact SD-NE2 3Å; M507-Q1230 VanDerWaalsContact SD-NE2 3.36Å
508	Q	71.4	Confident	64.9	Low	61 Å²	61	46.2 Å²	46.2	29%	0.285	22%	0.222	S	C	.	.			trans	-107	122.1	169	-66.4	-161.4	-28.3	0	0	108.1	T420 I421 T422 Q1230	T420-Q508 HydrophobicContact CG2-CB 4.18Å; T420-Q508 PolarHBondContact OG1-OE1 3.24Å; I421-Q508 WeakPolarHBondContact O-CG 3.27Å; T422-Q508 HydrophobicContact CG2-CG 4.12Å; T422-Q508 WeakPolarHBondContact OG1-CG 3.23Å; T422-Q508 PolarHBondContact OG1-NE2 3.39Å; T422-Q508 VanDerWaalsContact OG1-NE2 3.13Å; Q508-Q1230 WeakPolarHBondContact O-CG 3.37Å; Q508-Q1230 PolarHBondContact O-NE2 3.35Å
509	I	72.9	Confident	67.2	Low	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.219	C	C	.	.			trans	-111	115.3	-170.9	-27.2	160.3	0	0	0	108.7	I423 L439 I441 L464 M507 I520 L1169 G1170 Q1171	I423-I509 HydrophobicContact CD1-CD1 3.73Å; I423-I509 HydrophobicContact CD1-CG1 4.01Å; I423-I509 HydrophobicContact CG1-CD1 4.12Å; I423-I509 HydrophobicContact CG1-CG1 4.16Å; I423-I509 HydrophobicContact CG2-CD1 4.05Å; L439-I509 HydrophobicContact CD2-CD1 3.59Å; L439-I509 HydrophobicContact CD2-CG1 4.01Å; L439-I509 HydrophobicContact CD2-CG2 4.05Å; I441-I509 HydrophobicContact CD1-CG2 3.62Å; I441-I509 HydrophobicContact CG1-CD1 4.14Å; I441-I509 HydrophobicContact CG1-CG2 4Å; L464-I509 HydrophobicContact CD1-CG2 3.78Å; M507-I509 HydrophobicContact CG-CG1 4.45Å; I509-I520 HydrophobicContact CD1-CB 4.38Å; I509-I520 HydrophobicContact CD1-CD1 3.85Å; I509-I520 HydrophobicContact CD1-CG1 3.92Å; I509-I520 HydrophobicContact CD1-CG2 3.5Å; I509-L1169 WeakPolarHBondContact CG2-O 3.17Å; I509-G1170 CarbonylContact O-C 3.59Å; I509-G1170 WeakPolarHBondContact O-CA 3.25Å; I509-G1170 PolarHBondContact O-N 3.35Å; I509-Q1171 HydrophobicContact CB-CG 3.97Å; I509-Q1171 HydrophobicContact CD1-CG 4.06Å; I509-Q1171 HydrophobicContact CG1-CG 4.18Å; I509-Q1171 WeakPolarHBondContact O-CA 3.19Å; I509-Q1171 WeakPolarHBondContact O-CB 3.34Å; I509-Q1171 VanDerWaalsContact O-CG 3.23Å; I509-Q1171 WeakPolarHBondContact O-CG 3.41Å; I509-Q1171 PolarHBondContact O-N 2.82Å
510	P	72.7	Confident	69.5	Low	0 Å²	0	40.3 Å²	40.3	0%	0	19%	0.194	C	C	.	.			trans	-58.5	-91.3	-155.6	-27.4	40.1	0	0	0	126.7	N419 T420 E1168 L1169 G1170 Q1171 D1229 Q1230	N419-P510 CarbonylContact C-O 3.51Å; N419-P510 CarbonylContact O-C 3.05Å; N419-P510 VanDerWaalsContact O-C 3.25Å; T420-P510 WeakPolarHBondContact CA-O 3.27Å; T420-P510 HydrophobicContact CG2-CB 3.76Å; T420-P510 HydrophobicContact CG2-CG 3.65Å; T420-P510 PolarHBondContact N-O 2.81Å; P510-E1168 HydrophobicContact CB-CB 3.11Å; P510-E1168 HydrophobicContact CB-CG 4.18Å; P510-E1168 WeakPolarHBondContact CB-OE2 3.44Å; P510-E1168 HydrophobicContact CG-CB 4.42Å; P510-L1169 VanDerWaalsContact CA-N 3.28Å; P510-L1169 HydrophobicContact CB-CB 4.07Å; P510-L1169 VanDerWaalsContact CB-N 3.29Å; P510-L1169 HydrophobicContact CG-CB 4.33Å; P510-L1169 VanDerWaalsContact N-C 3.31Å; P510-G1170 CarbonylContact O-C 3.58Å; P510-Q1171 CarbonylContact O-C 3.58Å; P510-Q1171 WeakPolarHBondContact O-CA 3.49Å; P510-Q1171 PolarHBondContact O-N 3.42Å; P510-D1229 HydrophobicContact CB-CB 3.9Å; P510-D1229 HydrophobicContact CG-CB 3.82Å; P510-Q1230 HydrophobicContact CG-CG 4.2Å
511	N	72.6	Confident	71.7	Confident	24 Å²	24	38.1 Å²	38.1	13%	0.128	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-61.9	126	171.7	42	-132.7	0	0	0	121.8	Y518 I1167 E1168 L1169 G1170 Q1171	N511-Y518 WeakPolarHBondContact O-CE1 3.39Å; N511-Y518 PolarHBondContact O-OH 3.3Å; N511-I1167 HydrophobicContact CB-CB 4.08Å; N511-I1167 HydrophobicContact CB-CG2 3.32Å; N511-I1167 WeakPolarHBondContact OD1-CG2 3.14Å; N511-E1168 VanDerWaalsContact N-C 3.25Å; N511-E1168 VanDerWaalsContact N-N 3.15Å; N511-E1168 PolarHBondContact OD1-N 3.35Å; N511-E1168 PolarHBondContact OD1-O 2.8Å; N511-L1169 WeakPolarHBondContact ND2-CA 3.42Å; N511-G1170 VanDerWaalsContact C-CA 3.43Å; N511-G1170 VanDerWaalsContact C-N 3.27Å; N511-G1170 VanDerWaalsContact CA-N 3.35Å; N511-G1170 PolarHBondContact ND2-N 3Å; N511-G1170 CarbonylContact O-C 3.53Å; N511-G1170 WeakPolarHBondContact O-CA 3.47Å; N511-G1170 PolarHBondContact O-N 2.91Å; N511-Q1171 CarbonylContact C-O 3.53Å; N511-Q1171 VanDerWaalsContact C-O 3.3Å; N511-Q1171 WeakPolarHBondContact CA-O 3.4Å; N511-Q1171 PolarHBondContact O-N 3.42Å; N511-Q1171 VanDerWaalsContact O-N 3.12Å
512	L	76.4	Confident	73.6	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.165	C	C	.	.	P	Polyproline II helix		-85.1	172.9	120.5	-43.7	-149.7	0	0	0	106.6	M418 I421 S516 Y518 T549 G1170 Q1171	M418-L512 CarbonylContact O-C 3.55Å; M418-L512 VanDerWaalsContact O-C 3.26Å; M418-L512 WeakPolarHBondContact O-CA 3.42Å; M418-L512 VanDerWaalsContact O-CB 3.3Å; M418-L512 WeakPolarHBondContact O-CB 3.43Å; M418-L512 PolarHBondContact O-N 2.93Å; I421-L512 HydrophobicContact CD1-CD1 4.16Å; I421-L512 HydrophobicContact CD1-CD2 4.38Å; I421-L512 HydrophobicContact CD1-CG 4.13Å; L512-S516 WeakPolarHBondContact CD1-O 3.46Å; L512-Y518 WeakPolarHBondContact CA-OH 3.34Å; L512-Y518 HydrophobicContact CB-CD2 3.76Å; L512-Y518 HydrophobicContact CB-CE2 3.43Å; L512-Y518 VanDerWaalsContact CB-CE2 3.43Å; L512-Y518 HydrophobicContact CD1-CD2 3.66Å; L512-Y518 HydrophobicContact CD1-CE2 4.24Å; L512-Y518 HydrophobicContact CD1-CG 4.29Å; L512-Y518 HydrophobicContact CD2-CD1 3.75Å; L512-Y518 HydrophobicContact CD2-CD2 3.3Å; L512-Y518 HydrophobicContact CD2-CE1 4.21Å; L512-Y518 HydrophobicContact CD2-CE2 3.78Å; L512-Y518 HydrophobicContact CD2-CG 3.29Å; L512-Y518 HydrophobicContact CG-CD2 3.74Å; L512-Y518 HydrophobicContact CG-CE2 3.97Å; L512-Y518 HydrophobicContact CG-CG 4.24Å; L512-T549 HydrophobicContact CB-CG2 3.17Å; L512-T549 HydrophobicContact CD1-CG2 3.24Å; L512-T549 HydrophobicContact CG-CG2 3.31Å; L512-G1170 WeakPolarHBondContact CD2-O 3.05Å; L512-Q1171 VanDerWaalsContact CD2-CA 3.44Å; L512-Q1171 HydrophobicContact CD2-CB 4.27Å; L512-Q1171 HydrophobicContact CD2-CG 4.4Å; L512-Q1171 VanDerWaalsContact N-CA 3.34Å; L512-Q1171 PolarHBondContact N-O 3.18Å
513	K	81.1	Confident	75.3	Confident	62 Å²	62	30.5 Å²	30.5	27%	0.27	15%	0.145	S	C	.	.	P	Polyproline II helix	trans	-76.7	159.6	147.9	-76.9	-143.1	178.9	-165.9	0	108.2	L459 S516 Y518 T549 E589 I1167	L459-K513 HydrophobicContact CD1-CB 3.85Å; L459-K513 HydrophobicContact CD1-CG 3.98Å; L459-K513 HydrophobicContact CD2-CD 4.04Å; L459-K513 HydrophobicContact CD2-CG 3.88Å; L459-K513 HydrophobicContact CG-CG 4.47Å; K513-S516 WeakPolarHBondContact CB-OG 3.31Å; K513-S516 WeakPolarHBondContact O-CB 3.36Å; K513-S516 PolarHBondContact O-OG 3.08Å; K513-Y518 PolarHBondContact N-OH 2.71Å; K513-T549 WeakPolarHBondContact O-CG2 3.47Å; K513-E589 IonicContact NZ-OE1 3.06Å; K513-E589 PolarHBondContact NZ-OE1 2.99Å; K513-I1167 HydrophobicContact CB-CD1 4.4Å; K513-I1167 HydrophobicContact CD-CD1 4.11Å; K513-I1167 HydrophobicContact CG-CD1 3.86Å
514	P	77.1	Confident	76.5	Confident	2 Å²	2	27.8 Å²	27.8	1%	0.013	13%	0.132	C	C	.	.	S	Bend	trans	-41.8	156.1	156.1	-28.2	36.9	0	0	0	113.5	M418 S516 S552 N590	M418-P514 HydrophobicContact CB-CB 4.46Å; M418-P514 HydrophobicContact CB-CG 4.25Å; M418-P514 HydrophobicContact CE-CG 3.83Å; M418-P514 HydrophobicContact CG-CG 3.88Å; M418-P514 HydrophobicContact SD-CG 3.82Å; P514-S516 VanDerWaalsContact C-N 3.35Å; P514-S516 PolarHBondContact O-N 3.39Å; P514-S516 PolarHBondContact O-OG 2.85Å; P514-S552 WeakPolarHBondContact CB-OG 3.39Å; P514-S552 WeakPolarHBondContact CG-OG 3.04Å; P514-N590 HydrophobicContact CB-CB 4.32Å; P514-N590 WeakPolarHBondContact CB-OD1 3.5Å
515	N	83.4	Confident	77.2	Confident	35 Å²	35	25.1 Å²	25.1	19%	0.187	12%	0.115	C	C	.	.	S	Bend	trans	41.4	56.1	178.8	-168.6	40.7	0	0	0	114	S445 E446 T549 W551 E588	S445-N515 PolarHBondContact OG-O 2.9Å; E446-N515 PolarHBondContact O-ND2 3.41Å; N515-T549 WeakPolarHBondContact CA-OG1 3.22Å; N515-T549 PolarHBondContact N-OG1 2.94Å; N515-W551 PolarHBondContact OD1-NE1 2.74Å; N515-E588 PolarHBondContact ND2-O 2.72Å
516	S	81.4	Confident	77.5	Confident	8 Å²	8	25.2 Å²	25.2	6%	0.056	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	164	-171	-62.8	0	0	0	0	114.1	R444 S445 L459 L512 K513 P514 H548 T549	R444-S516 CarbonylContact O-C 3.51Å; R444-S516 WeakPolarHBondContact O-CA 3.45Å; R444-S516 VanDerWaalsContact O-CB 3.22Å; R444-S516 WeakPolarHBondContact O-CB 3.49Å; S445-S516 VanDerWaalsContact CB-OG 3.27Å; S445-S516 WeakPolarHBondContact CB-OG 3.46Å; L459-S516 WeakPolarHBondContact CD1-OG 3.09Å; L512-S516 WeakPolarHBondContact CD1-O 3.46Å; K513-S516 WeakPolarHBondContact CB-OG 3.31Å; K513-S516 WeakPolarHBondContact O-CB 3.36Å; K513-S516 PolarHBondContact O-OG 3.08Å; P514-S516 VanDerWaalsContact C-N 3.35Å; P514-S516 PolarHBondContact O-N 3.39Å; P514-S516 PolarHBondContact O-OG 2.85Å; S516-H548 WeakPolarHBondContact O-CA 2.8Å; S516-T549 PolarHBondContact N-OG1 3.24Å; S516-T549 PolarHBondContact O-N 2.9Å
517	Q	83.2	Confident	77.1	Confident	21 Å²	21	22.9 Å²	22.9	10%	0.098	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	125.9	179.4	179.7	-172.9	3.6	0	0	109.4	R444 I546 H548	R444-Q517 HydrophobicContact CG-CB 4.18Å; R444-Q517 WeakPolarHBondContact CG-O 3.45Å; R444-Q517 VanDerWaalsContact CZ-OE1 3.27Å; R444-Q517 PolarHBondContact N-O 2.81Å; R444-Q517 PolarHBondContact O-N 2.92Å; Q517-I546 HydrophobicContact CG-CG2 3.67Å; Q517-I546 VanDerWaalsContact NE2-CG2 3.34Å; Q517-H548 WeakPolarHBondContact CG-NE2 3.42Å
518	Y	79.8	Confident	76.4	Confident	4 Å²	4	23.7 Å²	23.7	2%	0.016	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	149.9	171.4	-67.8	-145.8	0	0	0	111.7	I441 S442 L459 N511 L512 K513 I546 C547	I441-Y518 HydrophobicContact CG2-CD1 3.75Å; I441-Y518 HydrophobicContact CG2-CG 4.35Å; S442-Y518 CarbonylContact O-C 3.59Å; S442-Y518 WeakPolarHBondContact O-CA 3.43Å; S442-Y518 VanDerWaalsContact O-CB 3.22Å; S442-Y518 WeakPolarHBondContact O-CB 3.38Å; L459-Y518 HydrophobicContact CB-CE1 4.41Å; L459-Y518 HydrophobicContact CB-CE2 4.02Å; L459-Y518 WeakPolarHBondContact CB-OH 3.32Å; L459-Y518 HydrophobicContact CD1-CD2 4.43Å; L459-Y518 HydrophobicContact CD1-CE2 3.36Å; L459-Y518 WeakPolarHBondContact CD1-OH 3.35Å; L459-Y518 HydrophobicContact CG-CE2 4.31Å; N511-Y518 WeakPolarHBondContact O-CE1 3.39Å; N511-Y518 PolarHBondContact O-OH 3.3Å; L512-Y518 WeakPolarHBondContact CA-OH 3.34Å; L512-Y518 HydrophobicContact CB-CD2 3.76Å; L512-Y518 HydrophobicContact CB-CE2 3.43Å; L512-Y518 VanDerWaalsContact CB-CE2 3.43Å; L512-Y518 HydrophobicContact CD1-CD2 3.66Å; L512-Y518 HydrophobicContact CD1-CE2 4.24Å; L512-Y518 HydrophobicContact CD1-CG 4.29Å; L512-Y518 HydrophobicContact CD2-CD1 3.75Å; L512-Y518 HydrophobicContact CD2-CD2 3.3Å; L512-Y518 HydrophobicContact CD2-CE1 4.21Å; L512-Y518 HydrophobicContact CD2-CE2 3.78Å; L512-Y518 HydrophobicContact CD2-CG 3.29Å; L512-Y518 HydrophobicContact CG-CD2 3.74Å; L512-Y518 HydrophobicContact CG-CE2 3.97Å; L512-Y518 HydrophobicContact CG-CG 4.24Å; K513-Y518 PolarHBondContact N-OH 2.71Å; Y518-I546 WeakPolarHBondContact O-CA 3.35Å; Y518-C547 PolarHBondContact N-O 2.74Å; Y518-C547 PolarHBondContact O-N 3.36Å
519	K	81.8	Confident	75.3	Confident	101 Å²	101	23.9 Å²	23.9	44%	0.439	12%	0.115	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	110.2	-178.2	-178.7	179.3	-174.3	173.6	0	107	D262 I441 S442 T544	D262-K519 IonicContact OD2-NZ 2.65Å; I441-K519 CarbonylContact C-O 3.4Å; I441-K519 WeakPolarHBondContact CA-O 3.48Å; S442-K519 PolarHBondContact N-O 2.82Å; S442-K519 PolarHBondContact O-N 3.06Å; K519-T544 HydrophobicContact CG-CG2 3.84Å
520	I	81.2	Confident	74.1	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	124.6	-173.7	-56.1	151.6	0	0	0	108.6	F411 I423 L439 I441 I509 T544 I545 C547 Q1171	F411-I520 HydrophobicContact CE1-CG2 4.44Å; F411-I520 HydrophobicContact CZ-CG2 3.87Å; I423-I520 HydrophobicContact CD1-CG2 4.28Å; I423-I520 HydrophobicContact CG2-CD1 3.85Å; I423-I520 HydrophobicContact CG2-CG2 4.27Å; L439-I520 HydrophobicContact CD1-CG2 4.19Å; L439-I520 HydrophobicContact CD2-CG2 3.95Å; L439-I520 HydrophobicContact CG-CG2 4.14Å; I441-I520 HydrophobicContact CG1-CG1 4.38Å; I441-I520 HydrophobicContact CG1-CG2 4.26Å; I441-I520 HydrophobicContact CG2-CB 4.37Å; I441-I520 HydrophobicContact CG2-CG1 3.57Å; I509-I520 HydrophobicContact CD1-CB 4.38Å; I509-I520 HydrophobicContact CD1-CD1 3.85Å; I509-I520 HydrophobicContact CD1-CG1 3.92Å; I509-I520 HydrophobicContact CD1-CG2 3.5Å; I520-T544 CarbonylContact O-C 3.57Å; I520-T544 VanDerWaalsContact O-CA 3.24Å; I520-T544 WeakPolarHBondContact O-CA 3.41Å; I520-I545 HydrophobicContact CB-CG1 4.09Å; I520-I545 HydrophobicContact CD1-CG1 4.37Å; I520-I545 PolarHBondContact N-O 2.76Å; I520-I545 PolarHBondContact O-N 3.2Å; I520-C547 HydrophobicContact CD1-CB 3.81Å; I520-C547 VanDerWaalsContact CD1-SG 3.53Å; I520-Q1171 HydrophobicContact CD1-CG 4.28Å
521	T	80.6	Confident	72.6	Confident	23 Å²	23	35.2 Å²	35.2	14%	0.141	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	139.2	-177	-57.1	0	0	0	0	110.4	L439 Q440 P542 V543 T544	L439-T521 CarbonylContact C-O 3.53Å; L439-T521 VanDerWaalsContact CA-O 3.23Å; L439-T521 WeakPolarHBondContact CA-O 3.22Å; L439-T521 VanDerWaalsContact CD1-O 3.29Å; L439-T521 WeakPolarHBondContact CD1-O 3.36Å; L439-T521 VanDerWaalsContact CG-O 3.3Å; L439-T521 WeakPolarHBondContact CG-O 3.31Å; Q440-T521 PolarHBondContact N-O 2.75Å; Q440-T521 WeakPolarHBondContact O-CB 3.36Å; Q440-T521 PolarHBondContact O-N 2.92Å; T521-P542 HydrophobicContact CG2-CB 3.54Å; T521-V543 CarbonylContact C-O 3.52Å; T521-V543 VanDerWaalsContact CA-O 3.25Å; T521-V543 WeakPolarHBondContact CA-O 3.32Å; T521-T544 WeakPolarHBondContact CG2-OG1 3.49Å; T521-T544 WeakPolarHBondContact OG1-CG2 3.34Å; T521-T544 PolarHBondContact OG1-OG1 3.48Å
522	I	80.2	Confident	71	Confident	1 Å²	1	43 Å²	43	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	128.8	178.5	-170.2	170.2	0	0	0	112.2	V408 F411 W425 Q438 L439 P542 V543	V408-I522 HydrophobicContact CB-CG2 4.48Å; V408-I522 HydrophobicContact CG1-CD1 4.3Å; V408-I522 HydrophobicContact CG1-CG1 4.43Å; V408-I522 HydrophobicContact CG1-CG2 4.38Å; V408-I522 HydrophobicContact CG2-CG2 3.35Å; F411-I522 HydrophobicContact CD1-CG2 3.61Å; F411-I522 HydrophobicContact CD2-CG2 4.04Å; F411-I522 HydrophobicContact CE1-CB 4.08Å; F411-I522 HydrophobicContact CE1-CG2 3.44Å; F411-I522 VanDerWaalsContact CE1-CG2 3.44Å; F411-I522 HydrophobicContact CE2-CB 4.33Å; F411-I522 HydrophobicContact CE2-CG2 3.83Å; F411-I522 HydrophobicContact CG-CG2 3.91Å; F411-I522 HydrophobicContact CZ-CB 3.86Å; F411-I522 HydrophobicContact CZ-CG2 3.54Å; W425-I522 HydrophobicContact CD2-CD1 3.61Å; W425-I522 HydrophobicContact CE3-CD1 4.04Å; W425-I522 HydrophobicContact CG-CD1 4.16Å; W425-I522 HydrophobicContact CH2-CD1 3.93Å; W425-I522 HydrophobicContact CZ2-CD1 3.45Å; W425-I522 VanDerWaalsContact CZ2-CD1 3.45Å; W425-I522 HydrophobicContact CZ3-CD1 4.21Å; Q438-I522 CarbonylContact O-C 3.45Å; Q438-I522 WeakPolarHBondContact O-CA 3.39Å; L439-I522 HydrophobicContact CD1-CB 3.48Å; L439-I522 VanDerWaalsContact CD1-CB 3.48Å; L439-I522 HydrophobicContact CD1-CD1 3.96Å; L439-I522 HydrophobicContact CD1-CG1 3.71Å; I522-P542 CarbonylContact O-C 3.58Å; I522-P542 WeakPolarHBondContact O-CA 3.35Å; I522-V543 HydrophobicContact CG2-CB 4.16Å; I522-V543 PolarHBondContact N-O 3.09Å; I522-V543 PolarHBondContact O-N 3.37Å
523	R	81.6	Confident	69.1	Low	55 Å²	55	47 Å²	47	21%	0.208	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	118.3	-172.7	176.7	-162.6	-85.9	129.4	-11.4	110.9	Y437 Q438 E539 G540 P542	Y437-R523 CarbonylContact C-O 3.48Å; Y437-R523 WeakPolarHBondContact CA-O 3.32Å; Q438-R523 HydrophobicContact CB-CB 4.34Å; Q438-R523 PolarHBondContact N-O 2.69Å; Q438-R523 PolarHBondContact O-N 3.47Å; R523-E539 WeakPolarHBondContact CD-OE2 3.46Å; R523-E539 IonicContact CZ-OE2 3.41Å; R523-E539 IonicContact NE-OE2 3.6Å; R523-E539 PolarHBondContact NE-OE2 3.38Å; R523-E539 IonicContact NH1-OE2 2.67Å; R523-E539 IonicContact NH2-OE2 3.16Å; R523-E539 PolarHBondContact NH2-OE2 2.83Å; R523-G540 WeakPolarHBondContact CG-O 3.47Å; R523-P542 HydrophobicContact CB-CB 4.15Å
524	P	79.4	Confident	67.1	Low	0 Å²	0	51 Å²	51	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	154.1	168.2	29.2	-32.6	0	0	0	112.2	F406 P428 L434 E436 Y437 Y526 G540 I541	F406-P524 WeakPolarHBondContact O-CG 3.37Å; P428-P524 HydrophobicContact CG-CB 3.95Å; P428-P524 HydrophobicContact CG-CG 4.04Å; L434-P524 HydrophobicContact CD1-CB 3.43Å; L434-P524 VanDerWaalsContact CD1-CB 3.43Å; E436-P524 CarbonylContact O-C 3.52Å; E436-P524 WeakPolarHBondContact O-CA 3.46Å; Y437-P524 HydrophobicContact CD1-CB 3.93Å; Y437-P524 HydrophobicContact CE1-CB 4.08Å; P524-Y526 HydrophobicContact CB-CE2 3.86Å; P524-Y526 HydrophobicContact CG-CE2 4.12Å; P524-G540 WeakPolarHBondContact O-CA 3.38Å; P524-G540 PolarHBondContact O-N 3.4Å; P524-I541 WeakPolarHBondContact CD-O 3.43Å
525	I	76.5	Confident	65.7	Low	10 Å²	10	57.3 Å²	57.3	5%	0.051	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	147.3	-178.9	-63.5	-177.4	0	0	0	109.1	L434 L435 E436 Q438 A537 E539	L434-I525 CarbonylContact C-O 3.49Å; L434-I525 WeakPolarHBondContact CD1-O 3.48Å; L435-I525 WeakPolarHBondContact CA-O 3.25Å; L435-I525 HydrophobicContact CB-CG2 4.43Å; L435-I525 PolarHBondContact N-O 2.99Å; E436-I525 HydrophobicContact CG-CB 3.68Å; E436-I525 HydrophobicContact CG-CD1 3.99Å; E436-I525 HydrophobicContact CG-CG1 4.2Å; E436-I525 HydrophobicContact CG-CG2 4.09Å; E436-I525 PolarHBondContact N-O 3.36Å; E436-I525 PolarHBondContact O-N 3.44Å; Q438-I525 HydrophobicContact CB-CD1 3.91Å; I525-A537 HydrophobicContact CG2-CB 3.97Å; I525-E539 HydrophobicContact CD1-CG 4.49Å; I525-E539 HydrophobicContact CG1-CG 4.36Å
526	Y	72	Confident	64	Low	5 Å²	5	57.2 Å²	57.2	2%	0.02	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	153.5	-167.6	-60.2	-99.8	0	0	0	114.6	I399 F406 N433 L434 P524 A537 K538 L845	I399-Y526 HydrophobicContact CD1-CD2 3.95Å; F406-Y526 WeakPolarHBondContact CA-OH 3.46Å; F406-Y526 HydrophobicContact CB-CE2 4.32Å; F406-Y526 HydrophobicContact CD1-CD1 4.21Å; F406-Y526 HydrophobicContact CD1-CD2 4.21Å; F406-Y526 AromaticContact CD1-CE1 3.7Å; F406-Y526 HydrophobicContact CD1-CE1 3.7Å; F406-Y526 AromaticContact CD1-CE2 3.73Å; F406-Y526 HydrophobicContact CD1-CE2 3.73Å; F406-Y526 HydrophobicContact CD1-CG 4.46Å; F406-Y526 AromaticContact CD1-CZ 3.45Å; F406-Y526 VanDerWaalsContact CD1-CZ 3.45Å; F406-Y526 HydrophobicContact CE1-CD1 4.22Å; F406-Y526 AromaticContact CE1-CE1 3.93Å; F406-Y526 HydrophobicContact CE1-CE1 3.93Å; N433-Y526 CarbonylContact O-C 2.93Å; N433-Y526 WeakPolarHBondContact O-CA 3.49Å; L434-Y526 HydrophobicContact CB-CD1 4Å; L434-Y526 HydrophobicContact CB-CE1 3.79Å; L434-Y526 HydrophobicContact CD1-CD1 4.04Å; L434-Y526 HydrophobicContact CD1-CD2 4.31Å; L434-Y526 HydrophobicContact CD1-CE1 3.51Å; L434-Y526 HydrophobicContact CD1-CE2 3.8Å; L434-Y526 HydrophobicContact CD1-CG 4.4Å; L434-Y526 HydrophobicContact CG-CE1 4.23Å; P524-Y526 HydrophobicContact CB-CE2 3.86Å; P524-Y526 HydrophobicContact CG-CE2 4.12Å; Y526-A537 CarbonylContact O-C 3.52Å; Y526-A537 WeakPolarHBondContact O-CA 3.35Å; Y526-K538 PolarHBondContact N-O 3.18Å; Y526-K538 PolarHBondContact O-N 3.29Å; Y526-L845 HydrophobicContact CD1-CD1 4.34Å
527	R	61.7	Low	63.1	Low	61 Å²	61	60.1 Å²	60.1	23%	0.23	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	121	-174.8	-171.2	-169.4	-77.3	-103	5.8	113.4	N433 L435 D469 L845	N433-R527 HydrophobicContact CB-CB 3.98Å; N433-R527 PolarHBondContact ND2-O 2.74Å; N433-R527 PolarHBondContact O-N 2.83Å; L435-R527 HydrophobicContact CD1-CB 4Å; L435-R527 HydrophobicContact CD2-CB 3.88Å; L435-R527 HydrophobicContact CD2-CG 4.29Å; L435-R527 HydrophobicContact CG-CB 3.72Å; D469-R527 IonicContact OD2-CZ 3.56Å; D469-R527 IonicContact OD2-NE 3.5Å; D469-R527 PolarHBondContact OD2-NE 2.87Å; D469-R527 IonicContact OD2-NH2 2.76Å; D469-R527 PolarHBondContact OD2-NH2 2.91Å; R527-L845 WeakPolarHBondContact O-CD2 3.42Å
528	A	57.8	Low	62.3	Low	25 Å²	25	62.5 Å²	62.5	21%	0.207	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	144.5	171.9	0	0	0	0	0	112.8	G536	A528-G536 CarbonylContact C-O 3.57Å; A528-G536 WeakPolarHBondContact CA-O 3.11Å; A528-G536 PolarHBondContact N-O 3.4Å; A528-G536 PolarHBondContact O-N 2.94Å
529	L	47.9	Very low	62.1	Low	65 Å²	65	67.4 Å²	67.4	34%	0.34	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	157.4	150.1	-74.5	81.3	0	0	0	107.9	R848	L529-R848 HydrophobicContact CD1-CB 4Å; L529-R848 HydrophobicContact CD1-CG 3.8Å; L529-R848 PolarHBondContact O-NH1 3.38Å; L529-R848 PolarHBondContact O-NH2 2.63Å
530	I	47.4	Very low	61.4	Low	113 Å²	113	62.9 Å²	62.9	58%	0.579	36%	0.359	S	S	*	.			trans	-127.6	170.7	148.5	-61.6	-175.2	0	0	0	105.6	F396	F396-I530 HydrophobicContact CE1-CD1 4.26Å; F396-I530 HydrophobicContact CE1-CG1 4.16Å; F396-I530 HydrophobicContact CZ-CG1 4.21Å
531	T	40.7	Very low	61.1	Low	125 Å²	125	65.5 Å²	65.5	77%	0.767	37%	0.372	S	S	*	.	S	Bend	trans	-59.1	146	175.9	39.5	0	0	0	0	112
532	E	39.4	Very low	61	Low	187 Å²	187	67.2 Å²	67.2	87%	0.874	38%	0.384	S	S	*	.	S	Bend	trans	63.8	101.1	171.7	-58.7	-174.2	-178.6	0	0	117	N534	E532-N534 PolarHBondContact O-N 3.08Å
533	G	38	Very low	60.7	Low	83 Å²	83	69 Å²	69	86%	0.856	40%	0.395	S	S	*	.	S	Bend	trans	92.1	-61.8	156.9	0	0	0	0	0	116.7
534	N	39	Very low	60.5	Low	146 Å²	146	69.3 Å²	69.3	78%	0.781	40%	0.403	S	S	*	.			trans	-101.9	142.1	-162.8	-72.4	-31.5	0	0	0	114.8	E532	E532-N534 PolarHBondContact O-N 3.08Å
535	I	47.2	Very low	60.5	Low	136 Å²	136	70 Å²	70	70%	0.697	41%	0.406	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.3	130.8	174.3	-55.8	174.7	0	0	0	108.6
536	G	48.3	Very low	60.7	Low	33 Å²	33	71.1 Å²	71.1	34%	0.34	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	151.7	-177.5	0	0	0	0	0	113.8	A528	A528-G536 CarbonylContact C-O 3.57Å; A528-G536 WeakPolarHBondContact CA-O 3.11Å; A528-G536 PolarHBondContact N-O 3.4Å; A528-G536 PolarHBondContact O-N 2.94Å
537	A	62.3	Low	60.8	Low	68 Å²	68	70.9 Å²	70.9	56%	0.562	41%	0.411	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.7	158.3	166.3	0	0	0	0	0	110.4	L435 I525 Y526	L435-A537 HydrophobicContact CD1-CB 3.88Å; I525-A537 HydrophobicContact CG2-CB 3.97Å; Y526-A537 CarbonylContact O-C 3.52Å; Y526-A537 WeakPolarHBondContact O-CA 3.35Å
538	K	66.2	Low	61.8	Low	71 Å²	71	70.3 Å²	70.3	31%	0.309	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	124.1	176.3	-169.2	176.5	177.6	158.2	0	110.3	M397 D398 I399 Y526	M397-K538 PolarHBondContact O-NZ 2.88Å; D398-K538 IonicContact OD1-NZ 2.76Å; D398-K538 PolarHBondContact OD1-NZ 2.82Å; I399-K538 HydrophobicContact CD1-CB 4.4Å; I399-K538 HydrophobicContact CD1-CD 3.9Å; I399-K538 HydrophobicContact CD1-CG 3.82Å; I399-K538 HydrophobicContact CG1-CD 4.33Å; Y526-K538 PolarHBondContact N-O 3.18Å; Y526-K538 PolarHBondContact O-N 3.29Å
539	E	74.3	Confident	62.7	Low	107 Å²	107	70 Å²	70	50%	0.5	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	138.1	-177.9	-69.6	179.7	-147.4	0	0	112.9	I399 R523 I525	I399-E539 WeakPolarHBondContact CD1-O 3.23Å; R523-E539 WeakPolarHBondContact CD-OE2 3.46Å; R523-E539 IonicContact CZ-OE2 3.41Å; R523-E539 IonicContact NE-OE2 3.6Å; R523-E539 PolarHBondContact NE-OE2 3.38Å; R523-E539 IonicContact NH1-OE2 2.67Å; R523-E539 IonicContact NH2-OE2 3.16Å; R523-E539 PolarHBondContact NH2-OE2 2.83Å; I525-E539 HydrophobicContact CD1-CG 4.49Å; I525-E539 HydrophobicContact CG1-CG 4.36Å
540	G	67.4	Low	64.3	Low	7 Å²	7	68.8 Å²	68.8	7%	0.072	40%	0.399	C	S	.	.			trans	-92.5	-160.9	162.7	0	0	0	0	0	112	R523 P524	R523-G540 WeakPolarHBondContact CG-O 3.47Å; P524-G540 WeakPolarHBondContact O-CA 3.38Å; P524-G540 PolarHBondContact O-N 3.4Å
541	I	76.1	Confident	66	Low	55 Å²	55	65.9 Å²	65.9	28%	0.282	38%	0.381	S	S	.	.	B	Isolated β-bridge	trans	-103.4	124.1	-160.4	-69.6	170.6	0	0	0	112.8	P403 F406 T407 P524	P403-I541 HydrophobicContact CB-CD1 3.14Å; F406-I541 PolarHBondContact O-N 3.48Å; T407-I541 PolarHBondContact OG1-O 3.34Å; P524-I541 WeakPolarHBondContact CD-O 3.43Å
542	P	78.6	Confident	67.8	Low	59 Å²	59	60 Å²	60	38%	0.383	35%	0.345	S	S	.	.			trans	-70.8	140.5	-179.7	27.3	-33.3	0	0	0	113.5	T521 I522 R523	T521-P542 HydrophobicContact CG2-CB 3.54Å; I522-P542 CarbonylContact O-C 3.58Å; I522-P542 WeakPolarHBondContact O-CA 3.35Å; R523-P542 HydrophobicContact CB-CB 4.15Å
543	V	72.5	Confident	69.7	Low	38 Å²	38	51 Å²	51	23%	0.23	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	133.4	170.1	-167.7	0	0	0	0	109.2	T407 V408 F411 T521 I522	T407-V543 WeakPolarHBondContact OG1-CG2 3.36Å; V408-V543 HydrophobicContact CG2-CB 4.03Å; V408-V543 HydrophobicContact CG2-CG2 3.66Å; F411-V543 HydrophobicContact CB-CB 4.4Å; F411-V543 HydrophobicContact CB-CG1 3.88Å; F411-V543 HydrophobicContact CD1-CB 3.99Å; F411-V543 HydrophobicContact CD1-CG1 3.91Å; F411-V543 WeakPolarHBondContact CD1-O 3.41Å; F411-V543 VanDerWaalsContact CE1-O 3.26Å; F411-V543 WeakPolarHBondContact CE1-O 3.16Å; F411-V543 HydrophobicContact CG-CG1 4.39Å; T521-V543 CarbonylContact C-O 3.52Å; T521-V543 VanDerWaalsContact CA-O 3.25Å; T521-V543 WeakPolarHBondContact CA-O 3.32Å; I522-V543 HydrophobicContact CG2-CB 4.16Å; I522-V543 PolarHBondContact N-O 3.09Å; I522-V543 PolarHBondContact O-N 3.37Å
544	T	78.4	Confident	71.8	Confident	62 Å²	62	47.1 Å²	47.1	38%	0.38	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	139.4	-176.2	-53.6	0	0	0	0	112.5	K519 I520 T521	K519-T544 HydrophobicContact CG-CG2 3.84Å; I520-T544 CarbonylContact O-C 3.57Å; I520-T544 VanDerWaalsContact O-CA 3.24Å; I520-T544 WeakPolarHBondContact O-CA 3.41Å; T521-T544 WeakPolarHBondContact CG2-OG1 3.49Å; T521-T544 WeakPolarHBondContact OG1-CG2 3.34Å; T521-T544 PolarHBondContact OG1-OG1 3.48Å
545	I	79.9	Confident	73.4	Confident	14 Å²	14	42.8 Å²	42.8	7%	0.072	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	159.9	169.4	65.5	172.9	0	0	0	111.4	F411 K412 C413 I423 I520	F411-I545 HydrophobicContact CB-CG2 4.47Å; F411-I545 HydrophobicContact CD1-CB 4.46Å; F411-I545 HydrophobicContact CD1-CG1 4.23Å; F411-I545 HydrophobicContact CD1-CG2 3.67Å; F411-I545 HydrophobicContact CE1-CD1 4.32Å; F411-I545 HydrophobicContact CE1-CG1 3.88Å; F411-I545 HydrophobicContact CE1-CG2 4.18Å; F411-I545 HydrophobicContact CE2-CD1 4.45Å; F411-I545 HydrophobicContact CG-CG2 4.12Å; F411-I545 HydrophobicContact CZ-CD1 4.31Å; F411-I545 HydrophobicContact CZ-CG1 4.24Å; F411-I545 WeakPolarHBondContact O-CG2 3.44Å; K412-I545 VanDerWaalsContact C-CD1 3.46Å; C413-I545 HydrophobicContact CB-CD1 4.07Å; I423-I545 HydrophobicContact CB-CD1 4.42Å; I423-I545 HydrophobicContact CG2-CD1 3.55Å; I423-I545 HydrophobicContact CG2-CG1 4.5Å; I520-I545 HydrophobicContact CB-CG1 4.09Å; I520-I545 HydrophobicContact CD1-CG1 4.37Å; I520-I545 PolarHBondContact N-O 2.76Å; I520-I545 PolarHBondContact O-N 3.2Å
546	I	79.2	Confident	74.6	Confident	33 Å²	33	41.2 Å²	41.2	17%	0.169	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	131.7	172.3	-66.7	172.8	0	0	0	108.8	D177 Q517 Y518	D177-I546 VanDerWaalsContact OD1-CD1 3.3Å; D177-I546 WeakPolarHBondContact OD1-CD1 3.39Å; Q517-I546 HydrophobicContact CG-CG2 3.67Å; Q517-I546 VanDerWaalsContact NE2-CG2 3.34Å; Y518-I546 WeakPolarHBondContact O-CA 3.35Å
547	C	74.2	Confident	76.3	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	137.3	176	-74.9	0	0	0	0	109.8	C413 I421 Y518 I520	C413-C547 HydrophobicContact CB-CB 4.46Å; C413-C547 WeakPolarHBondContact CB-SG 3.19Å; C413-C547 WeakPolarHBondContact SG-CB 2.88Å; C413-C547 CovalentContact SG-SG 2.04Å; C413-C547 PolarHBondContact SG-SG 2.79Å; I421-C547 HydrophobicContact CD1-CB 3.94Å; I421-C547 HydrophobicContact CG2-CB 4.14Å; Y518-C547 PolarHBondContact N-O 2.74Å; Y518-C547 PolarHBondContact O-N 3.36Å; I520-C547 HydrophobicContact CD1-CB 3.81Å; I520-C547 VanDerWaalsContact CD1-SG 3.53Å
548	H	82.2	Confident	77.3	Confident	49 Å²	49	41.3 Å²	41.3	23%	0.227	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	153.7	176.2	-71.3	89.3	0	0	0	110.3	S176 I421 S516 Q517	S176-H548 PolarHBondContact O-CE1 2.87Å; I421-H548 WeakPolarHBondContact CD1-O 3.45Å; S516-H548 WeakPolarHBondContact O-CA 2.8Å; Q517-H548 WeakPolarHBondContact CG-NE2 3.42Å
549	T	78.4	Confident	78	Confident	20 Å²	20	40.9 Å²	40.9	12%	0.123	21%	0.205	C	C	.	.	P	Polyproline II helix	trans	-80.6	171.9	172.1	63.4	0	0	0	0	113.4	T417 M418 L512 K513 N515 S516	T417-T549 WeakPolarHBondContact O-CA 3.22Å; M418-T549 HydrophobicContact CB-CG2 4.31Å; M418-T549 WeakPolarHBondContact O-CG2 3.38Å; L512-T549 HydrophobicContact CB-CG2 3.17Å; L512-T549 HydrophobicContact CD1-CG2 3.24Å; L512-T549 HydrophobicContact CG-CG2 3.31Å; K513-T549 WeakPolarHBondContact O-CG2 3.47Å; N515-T549 WeakPolarHBondContact CA-OG1 3.22Å; N515-T549 PolarHBondContact N-OG1 2.94Å; S516-T549 PolarHBondContact N-OG1 3.24Å; S516-T549 PolarHBondContact O-N 2.9Å
550	E	80.4	Confident	78.5	Confident	39 Å²	39	35.9 Å²	35.9	18%	0.182	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-88.5	164.9	149.4	-62.2	-169.4	138.9	0	0	109.7	R54 R416 Y771	R54-E550 IonicContact NH2-OE1 2.79Å; R54-E550 PolarHBondContact NH2-OE1 2.94Å; R54-E550 VanDerWaalsContact NH2-OE1 3.12Å; R416-E550 WeakPolarHBondContact O-CG 3.48Å; E550-Y771 HydrophobicContact CB-CE1 4.34Å; E550-Y771 WeakPolarHBondContact CB-OH 3.32Å
551	W	84	Confident	79.2	Confident	51 Å²	51	38.4 Å²	38.4	19%	0.193	19%	0.192	C	C	.	.	P	Polyproline II helix	trans	-77.5	168.9	178.2	-53.9	-35.1	0	0	0	111.7	N515 N590 P592 Y771 L777	N515-W551 PolarHBondContact OD1-NE1 2.74Å; W551-N590 CarbonylContact C-O 3.19Å; W551-N590 WeakPolarHBondContact CA-O 3.33Å; W551-N590 WeakPolarHBondContact CB-O 3.21Å; W551-P592 HydrophobicContact CD2-CG 4.3Å; W551-P592 HydrophobicContact CE3-CG 4.4Å; W551-P592 HydrophobicContact CH2-CG 3.83Å; W551-P592 HydrophobicContact CZ2-CG 3.7Å; W551-P592 HydrophobicContact CZ3-CG 4.16Å; W551-Y771 WeakPolarHBondContact CA-OH 3.18Å; W551-Y771 HydrophobicContact CB-CE1 4.18Å; W551-Y771 HydrophobicContact CD2-CD1 4.19Å; W551-Y771 AromaticContact CD2-CE1 3.86Å; W551-Y771 HydrophobicContact CD2-CE1 3.86Å; W551-Y771 AromaticContact CE3-CD1 3.56Å; W551-Y771 HydrophobicContact CE3-CD1 3.56Å; W551-Y771 AromaticContact CE3-CE1 3.63Å; W551-Y771 HydrophobicContact CE3-CE1 3.63Å; W551-Y771 HydrophobicContact CE3-CG 4.05Å; W551-Y771 HydrophobicContact CG-CE1 4.13Å; W551-Y771 AromaticContact CZ3-CD1 3.83Å; W551-Y771 HydrophobicContact CZ3-CD1 3.83Å; W551-Y771 HydrophobicContact CZ3-CE1 4.34Å; W551-Y771 HydrophobicContact CZ3-CG 4.23Å; W551-Y771 PolarHBondContact N-OH 3Å; W551-Y771 PolarHBondContact O-OH 3.41Å; W551-L777 VanDerWaalsContact C-CD1 3.45Å; W551-L777 HydrophobicContact CB-CD1 3.73Å; W551-L777 WeakPolarHBondContact O-CD1 3.49Å
552	S	78.3	Confident	79.3	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.007	20%	0.198	C	C	.	.			trans	-131.2	178.5	173.4	83.4	0	0	0	0	112	M418 P514 N590	M418-S552 WeakPolarHBondContact SD-CB 3.35Å; P514-S552 WeakPolarHBondContact CB-OG 3.39Å; P514-S552 WeakPolarHBondContact CG-OG 3.04Å; S552-N590 PolarHBondContact N-O 2.98Å; S552-N590 WeakPolarHBondContact OG-CB 3.38Å; S552-N590 PolarHBondContact OG-ND2 3.32Å; S552-N590 PolarHBondContact OG-OD1 3.09Å
553	A	78.8	Confident	79.3	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.2	C	C	.	.			trans	-67.9	137.2	-178.1	0	0	0	0	0	110.6	E555 N590 L777 S779 F1145 Q1176	A553-E555 PolarHBondContact O-N 2.91Å; A553-E555 VanDerWaalsContact O-N 3.11Å; A553-N590 PolarHBondContact O-ND2 2.85Å; A553-L777 HydrophobicContact CB-CD2 4.43Å; A553-S779 WeakPolarHBondContact CB-OG 3.11Å; A553-F1145 HydrophobicContact CB-CE2 4.25Å; A553-Q1176 WeakPolarHBondContact CB-O 3.31Å
554	P	81.4	Confident	79.3	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.006	20%	0.198	C	C	.	.			trans	-58.4	115.6	-179.3	-25.9	34.6	0	0	0	112.3	V586 I593 L777 S779	P554-V586 HydrophobicContact CB-CG1 3.56Å; P554-I593 HydrophobicContact CB-CD1 3.69Å; P554-I593 HydrophobicContact CG-CD1 3.51Å; P554-L777 VanDerWaalsContact CD-O 3.32Å; P554-L777 WeakPolarHBondContact CD-O 3.26Å; P554-S779 WeakPolarHBondContact O-CB 3.33Å; P554-S779 PolarHBondContact O-OG 2.88Å
555	E	73.1	Confident	79	Confident	55 Å²	55	39.8 Å²	39.8	26%	0.257	19%	0.194	S	C	.	.			trans	-73.3	151	-178.6	-87.6	170	112.3	0	0	112.2	A553 N590 Q1176 N1180	A553-E555 PolarHBondContact O-N 2.91Å; A553-E555 VanDerWaalsContact O-N 3.11Å; E555-N590 VanDerWaalsContact CG-ND2 3.29Å; E555-N590 WeakPolarHBondContact CG-ND2 3.34Å; E555-N590 PolarHBondContact OE2-ND2 2.83Å; E555-N590 PolarHBondContact OE2-OD1 3.29Å; E555-Q1176 PolarHBondContact OE1-OE1 3.05Å; E555-Q1176 VanDerWaalsContact OE1-OE1 3.13Å; E555-N1180 WeakPolarHBondContact CG-ND2 3.47Å; E555-N1180 PolarHBondContact OE1-ND2 3.41Å
556	H	73.9	Confident	78.7	Confident	102 Å²	102	44.9 Å²	44.9	47%	0.472	21%	0.213	S	C	.	.			trans	51.1	74.8	175.4	-55.4	-87.4	0	0	0	116.8	N1180 N1181	H556-N1180 VanDerWaalsContact CE1-CB 3.42Å; H556-N1180 WeakPolarHBondContact CE1-CB 3.3Å; H556-N1180 PolarHBondContact NE2-ND2 2.94Å; H556-N1181 PolarHBondContact ND1-ND2 2.87Å; H556-N1181 VanDerWaalsContact ND1-ND2 3.1Å
557	I	82.9	Confident	78	Confident	3 Å²	3	47.1 Å²	47.1	2%	0.015	24%	0.237	C	C	.	.	P	Polyproline II helix	trans	-86.5	116.8	166.8	-46.3	-162.2	0	0	0	110.5	V586 L765 A767 S779 S781	I557-V586 HydrophobicContact CB-CG2 4.22Å; I557-V586 HydrophobicContact CD1-CG2 3.96Å; I557-V586 HydrophobicContact CG1-CG1 4.25Å; I557-V586 HydrophobicContact CG1-CG2 3.74Å; I557-V586 HydrophobicContact CG2-CG2 3.93Å; I557-L765 HydrophobicContact CG2-CB 4.42Å; I557-L765 HydrophobicContact CG2-CD2 3.84Å; I557-L765 HydrophobicContact CG2-CG 4.1Å; I557-A767 HydrophobicContact CD1-CB 3.42Å; I557-A767 VanDerWaalsContact CD1-CB 3.42Å; I557-S779 VanDerWaalsContact CD1-C 3.41Å; I557-S779 WeakPolarHBondContact CD1-O 3.33Å; I557-S781 WeakPolarHBondContact O-CB 3.34Å
558	K	82.7	Confident	77.6	Confident	100 Å²	100	48.2 Å²	48.2	44%	0.435	25%	0.248	S	C	.	.	P	Polyproline II helix	trans	-68.7	142.1	175.6	-174.4	172.4	168.4	-161.1	0	111.6	E561 H584 S781	K558-E561 WeakPolarHBondContact CE-OE1 3.12Å; K558-E561 IonicContact NZ-OE1 2.74Å; K558-E561 PolarHBondContact NZ-OE1 3.49Å; K558-H584 HydrophobicContact CB-CB 4.26Å; K558-H584 PolarHBondContact NZ-CE1 2.87Å; K558-H584 VanDerWaalsContact NZ-CE1 3.28Å; K558-H584 PolarHBondContact NZ-NE2 3.05Å; K558-S781 WeakPolarHBondContact O-CB 3.2Å
559	Q	82.3	Confident	76.9	Confident	63 Å²	63	47.7 Å²	47.7	29%	0.294	25%	0.249	S	C	.	.	P	Polyproline II helix	trans	-64.9	156.1	-178.7	78.1	-171.6	40.7	0	0	113.1	Q782	Q559-Q782 HydrophobicContact CB-CB 4.44Å
560	P	85	Confident	76.2	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.013	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-72.4	130.8	178.4	-9.7	27.8	0	0	0	110.3	I581 K582 L583 V763 L765	P560-I581 HydrophobicContact CB-CG2 3.32Å; P560-K582 WeakPolarHBondContact CA-O 3.39Å; P560-L583 HydrophobicContact CB-CD2 4.13Å; P560-V763 HydrophobicContact CG-CG1 4.46Å; P560-L765 HydrophobicContact CG-CB 4.22Å
561	E	80.4	Confident	75.3	Confident	60 Å²	60	52 Å²	52	28%	0.28	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	125.6	179.5	-70.6	171.4	-176.3	0	0	110	K558 I581 K582 H584	K558-E561 WeakPolarHBondContact CE-OE1 3.12Å; K558-E561 IonicContact NZ-OE1 2.74Å; K558-E561 PolarHBondContact NZ-OE1 3.49Å; E561-I581 CarbonylContact O-C 3.58Å; E561-I581 WeakPolarHBondContact O-CA 3.43Å; E561-K582 HydrophobicContact CB-CB 4.25Å; E561-K582 PolarHBondContact N-O 2.93Å; E561-K582 PolarHBondContact O-N 2.79Å; E561-K582 IonicContact OE1-NZ 3.74Å; E561-K582 WeakPolarHBondContact OE2-CD 3.38Å; E561-K582 WeakPolarHBondContact OE2-CE 3.39Å; E561-K582 IonicContact OE2-NZ 3.56Å; E561-K582 PolarHBondContact OE2-NZ 2.9Å; E561-H584 IonicContact OE1-CE1 3.97Å; E561-H584 PolarHBondContact OE1-CE1 3.34Å; E561-H584 IonicContact OE1-NE2 3.46Å; E561-H584 IonicContact OE2-CE1 3.35Å
562	L	79.9	Confident	74.4	Confident	78 Å²	78	56.3 Å²	56.3	41%	0.408	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	131	175	174.9	64.3	0	0	0	110.6	I565 I579 I787	L562-I565 HydrophobicContact CD1-CG1 4.22Å; L562-I565 HydrophobicContact CD2-CD1 4.38Å; L562-I579 HydrophobicContact CD1-CG2 3.41Å; L562-I579 VanDerWaalsContact CD1-CG2 3.41Å; L562-I787 HydrophobicContact CD1-CD1 4.35Å; L562-I787 HydrophobicContact CD1-CG2 4.43Å; L562-I787 HydrophobicContact CD2-CG2 4.33Å
563	L	77.1	Confident	73.7	Confident	83 Å²	83	63.3 Å²	63.3	44%	0.435	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	-46.4	177.6	-63.9	178.8	0	0	0	112.8	E580 K582 V669	L563-E580 HydrophobicContact CB-CB 4.05Å; L563-E580 HydrophobicContact CB-CG 3.94Å; L563-E580 HydrophobicContact CD1-CG 3.95Å; L563-E580 PolarHBondContact N-O 3.41Å; L563-K582 HydrophobicContact CD1-CB 4.03Å; L563-K582 HydrophobicContact CD2-CB 4.3Å; L563-K582 HydrophobicContact CG-CB 4.19Å; L563-V669 HydrophobicContact CD1-CG1 3.79Å; L563-V669 HydrophobicContact CD1-CG2 4.19Å
564	A	73.2	Confident	73.1	Confident	22 Å²	22	64.3 Å²	64.3	18%	0.182	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	164.2	-175.8	0	0	0	0	0	113.6	Y566 I579 E580	A564-Y566 HydrophobicContact CB-CE1 4.33Å; A564-Y566 HydrophobicContact CB-CE2 3.8Å; A564-Y566 WeakPolarHBondContact CB-OH 3.2Å; A564-I579 CarbonylContact O-C 3.48Å; A564-I579 WeakPolarHBondContact O-CA 3.39Å; A564-E580 HydrophobicContact CB-CB 3.97Å; A564-E580 PolarHBondContact N-O 2.69Å; A564-E580 PolarHBondContact O-N 2.93Å
565	I	72	Confident	72.5	Confident	59 Å²	59	68 Å²	68	30%	0.303	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	138.4	171.4	-52	174.5	0	0	0	108.5	L562 I578 I787	L562-I565 HydrophobicContact CD1-CG1 4.22Å; L562-I565 HydrophobicContact CD2-CD1 4.38Å; I565-I578 CarbonylContact C-O 3.44Å; I565-I578 VanDerWaalsContact CA-O 3.3Å; I565-I578 WeakPolarHBondContact CA-O 3.39Å; I565-I578 WeakPolarHBondContact CG2-O 3.41Å; I565-I787 HydrophobicContact CD1-CG2 3.56Å; I565-I787 HydrophobicContact CG1-CG2 4.1Å
566	Y	73.6	Confident	72.4	Confident	122 Å²	122	65.5 Å²	65.5	48%	0.478	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	168.1	177.7	-40.4	-92.3	0	0	0	111.5	A564 S577 I578 E580	A564-Y566 HydrophobicContact CB-CE1 4.33Å; A564-Y566 HydrophobicContact CB-CE2 3.8Å; A564-Y566 WeakPolarHBondContact CB-OH 3.2Å; Y566-S577 CarbonylContact O-C 3.58Å; Y566-S577 VanDerWaalsContact O-CA 3.23Å; Y566-S577 WeakPolarHBondContact O-CA 3.47Å; Y566-S577 VanDerWaalsContact O-CB 3.26Å; Y566-S577 WeakPolarHBondContact O-CB 3.47Å; Y566-S577 PolarHBondContact O-OG 3.26Å; Y566-I578 HydrophobicContact CD2-CB 4.16Å; Y566-I578 HydrophobicContact CD2-CG2 3.88Å; Y566-I578 PolarHBondContact N-O 2.83Å; Y566-I578 PolarHBondContact O-N 2.83Å; Y566-E580 HydrophobicContact CE2-CB 4.48Å
567	A	65.3	Low	72.4	Confident	80 Å²	80	60.7 Å²	60.7	66%	0.661	35%	0.347	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.2	142.6	170.5	0	0	0	0	0	110.8
568	G	64.6	Low	72.1	Confident	23 Å²	23	62 Å²	62	24%	0.237	35%	0.354	C	S	.	.			trans	-104.7	179.1	-179.5	0	0	0	0	0	113.8	T576	G568-T576 VanDerWaalsContact CA-OG1 3.24Å; G568-T576 WeakPolarHBondContact CA-OG1 3.17Å; G568-T576 PolarHBondContact N-O 2.75Å; G568-T576 PolarHBondContact O-OG1 3.32Å
569	P	67.8	Low	71.9	Confident	38 Å²	38	57.4 Å²	57.4	25%	0.247	33%	0.334	C	S	.	.			trans	-68.3	150	-178.7	28.7	-35.1	0	0	0	112.8	T576	P569-T576 PolarHBondContact O-OG1 3.08Å
570	P	64.7	Low	71.6	Confident	120 Å²	120	55.8 Å²	55.8	78%	0.779	33%	0.326	S	S	*	.			trans	-64.7	146.2	179.2	27.8	-34.8	0	0	0	112.2	R754	P570-R754 PolarHBondContact O-NH1 3.23Å
571	D	61	Low	71.3	Confident	29 Å²	29	55.8 Å²	55.8	16%	0.155	33%	0.326	C	S	.	.			trans	-139.1	135.9	-178.5	-177.6	-39.3	0	0	0	108.5	Q573 G574 T576 R754 F756	D571-Q573 PolarHBondContact O-N 3.38Å; D571-Q573 WeakPolarHBondContact OD1-CB 3.29Å; D571-Q573 PolarHBondContact OD1-N 2.79Å; D571-G574 PolarHBondContact O-N 2.79Å; D571-T576 HydrophobicContact CB-CG2 4.01Å; D571-R754 WeakPolarHBondContact OD2-CD 3.18Å; D571-F756 HydrophobicContact CB-CE1 4.24Å
572	P	64.4	Low	71.4	Confident	142 Å²	142	55.3 Å²	55.3	92%	0.922	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-11.9	177	25.2	-35.6	0	0	0	114.9
573	Q	63.5	Low	71.6	Confident	147 Å²	147	51.6 Å²	51.6	69%	0.687	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-17.5	174.3	-61.9	179.3	70.7	0	0	114	D571 F756	D571-Q573 PolarHBondContact O-N 3.38Å; D571-Q573 WeakPolarHBondContact OD1-CB 3.29Å; D571-Q573 PolarHBondContact OD1-N 2.79Å; Q573-F756 HydrophobicContact CB-CE1 3.99Å; Q573-F756 HydrophobicContact CB-CZ 3.67Å
574	G	65.7	Low	71.9	Confident	22 Å²	22	48.9 Å²	48.9	23%	0.227	29%	0.289	C	S	.	.			trans	150	174.1	178.7	0	0	0	0	0	115.2	D571	D571-G574 PolarHBondContact O-N 2.79Å
575	P	69.8	Low	72.4	Confident	78 Å²	78	49.8 Å²	49.8	51%	0.506	29%	0.288	S	S	.	.			trans	-74.7	147.5	-178.4	31.9	-36.1	0	0	0	112.8	F756 Q757	P575-F756 WeakPolarHBondContact O-CA 3.5Å; P575-Q757 HydrophobicContact CB-CG 4.39Å; P575-Q757 HydrophobicContact CG-CB 4.37Å; P575-Q757 PolarHBondContact O-N 3.07Å
576	T	71	Confident	72.9	Confident	2 Å²	2	47.3 Å²	47.3	1%	0.012	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	172.2	-168.5	72.2	0	0	0	0	113.7	G568 P569 D571 R754 L755 F756 Q757	G568-T576 VanDerWaalsContact CA-OG1 3.24Å; G568-T576 WeakPolarHBondContact CA-OG1 3.17Å; G568-T576 PolarHBondContact N-O 2.75Å; G568-T576 PolarHBondContact O-OG1 3.32Å; P569-T576 PolarHBondContact O-OG1 3.08Å; D571-T576 HydrophobicContact CB-CG2 4.01Å; T576-R754 HydrophobicContact CG2-CB 4.08Å; T576-L755 CarbonylContact C-O 3.05Å; T576-L755 WeakPolarHBondContact CA-O 3.5Å; T576-F756 HydrophobicContact CG2-CD1 3.94Å; T576-F756 HydrophobicContact CG2-CE1 4.06Å; T576-Q757 PolarHBondContact O-NE2 2.93Å
577	S	74	Confident	73.4	Confident	2 Å²	2	42.9 Å²	42.9	1%	0.014	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	164.8	-176.6	-81.7	0	0	0	0	114.2	Y566 L755 P789	Y566-S577 CarbonylContact O-C 3.58Å; Y566-S577 VanDerWaalsContact O-CA 3.23Å; Y566-S577 WeakPolarHBondContact O-CA 3.47Å; Y566-S577 VanDerWaalsContact O-CB 3.26Å; Y566-S577 WeakPolarHBondContact O-CB 3.47Å; Y566-S577 PolarHBondContact O-OG 3.26Å; S577-L755 PolarHBondContact N-O 2.81Å; S577-L755 WeakPolarHBondContact O-CB 3.33Å; S577-P789 VanDerWaalsContact OG-CB 3.27Å; S577-P789 WeakPolarHBondContact OG-CB 3.38Å
578	I	76.8	Confident	74.4	Confident	31 Å²	31	40.9 Å²	40.9	16%	0.159	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	149.5	-179.8	-61.2	171.8	0	0	0	108.3	I565 Y566 I671 L672	I565-I578 CarbonylContact C-O 3.44Å; I565-I578 VanDerWaalsContact CA-O 3.3Å; I565-I578 WeakPolarHBondContact CA-O 3.39Å; I565-I578 WeakPolarHBondContact CG2-O 3.41Å; Y566-I578 HydrophobicContact CD2-CB 4.16Å; Y566-I578 HydrophobicContact CD2-CG2 3.88Å; Y566-I578 PolarHBondContact N-O 2.83Å; Y566-I578 PolarHBondContact O-N 2.83Å; I578-I671 HydrophobicContact CG2-CG2 3.85Å; I578-L672 CarbonylContact C-O 2.86Å; I578-L672 VanDerWaalsContact CA-O 3.23Å; I578-L672 WeakPolarHBondContact CA-O 3.29Å; I578-L672 WeakPolarHBondContact CG2-O 3.31Å
579	I	77.8	Confident	75.2	Confident	2 Å²	2	42.3 Å²	42.3	1%	0.01	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	143.6	-176.5	-55.3	169.9	0	0	0	110.4	L562 A564 I581 I671 L672 L755 I787	L562-I579 HydrophobicContact CD1-CG2 3.41Å; L562-I579 VanDerWaalsContact CD1-CG2 3.41Å; A564-I579 CarbonylContact O-C 3.48Å; A564-I579 WeakPolarHBondContact O-CA 3.39Å; I579-I581 HydrophobicContact CG2-CD1 4.12Å; I579-I581 HydrophobicContact CG2-CG1 3.91Å; I579-I671 CarbonylContact O-C 3.55Å; I579-I671 WeakPolarHBondContact O-CA 3.16Å; I579-L672 HydrophobicContact CB-CB 4.26Å; I579-L672 PolarHBondContact N-O 2.81Å; I579-L672 PolarHBondContact O-N 3.32Å; I579-L755 HydrophobicContact CD1-CD1 3.42Å; I579-L755 VanDerWaalsContact CD1-CD1 3.42Å; I579-L755 HydrophobicContact CG1-CD1 3.71Å; I579-I787 HydrophobicContact CD1-CB 4.23Å; I579-I787 HydrophobicContact CD1-CD1 3.97Å; I579-I787 HydrophobicContact CD1-CG2 3.71Å; I579-I787 HydrophobicContact CG1-CG2 4.16Å; I579-I787 HydrophobicContact CG2-CD1 4.07Å; I579-I787 HydrophobicContact CG2-CG2 4.45Å
580	E	77.1	Confident	75.6	Confident	30 Å²	30	40.7 Å²	40.7	14%	0.14	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	138.3	172.2	-170.1	-168.4	-168.7	0	0	111.3	L563 A564 Y566 V669 I671	L563-E580 HydrophobicContact CB-CB 4.05Å; L563-E580 HydrophobicContact CB-CG 3.94Å; L563-E580 HydrophobicContact CD1-CG 3.95Å; L563-E580 PolarHBondContact N-O 3.41Å; A564-E580 HydrophobicContact CB-CB 3.97Å; A564-E580 PolarHBondContact N-O 2.69Å; A564-E580 PolarHBondContact O-N 2.93Å; Y566-E580 HydrophobicContact CE2-CB 4.48Å; E580-V669 HydrophobicContact CG-CG1 4.08Å; E580-I671 HydrophobicContact CG-CG1 4.43Å
581	I	78	Confident	76.3	Confident	2 Å²	2	35 Å²	35	1%	0.01	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	143.7	-170.9	-65	-170.6	0	0	0	113.1	P560 E561 I579 L583 V669 I670 L672 V763 I787	P560-I581 HydrophobicContact CB-CG2 3.32Å; E561-I581 CarbonylContact O-C 3.58Å; E561-I581 WeakPolarHBondContact O-CA 3.43Å; I579-I581 HydrophobicContact CG2-CD1 4.12Å; I579-I581 HydrophobicContact CG2-CG1 3.91Å; I581-L583 HydrophobicContact CG2-CD2 4.34Å; I581-V669 CarbonylContact O-C 3.56Å; I581-V669 WeakPolarHBondContact O-CA 3.35Å; I581-I670 PolarHBondContact N-O 3.5Å; I581-I670 PolarHBondContact O-N 3.31Å; I581-L672 HydrophobicContact CD1-CD1 3.61Å; I581-L672 HydrophobicContact CG1-CD1 4.32Å; I581-V763 HydrophobicContact CD1-CB 3.79Å; I581-V763 HydrophobicContact CD1-CG1 3.77Å; I581-V763 HydrophobicContact CD1-CG2 3.7Å; I581-I787 HydrophobicContact CD1-CD1 4.37Å
582	K	82.9	Confident	77.3	Confident	49 Å²	49	35.4 Å²	35.4	21%	0.213	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	139.9	176.1	168.4	-178.1	164.7	-139.2	0	113.4	P560 E561 L563 H584 A668 V669	P560-K582 WeakPolarHBondContact CA-O 3.39Å; E561-K582 HydrophobicContact CB-CB 4.25Å; E561-K582 PolarHBondContact N-O 2.93Å; E561-K582 PolarHBondContact O-N 2.79Å; E561-K582 IonicContact OE1-NZ 3.74Å; E561-K582 WeakPolarHBondContact OE2-CD 3.38Å; E561-K582 WeakPolarHBondContact OE2-CE 3.39Å; E561-K582 IonicContact OE2-NZ 3.56Å; E561-K582 PolarHBondContact OE2-NZ 2.9Å; L563-K582 HydrophobicContact CD1-CB 4.03Å; L563-K582 HydrophobicContact CD2-CB 4.3Å; L563-K582 HydrophobicContact CG-CB 4.19Å; K582-H584 WeakPolarHBondContact CE-NE2 3.27Å; K582-H584 PolarHBondContact NZ-NE2 3.4Å; K582-A668 CarbonylContact C-O 3.32Å; K582-A668 WeakPolarHBondContact CA-O 3.48Å; K582-V669 HydrophobicContact CB-CG2 4.41Å
583	L	82.4	Confident	77.9	Confident	1 Å²	1	29 Å²	29	1%	0.005	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	166.4	177.7	-53	-170.2	0	0	0	112.5	P560 I581 V598 L660 T667 A668 I670 L765	P560-L583 HydrophobicContact CB-CD2 4.13Å; I581-L583 HydrophobicContact CG2-CD2 4.34Å; L583-V598 HydrophobicContact CD1-CG2 4.33Å; L583-L660 HydrophobicContact CD1-CD2 4.32Å; L583-T667 VanDerWaalsContact O-CA 3.29Å; L583-T667 WeakPolarHBondContact O-CA 3.38Å; L583-T667 VanDerWaalsContact O-CB 3.32Å; L583-T667 WeakPolarHBondContact O-CB 3.17Å; L583-A668 PolarHBondContact N-O 3.21Å; L583-A668 PolarHBondContact O-N 2.91Å; L583-A668 VanDerWaalsContact O-N 3.14Å; L583-I670 HydrophobicContact CD1-CD1 3.4Å; L583-I670 HydrophobicContact CD1-CG1 4.41Å; L583-I670 HydrophobicContact CG-CD1 3.97Å; L583-L765 HydrophobicContact CB-CD2 4.06Å; L583-L765 HydrophobicContact CD1-CD1 3.58Å; L583-L765 HydrophobicContact CD1-CD2 4.2Å; L583-L765 HydrophobicContact CD1-CG 4.47Å; L583-L765 HydrophobicContact CD2-CB 4.25Å; L583-L765 HydrophobicContact CD2-CD1 4.09Å; L583-L765 HydrophobicContact CD2-CD2 4.06Å; L583-L765 HydrophobicContact CD2-CG 4.35Å; L583-L765 HydrophobicContact CG-CD1 4.38Å; L583-L765 HydrophobicContact CG-CD2 4.33Å
584	H	84.2	Confident	78.5	Confident	26 Å²	26	24.6 Å²	24.6	12%	0.12	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	147.5	178.8	-60	78.8	0	0	0	111.7	K558 E561 K582 F661 E666 T667	K558-H584 HydrophobicContact CB-CB 4.26Å; K558-H584 PolarHBondContact NZ-CE1 2.87Å; K558-H584 VanDerWaalsContact NZ-CE1 3.28Å; K558-H584 PolarHBondContact NZ-NE2 3.05Å; E561-H584 IonicContact OE1-CE1 3.97Å; E561-H584 PolarHBondContact OE1-CE1 3.34Å; E561-H584 IonicContact OE1-NE2 3.46Å; E561-H584 IonicContact OE2-CE1 3.35Å; K582-H584 WeakPolarHBondContact CE-NE2 3.27Å; K582-H584 PolarHBondContact NZ-NE2 3.4Å; H584-F661 VanDerWaalsContact C-CZ 3.46Å; H584-F661 WeakPolarHBondContact O-CZ 3.17Å; H584-E666 CarbonylContact C-O 3.53Å; H584-E666 WeakPolarHBondContact CA-O 3.12Å; H584-T667 VanDerWaalsContact CD2-CG2 3.48Å; H584-T667 WeakPolarHBondContact CD2-CG2 3.08Å
585	R	84	Confident	79	Confident	40 Å²	40	24.1 Å²	24.1	15%	0.151	13%	0.126	C	C	.	.	P	Polyproline II helix	trans	-70.8	132.2	177.5	178.3	-172	-79.5	-105.9	4.5	110	S450 F661 K662 H665 E666	S450-R585 WeakPolarHBondContact O-CD 3.3Å; R585-F661 HydrophobicContact CB-CD1 3.86Å; R585-F661 HydrophobicContact CB-CE1 3.9Å; R585-F661 HydrophobicContact CB-CG 4.2Å; R585-F661 HydrophobicContact CB-CZ 4.27Å; R585-F661 VanDerWaalsContact N-CE1 3.31Å; R585-K662 PolarHBondContact NH2-O 2.93Å; R585-H665 PolarHBondContact NE-O 2.79Å; R585-E666 PolarHBondContact N-O 3.2Å
586	V	82.6	Confident	79.5	Confident	7 Å²	7	20.7 Å²	20.7	4%	0.042	10%	0.103	C	C	.	.	P	Polyproline II helix	trans	-91.9	146.5	174	-171.6	0	0	0	0	109.6	P554 I557 I593 Y596 A767	P554-V586 HydrophobicContact CB-CG1 3.56Å; I557-V586 HydrophobicContact CB-CG2 4.22Å; I557-V586 HydrophobicContact CD1-CG2 3.96Å; I557-V586 HydrophobicContact CG1-CG1 4.25Å; I557-V586 HydrophobicContact CG1-CG2 3.74Å; I557-V586 HydrophobicContact CG2-CG2 3.93Å; V586-I593 HydrophobicContact CB-CD1 4.44Å; V586-I593 HydrophobicContact CG1-CD1 4.4Å; V586-Y596 HydrophobicContact CG2-CE1 3.97Å; V586-Y596 PolarHBondContact N-OH 3.44Å; V586-A767 HydrophobicContact CG2-CB 4.17Å
587	S	84.4	Confident	79.9	Confident	29 Å²	29	21.3 Å²	21.3	20%	0.203	11%	0.105	C	C	.	.	P	Polyproline II helix	trans	-81.4	147.4	179.5	-170.3	0	0	0	0	112.3	I448 T449 E589	I448-S587 WeakPolarHBondContact O-CA 3.36Å; I448-S587 PolarHBondContact O-OG 2.81Å; T449-S587 WeakPolarHBondContact CA-OG 3.3Å; S587-E589 VanDerWaalsContact C-N 3.33Å
588	E	85.4	Confident	80.2	Confident	39 Å²	39	21.4 Å²	21.4	18%	0.182	11%	0.105	C	C	.	.	G	3₁₀ helix	trans	-90.9	15.6	-179.8	-62	-173.4	154.2	0	0	113.6	F447 I448 N515 N590 G591 I593	F447-E588 VanDerWaalsContact CB-C 3.46Å; F447-E588 HydrophobicContact CB-CB 4.31Å; F447-E588 VanDerWaalsContact CB-O 3.3Å; F447-E588 WeakPolarHBondContact CB-O 3.47Å; I448-E588 HydrophobicContact CB-CB 4.31Å; I448-E588 HydrophobicContact CB-CG 4.24Å; I448-E588 WeakPolarHBondContact CB-OE2 3.16Å; I448-E588 WeakPolarHBondContact CD1-OE2 3.34Å; I448-E588 WeakPolarHBondContact CG1-OE2 3.28Å; I448-E588 PolarHBondContact O-N 2.82Å; N515-E588 PolarHBondContact ND2-O 2.72Å; E588-N590 PolarHBondContact O-N 2.78Å; E588-G591 WeakPolarHBondContact CA-O 3.14Å; E588-G591 PolarHBondContact O-N 2.89Å; E588-I593 HydrophobicContact CG-CD1 4.25Å; E588-I593 HydrophobicContact CG-CG1 3.89Å; E588-I593 PolarHBondContact OE1-N 3.31Å
589	E	82.6	Confident	80.5	Confident	53 Å²	53	19.9 Å²	19.9	25%	0.248	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-52.1	-31.4	175.8	-174.4	159.7	-180	0	0	111.9	F447 K513 S587	F447-E589 HydrophobicContact CD1-CB 4.08Å; F447-E589 HydrophobicContact CD1-CG 3.99Å; F447-E589 HydrophobicContact CD2-CB 3.71Å; F447-E589 HydrophobicContact CD2-CG 4.4Å; F447-E589 HydrophobicContact CE1-CB 4Å; F447-E589 HydrophobicContact CE1-CG 3.6Å; F447-E589 HydrophobicContact CE2-CB 3.64Å; F447-E589 HydrophobicContact CE2-CG 4.05Å; F447-E589 VanDerWaalsContact CG-CA 3.43Å; F447-E589 HydrophobicContact CG-CB 3.92Å; F447-E589 HydrophobicContact CG-CG 4.36Å; F447-E589 HydrophobicContact CZ-CB 3.77Å; F447-E589 HydrophobicContact CZ-CG 3.61Å; F447-E589 VanDerWaalsContact CZ-OE2 3.28Å; F447-E589 WeakPolarHBondContact CZ-OE2 3.43Å; K513-E589 IonicContact NZ-OE1 3.06Å; K513-E589 PolarHBondContact NZ-OE1 2.99Å; S587-E589 VanDerWaalsContact C-N 3.33Å
590	N	75.5	Confident	80.7	Confident	4 Å²	4	19.9 Å²	19.9	2%	0.021	10%	0.098	C	C	.	.	G	3₁₀ helix	trans	-92.9	-11.1	177.5	-74.8	-9	0	0	0	115.1	P514 W551 S552 A553 E555 E588	P514-N590 HydrophobicContact CB-CB 4.32Å; P514-N590 WeakPolarHBondContact CB-OD1 3.5Å; W551-N590 CarbonylContact C-O 3.19Å; W551-N590 WeakPolarHBondContact CA-O 3.33Å; W551-N590 WeakPolarHBondContact CB-O 3.21Å; S552-N590 PolarHBondContact N-O 2.98Å; S552-N590 WeakPolarHBondContact OG-CB 3.38Å; S552-N590 PolarHBondContact OG-ND2 3.32Å; S552-N590 PolarHBondContact OG-OD1 3.09Å; A553-N590 PolarHBondContact O-ND2 2.85Å; E555-N590 VanDerWaalsContact CG-ND2 3.29Å; E555-N590 WeakPolarHBondContact CG-ND2 3.34Å; E555-N590 PolarHBondContact OE2-ND2 2.83Å; E555-N590 PolarHBondContact OE2-OD1 3.29Å; E588-N590 PolarHBondContact O-N 2.78Å
591	G	78.9	Confident	80.9	Confident	1 Å²	1	18.6 Å²	18.6	1%	0.01	9%	0.092	C	C	.	.	S	Bend	trans	140.1	161.4	179.9	0	0	0	0	0	112.8	E588 I593 S769	E588-G591 WeakPolarHBondContact CA-O 3.14Å; E588-G591 PolarHBondContact O-N 2.89Å; G591-I593 PolarHBondContact O-N 2.85Å; G591-S769 PolarHBondContact O-OG 3.32Å
592	P	81.6	Confident	80.9	Confident	36 Å²	36	19 Å²	19	23%	0.234	10%	0.095	C	C	.	.			trans	-59.6	128.3	-176.8	22.6	-34.4	0	0	0	112.8	W551 H594 S769	W551-P592 HydrophobicContact CD2-CG 4.3Å; W551-P592 HydrophobicContact CE3-CG 4.4Å; W551-P592 HydrophobicContact CH2-CG 3.83Å; W551-P592 HydrophobicContact CZ2-CG 3.7Å; W551-P592 HydrophobicContact CZ3-CG 4.16Å; P592-H594 PolarHBondContact O-ND1 3.08Å; P592-S769 WeakPolarHBondContact O-CA 3.33Å; P592-S769 WeakPolarHBondContact O-CB 3.31Å; P592-S769 PolarHBondContact O-OG 2.92Å
593	I	77.7	Confident	80.3	Confident	7 Å²	7	17.1 Å²	17.1	4%	0.036	9%	0.087	C	C	.	.			trans	-77.4	132	177.1	-38.9	-56.1	0	0	0	108.5	P554 V586 E588 G591 Y596 T657 A767	P554-I593 HydrophobicContact CB-CD1 3.69Å; P554-I593 HydrophobicContact CG-CD1 3.51Å; V586-I593 HydrophobicContact CB-CD1 4.44Å; V586-I593 HydrophobicContact CG1-CD1 4.4Å; E588-I593 HydrophobicContact CG-CD1 4.25Å; E588-I593 HydrophobicContact CG-CG1 3.89Å; E588-I593 PolarHBondContact OE1-N 3.31Å; G591-I593 PolarHBondContact O-N 2.85Å; I593-Y596 HydrophobicContact CG2-CE2 3.98Å; I593-T657 VanDerWaalsContact C-CG2 3.46Å; I593-T657 HydrophobicContact CB-CG2 3.72Å; I593-T657 HydrophobicContact CG2-CG2 3.53Å; I593-T657 WeakPolarHBondContact O-CB 2.98Å; I593-T657 VanDerWaalsContact O-CG2 3.23Å; I593-T657 WeakPolarHBondContact O-CG2 3.4Å; I593-T657 PolarHBondContact O-OG1 3.35Å; I593-A767 HydrophobicContact CG2-CB 4.03Å
594	H	76.8	Confident	79	Confident	55 Å²	55	21 Å²	21	26%	0.255	11%	0.107	S	C	.	.			trans	-108.8	-37.1	-178.4	-74.5	67.4	0	0	0	114.3	P592 H656 T657 C768 Q770	P592-H594 PolarHBondContact O-ND1 3.08Å; H594-H656 WeakPolarHBondContact O-CA 3.44Å; H594-H656 PolarHBondContact O-ND1 3.08Å; H594-T657 VanDerWaalsContact C-CG2 3.45Å; H594-T657 PolarHBondContact O-N 2.7Å; H594-T657 PolarHBondContact O-OG1 3.21Å; H594-C768 WeakPolarHBondContact CA-O 3.32Å; H594-C768 PolarHBondContact N-O 2.85Å; H594-Q770 HydrophobicContact CB-CB 3.63Å; H594-Q770 PolarHBondContact CE1-O 3.15Å; H594-Q770 VanDerWaalsContact CE1-O 3.31Å; H594-Q770 VanDerWaalsContact CG-N 3.35Å; H594-Q770 PolarHBondContact ND1-N 3.07Å; H594-Q770 VanDerWaalsContact ND1-N 3.19Å; H594-Q770 PolarHBondContact NE2-O 3Å
595	N	76.2	Confident	77	Confident	13 Å²	13	24.9 Å²	24.9	7%	0.07	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	151.8	-176.8	-62.9	-49.4	0	0	0	112.5	Y597 R655 H656 A767 C768 Q770 Q776	N595-Y597 HydrophobicContact CB-CD2 4.48Å; N595-Y597 HydrophobicContact CB-CE2 3.64Å; N595-R655 WeakPolarHBondContact CA-O 3.47Å; N595-H656 PolarHBondContact OD1-CE1 2.74Å; N595-H656 PolarHBondContact OD1-ND1 2.8Å; N595-A767 CarbonylContact O-C 3.43Å; N595-A767 WeakPolarHBondContact O-CA 3.26Å; N595-C768 PolarHBondContact N-O 3.3Å; N595-C768 PolarHBondContact O-N 2.81Å; N595-Q770 PolarHBondContact ND2-OE1 3.4Å; N595-Q776 PolarHBondContact ND2-NE2 2.81Å
596	Y	79.5	Confident	74.6	Confident	5 Å²	5	29.7 Å²	29.7	2%	0.02	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	146	165.5	-72.8	-89.4	0	0	0	110.9	V586 I593 A654 R655 T657 L660 F661 L765 R766 A767	V586-Y596 HydrophobicContact CG2-CE1 3.97Å; V586-Y596 PolarHBondContact N-OH 3.44Å; I593-Y596 HydrophobicContact CG2-CE2 3.98Å; Y596-A654 WeakPolarHBondContact O-CA 3.29Å; Y596-R655 PolarHBondContact N-O 3.46Å; Y596-R655 PolarHBondContact O-N 2.94Å; Y596-T657 HydrophobicContact CD2-CG2 3.5Å; Y596-T657 VanDerWaalsContact CD2-CG2 3.5Å; Y596-T657 HydrophobicContact CE2-CG2 3.37Å; Y596-L660 HydrophobicContact CD1-CD2 4.41Å; Y596-L660 HydrophobicContact CD2-CD2 3.57Å; Y596-L660 HydrophobicContact CE2-CD2 4.32Å; Y596-L660 HydrophobicContact CG-CD2 3.63Å; Y596-F661 HydrophobicContact CD2-CE2 4.11Å; Y596-F661 HydrophobicContact CE1-CE2 4.07Å; Y596-F661 AromaticContact CE2-CD2 3.96Å; Y596-F661 HydrophobicContact CE2-CD2 3.96Å; Y596-F661 AromaticContact CE2-CE2 3.5Å; Y596-F661 HydrophobicContact CE2-CE2 3.5Å; Y596-F661 AromaticContact CZ-CE2 3.5Å; Y596-F661 VanDerWaalsContact CZ-CE2 3.5Å; Y596-L765 HydrophobicContact CD1-CD1 3.9Å; Y596-L765 HydrophobicContact CD1-CD2 4.37Å; Y596-L765 HydrophobicContact CD1-CG 4.32Å; Y596-R766 CarbonylContact C-O 3.6Å; Y596-R766 VanDerWaalsContact CA-O 3.23Å; Y596-R766 WeakPolarHBondContact CA-O 3.23Å; Y596-A767 HydrophobicContact CD1-CB 3.37Å; Y596-A767 HydrophobicContact CE1-CB 3.31Å; Y596-A767 HydrophobicContact CG-CB 4.22Å
597	Y	78.7	Confident	72.8	Confident	16 Å²	16	35.1 Å²	35.1	6%	0.063	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	147.1	178.8	-45.6	-101.1	0	0	0	112.9	N595 L634 L651 L653 A654 L765 R766 C768 Q776	N595-Y597 HydrophobicContact CB-CD2 4.48Å; N595-Y597 HydrophobicContact CB-CE2 3.64Å; Y597-L634 HydrophobicContact CD1-CD1 4.41Å; Y597-L634 HydrophobicContact CD1-CD2 3.44Å; Y597-L634 VanDerWaalsContact CD1-CD2 3.44Å; Y597-L634 HydrophobicContact CD2-CD1 4.11Å; Y597-L634 HydrophobicContact CD2-CD2 3.84Å; Y597-L634 HydrophobicContact CE1-CD1 3.98Å; Y597-L634 HydrophobicContact CE1-CD2 3.79Å; Y597-L634 HydrophobicContact CE1-CG 4.44Å; Y597-L634 HydrophobicContact CE2-CD1 3.64Å; Y597-L634 HydrophobicContact CE2-CD2 4.16Å; Y597-L634 HydrophobicContact CG-CD1 4.48Å; Y597-L634 HydrophobicContact CG-CD2 3.46Å; Y597-L634 VanDerWaalsContact CG-CD2 3.46Å; Y597-L651 HydrophobicContact CD1-CD2 4.33Å; Y597-L653 CarbonylContact C-O 3.15Å; Y597-L653 WeakPolarHBondContact CA-O 3.12Å; Y597-A654 HydrophobicContact CD1-CB 3.49Å; Y597-A654 VanDerWaalsContact CD1-CB 3.49Å; Y597-A654 HydrophobicContact CE1-CB 3.76Å; Y597-L765 WeakPolarHBondContact O-CA 3.24Å; Y597-R766 HydrophobicContact CD2-CB 4.25Å; Y597-R766 HydrophobicContact CD2-CG 3.97Å; Y597-R766 PolarHBondContact N-O 3.43Å; Y597-R766 PolarHBondContact O-N 3.4Å; Y597-C768 HydrophobicContact CE2-CB 4.47Å; Y597-Q776 PolarHBondContact OH-NE2 2.83Å; Y597-Q776 PolarHBondContact OH-OE1 3.39Å
598	V	81.8	Confident	70.4	Confident	3 Å²	3	39.2 Å²	39.2	2%	0.018	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	137.6	179.8	-178.2	0	0	0	0	111	L583 A652 L653 I670 V763 A764 L765	L583-V598 HydrophobicContact CD1-CG2 4.33Å; V598-A652 HydrophobicContact CG1-CB 4.48Å; V598-A652 PolarHBondContact O-N 2.86Å; V598-L653 HydrophobicContact CB-CB 4.09Å; V598-L653 HydrophobicContact CG2-CB 4.2Å; V598-L653 HydrophobicContact CG2-CD2 4.43Å; V598-L653 PolarHBondContact N-O 2.77Å; V598-I670 HydrophobicContact CG2-CD1 3.75Å; V598-V763 HydrophobicContact CG1-CG1 3.61Å; V598-A764 WeakPolarHBondContact CA-O 3.25Å; V598-L765 HydrophobicContact CG2-CD1 4.25Å
599	I	81.7	Confident	67.5	Low	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	134.6	-158.8	-49.6	178.7	0	0	0	110.2	Y632 L637 L651 V763 A764 R766 T780 H1185	I599-Y632 HydrophobicContact CG2-CD2 3.94Å; I599-Y632 HydrophobicContact CG2-CE2 4.37Å; I599-L637 HydrophobicContact CB-CD1 4.17Å; I599-L637 HydrophobicContact CD1-CD1 3.63Å; I599-L637 HydrophobicContact CG1-CD1 3.76Å; I599-L637 HydrophobicContact CG2-CD1 3.43Å; I599-L637 VanDerWaalsContact CG2-CD1 3.43Å; I599-L637 HydrophobicContact CG2-CD2 3.52Å; I599-L637 HydrophobicContact CG2-CG 4.11Å; I599-L651 HydrophobicContact CG1-CD1 3.98Å; I599-V763 CarbonylContact O-C 3.53Å; I599-V763 WeakPolarHBondContact O-CA 3.5Å; I599-V763 WeakPolarHBondContact O-CG1 3.18Å; I599-A764 PolarHBondContact N-O 2.89Å; I599-A764 PolarHBondContact O-N 3.25Å; I599-R766 HydrophobicContact CD1-CB 3.89Å; I599-T780 HydrophobicContact CD1-CG2 4.48Å; I599-H1185 WeakPolarHBondContact CD1-CE1 3.43Å; I599-H1185 WeakPolarHBondContact CD1-ND1 3.49Å
600	I	83.2	Confident	64.7	Low	2 Å²	2	46 Å²	46	1%	0.01	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	137.8	-170.3	-54.8	-178.4	0	0	0	111.3	P649 Y650 A652 L672 Y761 R762 V763	I600-P649 CarbonylContact O-C 3.37Å; I600-P649 WeakPolarHBondContact O-CA 3.27Å; I600-P649 VanDerWaalsContact O-CB 3.28Å; I600-P649 WeakPolarHBondContact O-CB 3.38Å; I600-Y650 HydrophobicContact CB-CD1 4.3Å; I600-Y650 HydrophobicContact CB-CE1 3.9Å; I600-Y650 HydrophobicContact CB-CE2 4.45Å; I600-Y650 HydrophobicContact CD1-CE2 3.97Å; I600-Y650 HydrophobicContact CG2-CE1 3.8Å; I600-Y650 PolarHBondContact N-O 3.18Å; I600-Y650 PolarHBondContact O-N 2.86Å; I600-A652 HydrophobicContact CD1-CB 3.58Å; I600-A652 HydrophobicContact CG1-CB 4.01Å; I600-L672 HydrophobicContact CD1-CD1 3.75Å; I600-L672 HydrophobicContact CD1-CD2 4.03Å; I600-L672 HydrophobicContact CD1-CG 4.34Å; I600-L672 HydrophobicContact CG1-CD1 4.45Å; I600-Y761 HydrophobicContact CG2-CD1 4.02Å; I600-R762 WeakPolarHBondContact CA-O 3.46Å; I600-V763 HydrophobicContact CG1-CG1 4.32Å; I600-V763 HydrophobicContact CG1-CG2 4.15Å
601	S	81.3	Confident	62.4	Low	3 Å²	3	54.8 Å²	54.8	2%	0.021	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	135.3	171.5	-175.9	0	0	0	0	113.8	Y632 Y761 R762 W783	S601-Y632 WeakPolarHBondContact CB-OH 3.42Å; S601-Y632 PolarHBondContact OG-OH 2.81Å; S601-Y632 VanDerWaalsContact OG-OH 3.11Å; S601-Y761 CarbonylContact O-C 3.58Å; S601-Y761 VanDerWaalsContact O-CA 3.27Å; S601-Y761 WeakPolarHBondContact O-CA 3.38Å; S601-R762 PolarHBondContact N-O 3.39Å; S601-R762 PolarHBondContact O-N 2.85Å; S601-W783 VanDerWaalsContact CB-CH2 3.41Å
602	P	78.6	Confident	60.2	Low	10 Å²	10	61 Å²	61	7%	0.065	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	153.9	163.9	32.8	-34	0	0	0	111.9	T759 I760 Y761	P602-T759 HydrophobicContact CB-CG2 3.41Å; P602-T759 VanDerWaalsContact CB-CG2 3.41Å; P602-I760 CarbonylContact C-O 3.56Å; P602-I760 WeakPolarHBondContact CA-O 3.4Å; P602-Y761 HydrophobicContact CB-CD1 4.32Å; P602-Y761 HydrophobicContact CB-CE1 4.13Å
603	E	68.6	Low	57.6	Low	10 Å²	10	65.4 Å²	65.4	5%	0.047	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	118.8	177.9	172.1	159.1	-155.4	0	0	110.5	V626 I760 R762 R786	E603-V626 HydrophobicContact CB-CG2 4.08Å; E603-V626 HydrophobicContact CG-CG1 4.4Å; E603-V626 HydrophobicContact CG-CG2 4.09Å; E603-I760 HydrophobicContact CB-CB 4.14Å; E603-I760 HydrophobicContact CB-CG2 4.27Å; E603-I760 PolarHBondContact N-O 3.26Å; E603-R762 IonicContact OE1-NH2 3.03Å; E603-R762 PolarHBondContact OE1-NH2 3.07Å; E603-R762 IonicContact OE2-CZ 3.33Å; E603-R762 VanDerWaalsContact OE2-CZ 3.29Å; E603-R762 IonicContact OE2-NE 3.2Å; E603-R762 PolarHBondContact OE2-NE 2.84Å; E603-R762 IonicContact OE2-NH2 2.81Å; E603-R762 PolarHBondContact OE2-NH2 3.25Å; E603-R786 IonicContact OE1-CZ 2.67Å; E603-R786 IonicContact OE1-NE 2.97Å; E603-R786 PolarHBondContact OE1-NE 3.24Å; E603-R786 IonicContact OE1-NH2 3.69Å; E603-R786 PolarHBondContact OE1-NH2 3.32Å; E603-R786 IonicContact OE2-CZ 2.65Å; E603-R786 IonicContact OE2-NE 3.75Å; E603-R786 PolarHBondContact OE2-NE 2.82Å; E603-R786 IonicContact OE2-NH2 2.77Å
604	L	55.4	Low	55.3	Low	81 Å²	81	66.1 Å²	66.1	42%	0.424	36%	0.359	S	S	.	.			trans	-78.1	124.7	-170.5	-73.4	158.6	0	0	0	112.5	K1214	L604-K1214 HydrophobicContact CD1-CD 4.16Å; L604-K1214 VanDerWaalsContact CD1-CE 3.46Å
605	N	42.4	Very low	53.1	Low	108 Å²	108	66 Å²	66	58%	0.578	36%	0.361	S	S	*	.			trans	-83.6	123.2	176.2	-85.5	-40.7	0	0	0	112.4
606	T	34.8	Very low	51	Low	141 Å²	141	68.1 Å²	68.1	87%	0.865	37%	0.372	S	S	*	.			trans	-122.9	105.7	162.3	53.3	0	0	0	0	109.4
607	V	42.9	Very low	49	Very low	121 Å²	121	74.3 Å²	74.3	73%	0.733	41%	0.405	S	S	*	.			trans	-86.9	144.8	-177.1	166.4	0	0	0	0	110.7
608	T	34.9	Very low	47.5	Very low	115 Å²	115	80 Å²	80	71%	0.706	44%	0.436	S	S	*	.			trans	14.4	131.7	169.1	59	0	0	0	0	118.8
609	T	24.8	Very low	45.2	Very low	115 Å²	115	87.1 Å²	87.1	71%	0.706	47%	0.473	S	S	*	.				-168.1	155.9	79.7	22.8	0	0	0	0	114.5
610	N	23.5	Very low	42.5	Very low	119 Å²	119	93.1 Å²	93.1	64%	0.636	50%	0.5	S	S	*	.			trans	53.9	106.1	148.3	-62.3	-15.3	0	0	0	118.6
611	K	27	Very low	39.8	Very low	189 Å²	189	98 Å²	98	82%	0.822	53%	0.533	S	S	*	.	S	Bend		39.1	117.7	78.8	-56.8	179.1	-178	177	0	112.3	L613	K611-L613 VanDerWaalsContact C-N 3.34Å; K611-L613 PolarHBondContact O-N 3.48Å
612	N	31.7	Very low	37.3	Very low	131 Å²	131	102.7 Å²	102.7	70%	0.701	57%	0.567	S	S	*	*	S	Bend	trans	61.7	27.6	175.8	-65.5	14.2	0	0	0	117.1	V614	N612-V614 VanDerWaalsContact N-CG1 3.28Å
613	L	29.1	Very low	34.9	Very low	129 Å²	129	110.3 Å²	110.3	68%	0.675	60%	0.599	S	S	*	*	S	Bend		-117	128.7	119.4	-141.4	70.6	0	0	0	107	K611	K611-L613 VanDerWaalsContact C-N 3.34Å; K611-L613 PolarHBondContact O-N 3.48Å
614	V	28.4	Very low	33.5	Very low	22 Å²	22	112.6 Å²	112.6	13%	0.133	62%	0.616	C	S	.	*			trans	-157.6	162.2	-137.8	-93	0	0	0	0	113.3	N612 S925 P926	N612-V614 VanDerWaalsContact N-CG1 3.28Å; V614-S925 WeakPolarHBondContact CG2-O 3.37Å; V614-S925 CarbonylContact O-C 3.56Å; V614-S925 VanDerWaalsContact O-CA 3.26Å; V614-S925 WeakPolarHBondContact O-CA 3.3Å; V614-P926 PolarHBondContact N-O 2.73Å; V614-P926 CarbonylContact O-C 3.48Å; V614-P926 WeakPolarHBondContact O-CA 3.29Å; V614-P926 VanDerWaalsContact O-O 3.07Å
615	N	30	Very low	33	Very low	53 Å²	53	111.7 Å²	111.7	28%	0.283	61%	0.611	S	S	.	*			cis	-137.7	-81	6.8	-134.2	-42.4	0	0	0	111.1	K620 Y924	N615-K620 WeakPolarHBondContact O-CD 3.29Å; N615-K620 WeakPolarHBondContact O-CE 3.43Å; N615-K620 VanDerWaalsContact O-CG 3.27Å; N615-K620 WeakPolarHBondContact O-CG 3.49Å; N615-K620 WeakPolarHBondContact OD1-CE 3.5Å; N615-K620 PolarHBondContact OD1-NZ 2.84Å; N615-Y924 WeakPolarHBondContact CB-O 3.48Å
616	N	33.5	Very low	33.6	Very low	58 Å²	58	107.2 Å²	107.2	31%	0.31	59%	0.587	S	S	.	*	S	Bend	cis	65.1	128.8	38.5	-71.3	46.8	0	0	0	113.8	K620	N616-K620 PolarHBondContact OD1-NZ 2.96Å
617	D	37.6	Very low	35.1	Very low	134 Å²	134	101.1 Å²	101.1	72%	0.717	55%	0.549	S	S	*	.	S	Bend	cis	-121.1	37.9	-24.8	-75.7	-54	0	0	0	108.8
618	L	47	Very low	36.4	Very low	136 Å²	136	95.5 Å²	95.5	71%	0.712	52%	0.516	S	S	*	.	S	Bend	trans	-158.4	147.4	-163.4	-60.5	163.5	0	0	0	101.7
619	L	32.4	Very low	38.3	Very low	152 Å²	152	90.1 Å²	90.1	80%	0.796	48%	0.482	S	S	*	.			trans	59.5	-158.2	-161.6	-48.8	78.4	0	0	0	110.4
620	K	24.8	Very low	40.6	Very low	127 Å²	127	84.6 Å²	84.6	55%	0.552	45%	0.449	S	S	*	.			trans	52.2	89.1	-169.3	-82.1	179	-179.7	164.9	0	113.7	N615 N616	N615-K620 WeakPolarHBondContact O-CD 3.29Å; N615-K620 WeakPolarHBondContact O-CE 3.43Å; N615-K620 VanDerWaalsContact O-CG 3.27Å; N615-K620 WeakPolarHBondContact O-CG 3.49Å; N615-K620 WeakPolarHBondContact OD1-CE 3.5Å; N615-K620 PolarHBondContact OD1-NZ 2.84Å; N616-K620 PolarHBondContact OD1-NZ 2.96Å
621	S	27.9	Very low	43	Very low	103 Å²	103	79 Å²	79	72%	0.72	42%	0.418	S	S	*	.			cis	-139.8	133.6	4.9	57.8	0	0	0	0	111.5	K623	S621-K623 PolarHBondContact O-N 3.43Å
622	S	27.8	Very low	45.2	Very low	103 Å²	103	70 Å²	70	72%	0.72	38%	0.379	S	S	*	.			trans	-63.7	71.2	169.3	36.5	0	0	0	0	111.6	S624	S622-S624 VanDerWaalsContact C-N 3.3Å; S622-S624 PolarHBondContact O-N 3.41Å
623	K	28.9	Very low	47.1	Very low	169 Å²	169	64.6 Å²	64.6	74%	0.735	35%	0.35	S	S	*	.			trans	-60.5	104.3	149.8	-84.5	-171.5	175.5	-178.8	0	106	S621 L625 H1216	S621-K623 PolarHBondContact O-N 3.43Å; K623-L625 PolarHBondContact O-N 2.85Å; K623-H1216 PolarHBondContact O-CE1 3.33Å
624	S	39.5	Very low	49.2	Very low	58 Å²	58	59.1 Å²	59.1	41%	0.406	32%	0.322	S	S	.	.			trans	-32.1	126.8	-170.4	-171.1	0	0	0	0	113.6	S622 V626	S622-S624 VanDerWaalsContact C-N 3.3Å; S622-S624 PolarHBondContact O-N 3.41Å; S624-V626 PolarHBondContact O-N 3.41Å; S624-V626 WeakPolarHBondContact OG-CB 3.4Å; S624-V626 PolarHBondContact OG-N 2.92Å
625	L	43.6	Very low	51.2	Low	62 Å²	62	62.4 Å²	62.4	33%	0.325	33%	0.334	S	S	.	.			trans	-74.8	20.7	169.4	-72.2	56.8	0	0	0	110.6	K623 K1214 H1216	K623-L625 PolarHBondContact O-N 2.85Å; L625-K1214 WeakPolarHBondContact CB-O 2.93Å; L625-K1214 CarbonylContact O-C 3.6Å; L625-K1214 WeakPolarHBondContact O-CA 3.25Å; L625-H1216 HydrophobicContact CB-CB 4.47Å; L625-H1216 HydrophobicContact CG-CB 4.17Å
626	V	55.3	Low	53.1	Low	14 Å²	14	60 Å²	60	9%	0.085	32%	0.322	C	S	.	.			trans	-47.3	149.2	153.7	72.4	0	0	0	0	108.9	E603 S624 R1211	E603-V626 HydrophobicContact CB-CG2 4.08Å; E603-V626 HydrophobicContact CG-CG1 4.4Å; E603-V626 HydrophobicContact CG-CG2 4.09Å; S624-V626 PolarHBondContact O-N 3.41Å; S624-V626 WeakPolarHBondContact OG-CB 3.4Å; S624-V626 PolarHBondContact OG-N 2.92Å; V626-R1211 PolarHBondContact O-NE 3.12Å; V626-R1211 PolarHBondContact O-NH2 3.17Å
627	I	66.5	Low	54.9	Low	13 Å²	13	57.3 Å²	57.3	7%	0.067	31%	0.307	C	S	.	.			trans	-75.9	147	-166.3	-33.5	-176.7	0	0	0	109.4	H631 Y632 P649 W783 I1191 R1211 D1213	I627-H631 HydrophobicContact CG2-CB 3.56Å; I627-Y632 HydrophobicContact CB-CE1 4.31Å; I627-Y632 WeakPolarHBondContact CB-OH 3.18Å; I627-Y632 HydrophobicContact CD1-CE1 3.51Å; I627-Y632 WeakPolarHBondContact CD1-OH 3.5Å; I627-Y632 HydrophobicContact CG1-CE1 4.47Å; I627-Y632 HydrophobicContact CG2-CE1 3.72Å; I627-Y632 WeakPolarHBondContact CG2-OH 3.41Å; I627-P649 HydrophobicContact CD1-CG 4.15Å; I627-W783 PolarHBondContact O-NE1 2.86Å; I627-I1191 HydrophobicContact CG2-CD1 4.05Å; I627-R1211 WeakPolarHBondContact CG2-O 3.48Å; I627-R1211 PolarHBondContact O-NH2 2.65Å; I627-D1213 WeakPolarHBondContact CD1-O 3.41Å; I627-D1213 WeakPolarHBondContact CG1-O 3.16Å
628	D	71	Confident	56.3	Low	4 Å²	4	52.7 Å²	52.7	2%	0.021	29%	0.286	C	S	.	.			trans	-87.9	-175.2	159.9	79.1	68.8	0	0	0	108.6	S630 W783 T1183 I1191 T1193 R1211	D628-S630 PolarHBondContact O-N 2.85Å; D628-W783 WeakPolarHBondContact O-CZ2 3.41Å; D628-T1183 WeakPolarHBondContact OD1-CG2 2.92Å; D628-I1191 HydrophobicContact CB-CD1 4.03Å; D628-I1191 WeakPolarHBondContact O-CD1 3.38Å; D628-I1191 WeakPolarHBondContact OD1-CD1 3.28Å; D628-I1191 WeakPolarHBondContact OD2-CD1 3.24Å; D628-I1191 WeakPolarHBondContact OD2-CG2 3.32Å; D628-T1193 WeakPolarHBondContact OD1-CB 3.29Å; D628-T1193 PolarHBondContact OD1-OG1 2.79Å; D628-T1193 WeakPolarHBondContact OD2-CB 3.26Å; D628-R1211 WeakPolarHBondContact OD2-CD 3.33Å; D628-R1211 WeakPolarHBondContact OD2-CG 3.26Å; D628-R1211 IonicContact OD2-NE 3.74Å
629	P	74.1	Confident	57.3	Low	1 Å²	1	50.1 Å²	50.1	1%	0.006	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-53.1	-174.1	-22.2	24.1	0	0	0	115	H631 Y632 A764 W783 T1183 H1185	P629-H631 VanDerWaalsContact C-N 3.35Å; P629-H631 PolarHBondContact O-N 2.88Å; P629-Y632 WeakPolarHBondContact O-CD2 3.02Å; P629-Y632 WeakPolarHBondContact O-CE2 3.37Å; P629-A764 HydrophobicContact CB-CB 3.53Å; P629-A764 HydrophobicContact CG-CB 3.81Å; P629-W783 VanDerWaalsContact CA-CZ2 3.5Å; P629-W783 HydrophobicContact CB-CD2 4.07Å; P629-W783 HydrophobicContact CB-CE3 3.94Å; P629-W783 HydrophobicContact CB-CH2 4.32Å; P629-W783 HydrophobicContact CB-CZ2 4.43Å; P629-W783 HydrophobicContact CB-CZ3 4.08Å; P629-W783 VanDerWaalsContact CD-CD1 3.45Å; P629-W783 VanDerWaalsContact CD-CD2 3.49Å; P629-W783 HydrophobicContact CG-CB 3.93Å; P629-W783 HydrophobicContact CG-CD2 3.48Å; P629-W783 VanDerWaalsContact CG-CD2 3.48Å; P629-W783 HydrophobicContact CG-CE3 3.64Å; P629-W783 HydrophobicContact CG-CG 3.61Å; P629-W783 HydrophobicContact CG-CZ3 4.3Å; P629-W783 VanDerWaalsContact N-CE2 3.33Å; P629-T1183 HydrophobicContact CB-CG2 3.56Å; P629-T1183 HydrophobicContact CG-CG2 3.61Å; P629-H1185 VanDerWaalsContact C-NE2 3.3Å; P629-H1185 WeakPolarHBondContact CB-NE2 3.23Å; P629-H1185 PolarHBondContact O-CE1 3.39Å; P629-H1185 PolarHBondContact O-ND1 2.82Å; P629-H1185 PolarHBondContact O-NE2 2.81Å
630	S	72.5	Confident	58.8	Low	0 Å²	0	44 Å²	44	0%	0	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-1.5	-155.4	38.5	0	0	0	0	119.6	D628 Y632 T1183 L1184 H1185 F1186 L1190 I1191 V1192	D628-S630 PolarHBondContact O-N 2.85Å; S630-Y632 PolarHBondContact O-N 3.27Å; S630-T1183 WeakPolarHBondContact CB-O 3.44Å; S630-T1183 WeakPolarHBondContact OG-CG2 3.41Å; S630-L1184 WeakPolarHBondContact CB-O 3.22Å; S630-H1185 VanDerWaalsContact CA-CD2 3.43Å; S630-H1185 WeakPolarHBondContact CA-CD2 3.43Å; S630-H1185 WeakPolarHBondContact O-CA 3.3Å; S630-F1186 PolarHBondContact O-N 2.94Å; S630-L1190 CarbonylContact O-C 3.41Å; S630-I1191 PolarHBondContact O-N 3.07Å; S630-I1191 WeakPolarHBondContact OG-CA 3.1Å; S630-I1191 VanDerWaalsContact OG-CG2 3.32Å; S630-I1191 WeakPolarHBondContact OG-CG2 3.3Å; S630-V1192 VanDerWaalsContact OG-C 3.23Å; S630-V1192 PolarHBondContact OG-N 3.41Å; S630-V1192 PolarHBondContact OG-O 3.43Å
631	H	73.7	Confident	60.4	Low	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.215	C	C	.	.	S	Bend	trans	-81	37.4	-172.8	-118.3	92.3	0	0	0	111.8	I627 P629 W1153 K1189 L1190 I1191 R1211 K1212	I627-H631 HydrophobicContact CG2-CB 3.56Å; P629-H631 VanDerWaalsContact C-N 3.35Å; P629-H631 PolarHBondContact O-N 2.88Å; H631-W1153 AromaticContact CE1-CE3 3.28Å; H631-W1153 AromaticContact CE1-CZ3 3.51Å; H631-W1153 AromaticContact NE2-CD2 3.85Å; H631-W1153 AromaticContact NE2-CE3 3.58Å; H631-W1153 AromaticContact NE2-CZ3 3.97Å; H631-K1189 HydrophobicContact CB-CB 4.39Å; H631-K1189 VanDerWaalsContact CD2-CB 3.48Å; H631-K1189 WeakPolarHBondContact CD2-CB 3.34Å; H631-K1189 PolarHBondContact CD2-O 3.09Å; H631-K1189 PolarHBondContact NE2-O 3.19Å; H631-K1189 VanDerWaalsContact NE2-O 3.13Å; H631-K1189 CarbonylContact O-C 3.58Å; H631-K1189 WeakPolarHBondContact O-CA 3.34Å; H631-K1189 WeakPolarHBondContact O-CB 3.44Å; H631-L1190 VanDerWaalsContact CA-N 3.32Å; H631-L1190 WeakPolarHBondContact CD2-CA 3.36Å; H631-L1190 PolarHBondContact CD2-N 3.23Å; H631-L1190 WeakPolarHBondContact NE2-CA 3.49Å; H631-L1190 PolarHBondContact O-N 3.23Å; H631-I1191 HydrophobicContact CB-CB 4.31Å; H631-I1191 HydrophobicContact CB-CD1 3.81Å; H631-I1191 HydrophobicContact CB-CG1 3.23Å; H631-I1191 PolarHBondContact CE1-N 2.97Å; H631-I1191 VanDerWaalsContact CE1-N 3.34Å; H631-I1191 VanDerWaalsContact CG-N 3.3Å; H631-I1191 WeakPolarHBondContact ND1-CB 3.16Å; H631-I1191 WeakPolarHBondContact ND1-CG1 3.39Å; H631-I1191 PolarHBondContact ND1-N 2.85Å; H631-R1211 WeakPolarHBondContact CB-O 3.09Å; H631-R1211 VanDerWaalsContact CE1-C 3.41Å; H631-R1211 VanDerWaalsContact CG-C 3.41Å; H631-R1211 PolarHBondContact ND1-N 2.66Å; H631-R1211 VanDerWaalsContact ND1-N 3.19Å; H631-R1211 PolarHBondContact ND1-O 2.59Å; H631-K1212 WeakPolarHBondContact CD2-CA 3.34Å; H631-K1212 WeakPolarHBondContact CD2-CB 3.4Å; H631-K1212 PolarHBondContact CE1-N 3.46Å; H631-K1212 VanDerWaalsContact CE1-N 3.31Å; H631-K1212 PolarHBondContact ND1-N 3.22Å; H631-K1212 VanDerWaalsContact NE2-CA 3.31Å; H631-K1212 WeakPolarHBondContact NE2-CA 3.17Å; H631-K1212 WeakPolarHBondContact NE2-CB 3.16Å; H631-K1212 PolarHBondContact NE2-NZ 2.84Å
632	Y	74	Confident	61.9	Low	1 Å²	1	39 Å²	39	0%	0.004	21%	0.21	C	C	.	.			trans	-155.2	105.9	-177.8	-21.2	-74.8	0	0	0	110.5	I599 S601 I627 P629 S630 L637 P649 W783 H1185 F1186	I599-Y632 HydrophobicContact CG2-CD2 3.94Å; I599-Y632 HydrophobicContact CG2-CE2 4.37Å; S601-Y632 WeakPolarHBondContact CB-OH 3.42Å; S601-Y632 PolarHBondContact OG-OH 2.81Å; S601-Y632 VanDerWaalsContact OG-OH 3.11Å; I627-Y632 HydrophobicContact CB-CE1 4.31Å; I627-Y632 WeakPolarHBondContact CB-OH 3.18Å; I627-Y632 HydrophobicContact CD1-CE1 3.51Å; I627-Y632 WeakPolarHBondContact CD1-OH 3.5Å; I627-Y632 HydrophobicContact CG1-CE1 4.47Å; I627-Y632 HydrophobicContact CG2-CE1 3.72Å; I627-Y632 WeakPolarHBondContact CG2-OH 3.41Å; P629-Y632 WeakPolarHBondContact O-CD2 3.02Å; P629-Y632 WeakPolarHBondContact O-CE2 3.37Å; S630-Y632 PolarHBondContact O-N 3.27Å; Y632-L637 HydrophobicContact CD1-CD2 4.4Å; Y632-L637 HydrophobicContact CD2-CD2 3.61Å; Y632-L637 HydrophobicContact CD2-CG 4.4Å; Y632-L637 HydrophobicContact CG-CD2 3.53Å; Y632-L637 HydrophobicContact CG-CG 4.15Å; Y632-L637 WeakPolarHBondContact O-CD1 3.42Å; Y632-P649 HydrophobicContact CD1-CB 4.08Å; Y632-P649 HydrophobicContact CD1-CG 3.49Å; Y632-P649 VanDerWaalsContact CD1-CG 3.49Å; Y632-P649 HydrophobicContact CD2-CB 4.4Å; Y632-P649 HydrophobicContact CE1-CB 3.57Å; Y632-P649 HydrophobicContact CE1-CG 2.98Å; Y632-P649 HydrophobicContact CE2-CB 3.81Å; Y632-P649 HydrophobicContact CE2-CG 4.19Å; Y632-P649 HydrophobicContact CG-CG 4.34Å; Y632-P649 WeakPolarHBondContact OH-CB 3.06Å; Y632-W783 AromaticContact CE2-CH2 3.82Å; Y632-W783 HydrophobicContact CE2-CH2 3.82Å; Y632-W783 AromaticContact CE2-CZ2 3.92Å; Y632-W783 HydrophobicContact CE2-CZ2 3.92Å; Y632-H1185 AromaticContact CD2-CE1 3.8Å; Y632-H1185 WeakPolarHBondContact O-CB 3.06Å; Y632-H1185 PolarHBondContact O-ND1 3.27Å; Y632-F1186 CarbonylContact C-O 3.49Å
633	D	71.7	Confident	63.4	Low	17 Å²	17	37.9 Å²	37.9	9%	0.091	20%	0.195	C	C	.	.			trans	-62.2	161.2	161.2	-177	30.9	0	0	0	110.4	K635 S636 L637 R766 F1186 S1187	D633-K635 PolarHBondContact O-N 3.49Å; D633-K635 VanDerWaalsContact O-N 3.15Å; D633-K635 IonicContact OD2-NZ 2.76Å; D633-K635 PolarHBondContact OD2-NZ 3.46Å; D633-S636 PolarHBondContact O-N 3.19Å; D633-S636 PolarHBondContact O-OG 2.94Å; D633-L637 WeakPolarHBondContact O-CG 3.41Å; D633-L637 PolarHBondContact O-N 3.29Å; D633-L637 VanDerWaalsContact O-N 3.09Å; D633-R766 IonicContact OD1-NH1 2.76Å; D633-R766 IonicContact OD1-NH2 3.95Å; D633-F1186 PolarHBondContact N-O 3.2Å; D633-S1187 VanDerWaalsContact CB-CA 3.42Å; D633-S1187 WeakPolarHBondContact CB-O 3.08Å; D633-S1187 PolarHBondContact N-O 2.74Å
634	L	72.9	Confident	64.6	Low	15 Å²	15	35.4 Å²	35.4	8%	0.079	20%	0.199	C	C	.	.	H	α-helix	trans	-59.5	-28.3	-177.3	-67.3	162.7	0	0	0	111.6	Y597 S638 L651	Y597-L634 HydrophobicContact CD1-CD1 4.41Å; Y597-L634 HydrophobicContact CD1-CD2 3.44Å; Y597-L634 VanDerWaalsContact CD1-CD2 3.44Å; Y597-L634 HydrophobicContact CD2-CD1 4.11Å; Y597-L634 HydrophobicContact CD2-CD2 3.84Å; Y597-L634 HydrophobicContact CE1-CD1 3.98Å; Y597-L634 HydrophobicContact CE1-CD2 3.79Å; Y597-L634 HydrophobicContact CE1-CG 4.44Å; Y597-L634 HydrophobicContact CE2-CD1 3.64Å; Y597-L634 HydrophobicContact CE2-CD2 4.16Å; Y597-L634 HydrophobicContact CG-CD1 4.48Å; Y597-L634 HydrophobicContact CG-CD2 3.46Å; Y597-L634 VanDerWaalsContact CG-CD2 3.46Å; L634-S638 WeakPolarHBondContact O-CB 3.45Å; L634-S638 PolarHBondContact O-N 3.29Å; L634-L651 HydrophobicContact CD2-CD1 3.87Å; L634-L651 HydrophobicContact CD2-CD2 4.39Å
635	K	71.1	Confident	65.5	Low	91 Å²	91	34.7 Å²	34.7	40%	0.396	20%	0.195	S	C	.	.	H	α-helix	trans	-74.1	-35.7	179	-30.4	178.8	-163	75	0	112.3	D633 S638 Q639 D1188	D633-K635 PolarHBondContact O-N 3.49Å; D633-K635 VanDerWaalsContact O-N 3.15Å; D633-K635 IonicContact OD2-NZ 2.76Å; D633-K635 PolarHBondContact OD2-NZ 3.46Å; K635-S638 CarbonylContact O-C 3.01Å; K635-S638 PolarHBondContact O-N 2.82Å; K635-Q639 VanDerWaalsContact C-NE2 3.31Å; K635-Q639 WeakPolarHBondContact O-CB 3.47Å; K635-Q639 WeakPolarHBondContact O-CG 3.24Å; K635-Q639 PolarHBondContact O-N 3.01Å; K635-Q639 PolarHBondContact O-NE2 3.14Å; K635-D1188 VanDerWaalsContact CB-OD1 3.27Å; K635-D1188 WeakPolarHBondContact CB-OD1 3.5Å
636	S	69.7	Low	66.3	Low	3 Å²	3	33 Å²	33	2%	0.021	19%	0.186	C	C	.	.	H	α-helix	trans	-78.8	-34.7	174.8	64.7	0	0	0	0	113.3	D633 S638 Q639 N640 D1188	D633-S636 PolarHBondContact O-N 3.19Å; D633-S636 PolarHBondContact O-OG 2.94Å; S636-S638 PolarHBondContact O-N 3.18Å; S636-Q639 PolarHBondContact O-N 2.8Å; S636-N640 WeakPolarHBondContact O-CB 3.04Å; S636-N640 VanDerWaalsContact O-CG 3.28Å; S636-N640 PolarHBondContact O-N 3.04Å; S636-D1188 WeakPolarHBondContact CB-O 3.27Å; S636-D1188 PolarHBondContact N-OD1 3.45Å; S636-D1188 PolarHBondContact N-OD2 3.4Å; S636-D1188 WeakPolarHBondContact OG-CA 3.34Å; S636-D1188 PolarHBondContact OG-O 2.96Å
637	L	70.5	Confident	66.7	Low	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.1	-34	169.7	-65.3	173.4	0	0	0	110.7	I599 Y632 D633 S641 L651	I599-L637 HydrophobicContact CB-CD1 4.17Å; I599-L637 HydrophobicContact CD1-CD1 3.63Å; I599-L637 HydrophobicContact CG1-CD1 3.76Å; I599-L637 HydrophobicContact CG2-CD1 3.43Å; I599-L637 VanDerWaalsContact CG2-CD1 3.43Å; I599-L637 HydrophobicContact CG2-CD2 3.52Å; I599-L637 HydrophobicContact CG2-CG 4.11Å; Y632-L637 HydrophobicContact CD1-CD2 4.4Å; Y632-L637 HydrophobicContact CD2-CD2 3.61Å; Y632-L637 HydrophobicContact CD2-CG 4.4Å; Y632-L637 HydrophobicContact CG-CD2 3.53Å; Y632-L637 HydrophobicContact CG-CG 4.15Å; Y632-L637 WeakPolarHBondContact O-CD1 3.42Å; D633-L637 WeakPolarHBondContact O-CG 3.41Å; D633-L637 PolarHBondContact O-N 3.29Å; D633-L637 VanDerWaalsContact O-N 3.09Å; L637-S641 VanDerWaalsContact O-CB 3.25Å; L637-S641 WeakPolarHBondContact O-CB 3.49Å; L637-S641 PolarHBondContact O-N 3.49Å; L637-L651 HydrophobicContact CB-CB 3.64Å; L637-L651 HydrophobicContact CB-CD1 3.78Å; L637-L651 HydrophobicContact CB-CG 4.24Å; L637-L651 HydrophobicContact CD1-CD1 3.7Å; L637-L651 HydrophobicContact CG-CD1 4.39Å; L637-L651 PolarHBondContact O-N 3.13Å
638	S	68.1	Low	66.8	Low	38 Å²	38	38.7 Å²	38.7	27%	0.266	21%	0.214	S	C	.	.	H	α-helix	trans	-89	12.2	172.5	-169.1	0	0	0	0	114.8	L634 K635 S636 S641	L634-S638 WeakPolarHBondContact O-CB 3.45Å; L634-S638 PolarHBondContact O-N 3.29Å; K635-S638 CarbonylContact O-C 3.01Å; K635-S638 PolarHBondContact O-N 2.82Å; S636-S638 PolarHBondContact O-N 3.18Å; S638-S641 WeakPolarHBondContact CA-OG 3.27Å; S638-S641 PolarHBondContact O-OG 2.64Å
639	Q	67.1	Low	67.1	Low	82 Å²	82	39.1 Å²	39.1	38%	0.383	22%	0.216	S	C	.	.	H	α-helix	trans	-117.6	-45.9	167.4	-78.8	158.8	55.6	0	0	109.6	K635 S636 S641 D642 L643 D1188	K635-Q639 VanDerWaalsContact C-NE2 3.31Å; K635-Q639 WeakPolarHBondContact O-CB 3.47Å; K635-Q639 WeakPolarHBondContact O-CG 3.24Å; K635-Q639 PolarHBondContact O-N 3.01Å; K635-Q639 PolarHBondContact O-NE2 3.14Å; S636-Q639 PolarHBondContact O-N 2.8Å; Q639-S641 PolarHBondContact O-N 3.04Å; Q639-D642 WeakPolarHBondContact O-CA 3.2Å; Q639-D642 WeakPolarHBondContact O-CB 3.46Å; Q639-D642 PolarHBondContact O-N 3.33Å; Q639-L643 VanDerWaalsContact O-CD1 3.28Å; Q639-L643 WeakPolarHBondContact O-CD1 3.4Å; Q639-L643 PolarHBondContact O-N 3.38Å; Q639-D1188 PolarHBondContact NE2-OD2 2.69Å
640	N	63.7	Low	67.2	Low	23 Å²	23	39.2 Å²	39.2	12%	0.123	22%	0.217	C	C	.	.	H	α-helix	trans	-61	-22	167.2	-65.7	-17.3	0	0	0	111.9	S636 D642 A648 P649 K753	S636-N640 WeakPolarHBondContact O-CB 3.04Å; S636-N640 VanDerWaalsContact O-CG 3.28Å; S636-N640 PolarHBondContact O-N 3.04Å; N640-D642 PolarHBondContact O-N 3.39Å; N640-A648 HydrophobicContact CB-CB 4.21Å; N640-P649 WeakPolarHBondContact CB-O 3.26Å; N640-P649 PolarHBondContact ND2-O 3.04Å; N640-K753 VanDerWaalsContact O-CE 3.27Å; N640-K753 WeakPolarHBondContact O-CE 3.33Å; N640-K753 PolarHBondContact O-NZ 2.85Å
641	S	59.4	Low	67.2	Low	9 Å²	9	39.4 Å²	39.4	6%	0.063	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-26.6	166.1	56.3	0	0	0	0	113.1	L637 S638 Q639 N751 K753	L637-S641 VanDerWaalsContact O-CB 3.25Å; L637-S641 WeakPolarHBondContact O-CB 3.49Å; L637-S641 PolarHBondContact O-N 3.49Å; S638-S641 WeakPolarHBondContact CA-OG 3.27Å; S638-S641 PolarHBondContact O-OG 2.64Å; Q639-S641 PolarHBondContact O-N 3.04Å; S641-N751 PolarHBondContact O-ND2 3.41Å; S641-K753 WeakPolarHBondContact O-CE 3.37Å
642	D	58.7	Low	66.9	Low	115 Å²	115	39.5 Å²	39.5	62%	0.615	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-109	-17.2	-170.2	-56.7	4	0	0	0	111.6	Q639 N640 S644 N751	Q639-D642 WeakPolarHBondContact O-CA 3.2Å; Q639-D642 WeakPolarHBondContact O-CB 3.46Å; Q639-D642 PolarHBondContact O-N 3.33Å; N640-D642 PolarHBondContact O-N 3.39Å; D642-S644 PolarHBondContact O-N 3.39Å; D642-N751 PolarHBondContact OD1-ND2 3.45Å
643	L	59.1	Low	66.6	Low	80 Å²	80	40.1 Å²	40.1	42%	0.419	22%	0.222	S	C	.	.			trans	-63.3	132.4	170.9	-93.3	80.4	0	0	0	111.3	Q639 S645 K753	Q639-L643 VanDerWaalsContact O-CD1 3.28Å; Q639-L643 WeakPolarHBondContact O-CD1 3.4Å; Q639-L643 PolarHBondContact O-N 3.38Å; L643-S645 PolarHBondContact O-N 3.23Å; L643-S645 VanDerWaalsContact O-N 3.12Å; L643-K753 PolarHBondContact O-NZ 3.4Å
644	S	55.1	Low	65.7	Low	117 Å²	117	40.5 Å²	40.5	82%	0.818	23%	0.227	S	C	*	.	S	Bend	trans	-65.6	-11.4	175.1	56	0	0	0	0	114.6	D642	D642-S644 PolarHBondContact O-N 3.39Å
645	S	57.6	Low	65	Low	44 Å²	44	44.7 Å²	44.7	31%	0.308	24%	0.242	S	C	.	.			trans	-88.9	111.6	179.8	61.4	0	0	0	0	112.7	L643 H647 A648	L643-S645 PolarHBondContact O-N 3.23Å; L643-S645 VanDerWaalsContact O-N 3.12Å; S645-H647 PolarHBondContact O-N 3.04Å; S645-A648 PolarHBondContact O-N 3.21Å
646	N	61.2	Low	64.3	Low	25 Å²	25	45.9 Å²	45.9	13%	0.134	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	14.5	170.1	-75.6	-11.2	0	0	0	114.7	K753 R754 F756	N646-K753 VanDerWaalsContact OD1-CD 3.29Å; N646-K753 WeakPolarHBondContact OD1-CD 3.27Å; N646-R754 PolarHBondContact ND2-O 2.88Å; N646-F756 HydrophobicContact CB-CD2 3.84Å; N646-F756 HydrophobicContact CB-CE2 3.83Å; N646-F756 WeakPolarHBondContact ND2-CE2 3.04Å
647	H	64.1	Low	63.4	Low	133 Å²	133	47.1 Å²	47.1	62%	0.616	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	0.2	174.1	-61.5	95.2	0	0	0	112.8	S645	S645-H647 PolarHBondContact O-N 3.04Å
648	A	68.3	Low	62.6	Low	15 Å²	15	54.2 Å²	54.2	12%	0.124	29%	0.293	C	S	.	.	S	Bend	trans	-114.3	146.1	179.9	0	0	0	0	0	111.6	N640 S645	N640-A648 HydrophobicContact CB-CB 4.21Å; S645-A648 PolarHBondContact O-N 3.21Å
649	P	77.4	Confident	62.1	Low	12 Å²	12	58.7 Å²	58.7	8%	0.078	31%	0.314	C	S	.	.			trans	-79.9	141	178.4	30	-31.9	0	0	0	112.3	I600 I627 Y632 N640	I600-P649 CarbonylContact O-C 3.37Å; I600-P649 WeakPolarHBondContact O-CA 3.27Å; I600-P649 VanDerWaalsContact O-CB 3.28Å; I600-P649 WeakPolarHBondContact O-CB 3.38Å; I627-P649 HydrophobicContact CD1-CG 4.15Å; Y632-P649 HydrophobicContact CD1-CB 4.08Å; Y632-P649 HydrophobicContact CD1-CG 3.49Å; Y632-P649 VanDerWaalsContact CD1-CG 3.49Å; Y632-P649 HydrophobicContact CD2-CB 4.4Å; Y632-P649 HydrophobicContact CE1-CB 3.57Å; Y632-P649 HydrophobicContact CE1-CG 2.98Å; Y632-P649 HydrophobicContact CE2-CB 3.81Å; Y632-P649 HydrophobicContact CE2-CG 4.19Å; Y632-P649 HydrophobicContact CG-CG 4.34Å; Y632-P649 WeakPolarHBondContact OH-CB 3.06Å; N640-P649 WeakPolarHBondContact CB-O 3.26Å; N640-P649 PolarHBondContact ND2-O 3.04Å
650	Y	74.5	Confident	61.9	Low	4 Å²	4	55.4 Å²	55.4	2%	0.016	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	164.8	-163.6	67.3	-82.8	0	0	0	114.2	I600 N751 K753 L755	I600-Y650 HydrophobicContact CB-CD1 4.3Å; I600-Y650 HydrophobicContact CB-CE1 3.9Å; I600-Y650 HydrophobicContact CB-CE2 4.45Å; I600-Y650 HydrophobicContact CD1-CE2 3.97Å; I600-Y650 HydrophobicContact CG2-CE1 3.8Å; I600-Y650 PolarHBondContact N-O 3.18Å; I600-Y650 PolarHBondContact O-N 2.86Å; Y650-N751 WeakPolarHBondContact CE2-O 3.4Å; Y650-K753 HydrophobicContact CD1-CD 4.33Å; Y650-K753 HydrophobicContact CD2-CD 4.32Å; Y650-K753 HydrophobicContact CD2-CG 4.01Å; Y650-K753 HydrophobicContact CE1-CB 4.36Å; Y650-K753 HydrophobicContact CE1-CD 4.43Å; Y650-K753 HydrophobicContact CE2-CB 3.89Å; Y650-K753 HydrophobicContact CE2-CD 4.43Å; Y650-K753 HydrophobicContact CE2-CG 3.83Å; Y650-K753 HydrophobicContact CG-CD 4.28Å; Y650-K753 HydrophobicContact CG-CG 4.47Å; Y650-K753 PolarHBondContact OH-O 3.32Å; Y650-L755 VanDerWaalsContact OH-CD2 3.3Å; Y650-L755 WeakPolarHBondContact OH-CD2 2.92Å
651	L	73.1	Confident	62.3	Low	3 Å²	3	55 Å²	55	2%	0.016	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	133.5	175.9	-151.8	66.3	0	0	0	110.7	Y597 I599 L634 L637 I748	Y597-L651 HydrophobicContact CD1-CD2 4.33Å; I599-L651 HydrophobicContact CG1-CD1 3.98Å; L634-L651 HydrophobicContact CD2-CD1 3.87Å; L634-L651 HydrophobicContact CD2-CD2 4.39Å; L637-L651 HydrophobicContact CB-CB 3.64Å; L637-L651 HydrophobicContact CB-CD1 3.78Å; L637-L651 HydrophobicContact CB-CG 4.24Å; L637-L651 HydrophobicContact CD1-CD1 3.7Å; L637-L651 HydrophobicContact CG-CD1 4.39Å; L637-L651 PolarHBondContact O-N 3.13Å; L651-I748 HydrophobicContact CD2-CG2 3.51Å
652	A	68.1	Low	62.5	Low	2 Å²	2	61.2 Å²	61.2	2%	0.017	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	-28.4	179.3	0	0	0	0	0	114.1	V598 I600 L672 V750	V598-A652 HydrophobicContact CG1-CB 4.48Å; V598-A652 PolarHBondContact O-N 2.86Å; I600-A652 HydrophobicContact CD1-CB 3.58Å; I600-A652 HydrophobicContact CG1-CB 4.01Å; A652-L672 HydrophobicContact CB-CD2 3.65Å; A652-V750 VanDerWaalsContact O-CG1 3.25Å; A652-V750 WeakPolarHBondContact O-CG1 2.9Å
653	L	66.9	Low	62.5	Low	14 Å²	14	61 Å²	61	7%	0.073	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	146.5	179.7	-174.1	136.3	0	0	0	111.4	Y597 V598 R655 I670	Y597-L653 CarbonylContact C-O 3.15Å; Y597-L653 WeakPolarHBondContact CA-O 3.12Å; V598-L653 HydrophobicContact CB-CB 4.09Å; V598-L653 HydrophobicContact CG2-CB 4.2Å; V598-L653 HydrophobicContact CG2-CD2 4.43Å; V598-L653 PolarHBondContact N-O 2.77Å; L653-R655 HydrophobicContact CD2-CB 4.24Å; L653-R655 HydrophobicContact CD2-CG 4.07Å; L653-R655 HydrophobicContact CG-CG 4.49Å; L653-I670 HydrophobicContact CD1-CD1 4.08Å; L653-I670 HydrophobicContact CD1-CG1 4.4Å; L653-I670 HydrophobicContact CD1-CG2 4.25Å; L653-I670 HydrophobicContact CD2-CD1 4.16Å
654	A	53.4	Low	62.4	Low	25 Å²	25	63 Å²	63	21%	0.207	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	124.3	169.5	0	0	0	0	0	109.1	Y596 Y597 I748	Y596-A654 WeakPolarHBondContact O-CA 3.29Å; Y597-A654 HydrophobicContact CD1-CB 3.49Å; Y597-A654 VanDerWaalsContact CD1-CB 3.49Å; Y597-A654 HydrophobicContact CE1-CB 3.76Å; A654-I748 HydrophobicContact CB-CB 4.21Å; A654-I748 HydrophobicContact CB-CG2 4.17Å
655	R	57.8	Low	62.7	Low	103 Å²	103	61.9 Å²	61.9	39%	0.389	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	146.1	175.9	-79	-168.5	175.2	-159.5	-0.2	113	N595 Y596 L653	N595-R655 WeakPolarHBondContact CA-O 3.47Å; Y596-R655 PolarHBondContact N-O 3.46Å; Y596-R655 PolarHBondContact O-N 2.94Å; L653-R655 HydrophobicContact CD2-CB 4.24Å; L653-R655 HydrophobicContact CD2-CG 4.07Å; L653-R655 HydrophobicContact CG-CG 4.49Å
656	H	56.1	Low	63.6	Low	117 Å²	117	65 Å²	65	54%	0.542	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	144.7	166.1	-97.3	-44.3	0	0	0	111.6	H594 N595 I658	H594-H656 WeakPolarHBondContact O-CA 3.44Å; H594-H656 PolarHBondContact O-ND1 3.08Å; N595-H656 PolarHBondContact OD1-CE1 2.74Å; N595-H656 PolarHBondContact OD1-ND1 2.8Å; H656-I658 PolarHBondContact O-N 3.46Å
657	T	52.2	Low	64.2	Low	29 Å²	29	66.7 Å²	66.7	18%	0.178	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-63.7	-36	-172.4	44.3	0	0	0	0	115.5	I593 H594 Y596 N659 L660	I593-T657 VanDerWaalsContact C-CG2 3.46Å; I593-T657 HydrophobicContact CB-CG2 3.72Å; I593-T657 HydrophobicContact CG2-CG2 3.53Å; I593-T657 WeakPolarHBondContact O-CB 2.98Å; I593-T657 VanDerWaalsContact O-CG2 3.23Å; I593-T657 WeakPolarHBondContact O-CG2 3.4Å; I593-T657 PolarHBondContact O-OG1 3.35Å; H594-T657 VanDerWaalsContact C-CG2 3.45Å; H594-T657 PolarHBondContact O-N 2.7Å; H594-T657 PolarHBondContact O-OG1 3.21Å; Y596-T657 HydrophobicContact CD2-CG2 3.5Å; Y596-T657 VanDerWaalsContact CD2-CG2 3.5Å; Y596-T657 HydrophobicContact CE2-CG2 3.37Å; T657-N659 PolarHBondContact O-N 2.6Å; T657-L660 PolarHBondContact O-N 3.44Å; T657-L660 VanDerWaalsContact O-N 3.11Å
658	I	52.5	Low	64.6	Low	149 Å²	149	60.9 Å²	60.9	76%	0.764	32%	0.315	S	S	*	.	G	3₁₀ helix	trans	-51.4	-30.8	-176.6	-63.2	175	0	0	0	112.4	H656	H656-I658 PolarHBondContact O-N 3.46Å
659	N	57.1	Low	64.7	Low	132 Å²	132	61.3 Å²	61.3	71%	0.706	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-112.5	7.2	-174.7	-67.4	-20	0	0	0	114.9	T657	T657-N659 PolarHBondContact O-N 2.6Å
660	L	64.4	Low	64.5	Low	12 Å²	12	61 Å²	61	6%	0.063	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-32.1	179.9	-168.2	62.7	0	0	0	113.6	L583 Y596 T657 A668 I681	L583-L660 HydrophobicContact CD1-CD2 4.32Å; Y596-L660 HydrophobicContact CD1-CD2 4.41Å; Y596-L660 HydrophobicContact CD2-CD2 3.57Å; Y596-L660 HydrophobicContact CE2-CD2 4.32Å; Y596-L660 HydrophobicContact CG-CD2 3.63Å; T657-L660 PolarHBondContact O-N 3.44Å; T657-L660 VanDerWaalsContact O-N 3.11Å; L660-A668 HydrophobicContact CD1-CB 4.33Å; L660-A668 HydrophobicContact CG-CB 4.32Å; L660-A668 WeakPolarHBondContact O-CB 3.38Å; L660-I681 HydrophobicContact CD1-CD1 4.28Å
661	F	71.5	Confident	64.3	Low	15 Å²	15	62.6 Å²	62.6	7%	0.066	32%	0.322	C	S	.	.	S	Bend	trans	-127.5	125.7	178	-61.5	-89.4	0	0	0	110.1	H584 R585 Y596 A668	H584-F661 VanDerWaalsContact C-CZ 3.46Å; H584-F661 WeakPolarHBondContact O-CZ 3.17Å; R585-F661 HydrophobicContact CB-CD1 3.86Å; R585-F661 HydrophobicContact CB-CE1 3.9Å; R585-F661 HydrophobicContact CB-CG 4.2Å; R585-F661 HydrophobicContact CB-CZ 4.27Å; R585-F661 VanDerWaalsContact N-CE1 3.31Å; Y596-F661 HydrophobicContact CD2-CE2 4.11Å; Y596-F661 HydrophobicContact CE1-CE2 4.07Å; Y596-F661 AromaticContact CE2-CD2 3.96Å; Y596-F661 HydrophobicContact CE2-CD2 3.96Å; Y596-F661 AromaticContact CE2-CE2 3.5Å; Y596-F661 HydrophobicContact CE2-CE2 3.5Å; Y596-F661 AromaticContact CZ-CE2 3.5Å; Y596-F661 VanDerWaalsContact CZ-CE2 3.5Å; F661-A668 HydrophobicContact CD1-CB 4.18Å; F661-A668 HydrophobicContact CE1-CB 3.86Å; F661-A668 HydrophobicContact CZ-CB 4.26Å
662	K	62.7	Low	64.4	Low	140 Å²	140	62.5 Å²	62.5	61%	0.609	32%	0.322	S	S	*	.			trans	-58.9	151.5	170.1	-70.9	-178.6	179.4	-177.5	0	110.3	R585 N664 H665	R585-K662 PolarHBondContact NH2-O 2.93Å; K662-N664 PolarHBondContact O-N 3.39Å; K662-H665 HydrophobicContact CB-CB 4.12Å; K662-H665 WeakPolarHBondContact CB-CD2 3.41Å; K662-H665 WeakPolarHBondContact O-CB 3.46Å; K662-H665 PolarHBondContact O-N 2.86Å; K662-H665 VanDerWaalsContact O-N 3.11Å
663	P	58.7	Low	64.4	Low	109 Å²	109	62.4 Å²	62.4	71%	0.708	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.1	139	172.3	-25.8	35	0	0	0	111.2	H665	P663-H665 PolarHBondContact O-CD2 3.44Å; P663-H665 VanDerWaalsContact O-CD2 3.3Å; P663-H665 PolarHBondContact O-N 2.78Å; P663-H665 VanDerWaalsContact O-N 3.09Å
664	N	57.1	Low	64.2	Low	122 Å²	122	62.2 Å²	62.2	65%	0.652	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	16.1	-177.8	-51.5	3.3	0	0	0	115.6	K662	K662-N664 PolarHBondContact O-N 3.39Å
665	H	61.7	Low	64.2	Low	94 Å²	94	66.2 Å²	66.2	44%	0.435	34%	0.335	S	S	.	.			trans	-108	138	173.7	-76.4	-98.5	0	0	0	113.2	R585 K662 P663	R585-H665 PolarHBondContact NE-O 2.79Å; K662-H665 HydrophobicContact CB-CB 4.12Å; K662-H665 WeakPolarHBondContact CB-CD2 3.41Å; K662-H665 WeakPolarHBondContact O-CB 3.46Å; K662-H665 PolarHBondContact O-N 2.86Å; K662-H665 VanDerWaalsContact O-N 3.11Å; P663-H665 PolarHBondContact O-CD2 3.44Å; P663-H665 VanDerWaalsContact O-CD2 3.3Å; P663-H665 PolarHBondContact O-N 2.78Å; P663-H665 VanDerWaalsContact O-N 3.09Å
666	E	76	Confident	63.8	Low	110 Å²	110	69.1 Å²	69.1	51%	0.514	35%	0.353	S	S	.	.			trans	-88	-17.3	-174.5	-66	-175.1	164.4	0	0	115.9	H584 R585	H584-E666 CarbonylContact C-O 3.53Å; H584-E666 WeakPolarHBondContact CA-O 3.12Å; R585-E666 PolarHBondContact N-O 3.2Å
667	T	73.9	Confident	63.1	Low	60 Å²	60	66.1 Å²	66.1	37%	0.368	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	159.7	-165.3	55.7	0	0	0	0	114.1	L583 H584	L583-T667 VanDerWaalsContact O-CA 3.29Å; L583-T667 WeakPolarHBondContact O-CA 3.38Å; L583-T667 VanDerWaalsContact O-CB 3.32Å; L583-T667 WeakPolarHBondContact O-CB 3.17Å; H584-T667 VanDerWaalsContact CD2-CG2 3.48Å; H584-T667 WeakPolarHBondContact CD2-CG2 3.08Å
668	A	72.6	Confident	62.4	Low	12 Å²	12	70.7 Å²	70.7	10%	0.099	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	163.7	178.1	0	0	0	0	0	110.9	K582 L583 L660 F661	K582-A668 CarbonylContact C-O 3.32Å; K582-A668 WeakPolarHBondContact CA-O 3.48Å; L583-A668 PolarHBondContact N-O 3.21Å; L583-A668 PolarHBondContact O-N 2.91Å; L583-A668 VanDerWaalsContact O-N 3.14Å; L660-A668 HydrophobicContact CD1-CB 4.33Å; L660-A668 HydrophobicContact CG-CB 4.32Å; L660-A668 WeakPolarHBondContact O-CB 3.38Å; F661-A668 HydrophobicContact CD1-CB 4.18Å; F661-A668 HydrophobicContact CE1-CB 3.86Å; F661-A668 HydrophobicContact CZ-CB 4.26Å
669	V	70.8	Confident	61.5	Low	23 Å²	23	70.6 Å²	70.6	14%	0.139	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	143.6	-175.1	178.5	0	0	0	0	111.5	L563 E580 I581 K582	L563-V669 HydrophobicContact CD1-CG1 3.79Å; L563-V669 HydrophobicContact CD1-CG2 4.19Å; E580-V669 HydrophobicContact CG-CG1 4.08Å; I581-V669 CarbonylContact O-C 3.56Å; I581-V669 WeakPolarHBondContact O-CA 3.35Å; K582-V669 HydrophobicContact CB-CG2 4.41Å
670	I	74	Confident	60.4	Low	7 Å²	7	70.3 Å²	70.3	4%	0.036	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	149.1	-172.7	-64.4	174	0	0	0	110.6	I581 L583 V598 L653 L672	I581-I670 PolarHBondContact N-O 3.5Å; I581-I670 PolarHBondContact O-N 3.31Å; L583-I670 HydrophobicContact CD1-CD1 3.4Å; L583-I670 HydrophobicContact CD1-CG1 4.41Å; L583-I670 HydrophobicContact CG-CD1 3.97Å; V598-I670 HydrophobicContact CG2-CD1 3.75Å; L653-I670 HydrophobicContact CD1-CD1 4.08Å; L653-I670 HydrophobicContact CD1-CG1 4.4Å; L653-I670 HydrophobicContact CD1-CG2 4.25Å; L653-I670 HydrophobicContact CD2-CD1 4.16Å; I670-L672 HydrophobicContact CG2-CD2 4.2Å
671	I	70.7	Confident	59.1	Low	37 Å²	37	73 Å²	73	19%	0.19	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	143.1	176.5	-52.1	177.3	0	0	0	110.2	I578 I579 E580 F680	I578-I671 HydrophobicContact CG2-CG2 3.85Å; I579-I671 CarbonylContact O-C 3.55Å; I579-I671 WeakPolarHBondContact O-CA 3.16Å; E580-I671 HydrophobicContact CG-CG1 4.43Å; I671-F680 HydrophobicContact CD1-CB 4.2Å; I671-F680 HydrophobicContact CD1-CD1 4.46Å
672	L	75.4	Confident	57.1	Low	1 Å²	1	75.4 Å²	75.4	1%	0.005	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	154.6	-175.3	-58.6	175.2	0	0	0	112.4	I578 I579 I581 I600 A652 I670 N752 V763	I578-L672 CarbonylContact C-O 2.86Å; I578-L672 VanDerWaalsContact CA-O 3.23Å; I578-L672 WeakPolarHBondContact CA-O 3.29Å; I578-L672 WeakPolarHBondContact CG2-O 3.31Å; I579-L672 HydrophobicContact CB-CB 4.26Å; I579-L672 PolarHBondContact N-O 2.81Å; I579-L672 PolarHBondContact O-N 3.32Å; I581-L672 HydrophobicContact CD1-CD1 3.61Å; I581-L672 HydrophobicContact CG1-CD1 4.32Å; I600-L672 HydrophobicContact CD1-CD1 3.75Å; I600-L672 HydrophobicContact CD1-CD2 4.03Å; I600-L672 HydrophobicContact CD1-CG 4.34Å; I600-L672 HydrophobicContact CG1-CD1 4.45Å; A652-L672 HydrophobicContact CB-CD2 3.65Å; I670-L672 HydrophobicContact CG2-CD2 4.2Å; L672-N752 WeakPolarHBondContact CA-OD1 3.27Å; L672-V763 HydrophobicContact CD1-CG1 4.26Å; L672-V763 HydrophobicContact CD1-CG2 4.16Å
673	G	66.8	Low	55.4	Low	0 Å²	0	74.9 Å²	74.9	0%	0	39%	0.387	C	S	.	.	S	Bend	trans	93.8	11.4	170.9	0	0	0	0	0	117	N752	G673-N752 VanDerWaalsContact N-CG 3.33Å; G673-N752 PolarHBondContact N-ND2 2.91Å; G673-N752 PolarHBondContact N-OD1 3.28Å
674	S	62.2	Low	53.8	Low	9 Å²	9	74.3 Å²	74.3	6%	0.063	38%	0.381	C	S	.	.			trans	-136.8	125.4	174.7	-174.3	0	0	0	0	112.7	E676 N752	S674-E676 PolarHBondContact O-N 2.98Å; S674-E676 PolarHBondContact OG-N 3.23Å; S674-N752 CarbonylContact C-O 2.96Å; S674-N752 PolarHBondContact N-ND2 2.89Å; S674-N752 PolarHBondContact N-O 2.72Å; S674-N752 WeakPolarHBondContact O-CB 3.42Å; S674-N752 PolarHBondContact O-ND2 3.29Å
675	E	54.4	Low	52.4	Low	110 Å²	110	75.1 Å²	75.1	51%	0.514	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-17.9	176.1	-64.9	162.5	166.3	0	0	112.7	R754	E675-R754 VanDerWaalsContact CD-NE 3.34Å; E675-R754 HydrophobicContact CG-CG 4.48Å; E675-R754 IonicContact OE1-NE 3.43Å; E675-R754 PolarHBondContact OE1-NE 2.89Å; E675-R754 IonicContact OE2-CZ 2.64Å; E675-R754 IonicContact OE2-NE 3.43Å; E675-R754 PolarHBondContact OE2-NE 3.19Å; E675-R754 IonicContact OE2-NH2 2.79Å; E675-R754 PolarHBondContact OE2-NH2 3.17Å
676	E	49.6	Very low	50.6	Low	164 Å²	164	79.3 Å²	79.3	77%	0.766	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	4.9	-174.8	-60.7	179.4	156.9	0	0	113.2	S674	S674-E676 PolarHBondContact O-N 2.98Å; S674-E676 PolarHBondContact OG-N 3.23Å
677	V	40.6	Very low	48.2	Very low	53 Å²	53	83.4 Å²	83.4	32%	0.321	41%	0.407	S	S	.	.			trans	-113.5	58.2	-170.7	-169.9	0	0	0	0	111.9	N679 F680	V677-N679 PolarHBondContact O-N 3.36Å; V677-F680 HydrophobicContact CG1-CB 3.81Å
678	D	36.8	Very low	45.9	Very low	125 Å²	125	84.3 Å²	84.3	67%	0.668	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-10.9	174.9	-105.2	-31.3	0	0	0	114.2
679	N	33.6	Very low	43.7	Very low	147 Å²	147	89.9 Å²	89.9	79%	0.786	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.4	16.8	-156.3	-96.6	-55.3	0	0	0	117.2	V677	V677-N679 PolarHBondContact O-N 3.36Å
680	F	35.3	Very low	41.8	Very low	126 Å²	126	92.5 Å²	92.5	55%	0.553	46%	0.457	S	S	*	.			trans	-125.9	87.6	-174.8	-111.5	-113.3	0	0	0	114.9	I671 V677 L682	I671-F680 HydrophobicContact CD1-CB 4.2Å; I671-F680 HydrophobicContact CD1-CD1 4.46Å; V677-F680 HydrophobicContact CG1-CB 3.81Å; F680-L682 HydrophobicContact CD1-CD1 4.36Å; F680-L682 HydrophobicContact CD1-CG 3.82Å; F680-L682 HydrophobicContact CE1-CD1 4.46Å; F680-L682 HydrophobicContact CE1-CD2 4.23Å; F680-L682 HydrophobicContact CE1-CG 3.82Å
681	I	35.8	Very low	39.6	Very low	68 Å²	68	100.3 Å²	100.3	35%	0.349	49%	0.493	S	S	.	.			trans	-88.8	116.8	141.8	-67.6	-174.4	0	0	0	105.8	L660 E683	L660-I681 HydrophobicContact CD1-CD1 4.28Å; I681-E683 PolarHBondContact O-N 3.33Å
682	L	31.5	Very low	37.6	Very low	67 Å²	67	104 Å²	104	35%	0.351	52%	0.518	S	S	.	.			trans	-72.1	118.4	-171.4	-127.5	163.1	0	0	0	111.1	F680 T684	F680-L682 HydrophobicContact CD1-CD1 4.36Å; F680-L682 HydrophobicContact CD1-CG 3.82Å; F680-L682 HydrophobicContact CE1-CD1 4.46Å; F680-L682 HydrophobicContact CE1-CD2 4.23Å; F680-L682 HydrophobicContact CE1-CG 3.82Å; L682-T684 HydrophobicContact CB-CG2 4.43Å; L682-T684 HydrophobicContact CD2-CG2 4.45Å; L682-T684 PolarHBondContact O-N 3.17Å; L682-T684 PolarHBondContact O-OG1 3.16Å
683	E	26.5	Very low	35.3	Very low	129 Å²	129	109.8 Å²	109.8	60%	0.603	55%	0.548	S	S	*	.			trans	-69.7	73	176.7	-68.8	-159.6	110.3	0	0	112.4	I681 Q685 Y686	I681-E683 PolarHBondContact O-N 3.33Å; E683-Q685 PolarHBondContact O-N 3.34Å; E683-Y686 PolarHBondContact O-N 3.13Å; E683-Y686 WeakPolarHBondContact OE1-CD2 3.5Å; E683-Y686 WeakPolarHBondContact OE2-CD2 3.41Å
684	T	25.5	Very low	33.4	Very low	97 Å²	97	121.1 Å²	121.1	60%	0.595	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	37.8	-178.1	37.2	0	0	0	0	114.2	L682	L682-T684 HydrophobicContact CB-CG2 4.43Å; L682-T684 HydrophobicContact CD2-CG2 4.45Å; L682-T684 PolarHBondContact O-N 3.17Å; L682-T684 PolarHBondContact O-OG1 3.16Å
685	Q	26.7	Very low	31.8	Very low	139 Å²	139	127.4 Å²	127.4	65%	0.65	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-154.4	13	152.7	-121.3	170.1	5.3	0	0	116.4	E683 Y687	E683-Q685 PolarHBondContact O-N 3.34Å; Q685-Y687 PolarHBondContact O-N 3.46Å
686	Y	24.5	Very low	30.5	Very low	182 Å²	182	130.6 Å²	130.6	71%	0.714	64%	0.639	S	S	*	*			trans	-78.9	63.4	173.6	-120.4	-59.4	0	0	0	112.6	E683	E683-Y686 PolarHBondContact O-N 3.13Å; E683-Y686 WeakPolarHBondContact OE1-CD2 3.5Å; E683-Y686 WeakPolarHBondContact OE2-CD2 3.41Å
687	Y	24.8	Very low	29.5	Very low	196 Å²	196	128.4 Å²	128.4	77%	0.769	64%	0.637	S	S	*	*			trans	-166.4	62.8	169.9	-113	-57.6	0	0	0	115.2	Q685 K805	Q685-Y687 PolarHBondContact O-N 3.46Å; Y687-K805 VanDerWaalsContact O-CE 3.32Å; Y687-K805 WeakPolarHBondContact O-CE 3.41Å; Y687-K805 PolarHBondContact O-NZ 3.42Å
688	L	25	Very low	28.8	Very low	78 Å²	78	134.7 Å²	134.7	41%	0.408	66%	0.656	S	S	.	*	S	Bend	trans	-170	147.4	135.2	-100.5	-158	0	0	0	112.9	K805	L688-K805 HydrophobicContact CB-CG 4.34Å; L688-K805 HydrophobicContact CD1-CB 3.63Å; L688-K805 HydrophobicContact CD1-CD 4.12Å; L688-K805 HydrophobicContact CD1-CG 3.92Å; L688-K805 HydrophobicContact CG-CB 4.14Å; L688-K805 HydrophobicContact CG-CD 4.01Å; L688-K805 HydrophobicContact CG-CG 3.86Å
689	H	26.6	Very low	28.4	Very low	129 Å²	129	133.6 Å²	133.6	60%	0.597	65%	0.65	S	S	*	*			trans	54.2	145	163.3	-73.1	-66	0	0	0	121.9
690	A	31.1	Very low	28.1	Very low	79 Å²	79	135.6 Å²	135.6	65%	0.653	65%	0.647	S	S	*	*			trans	66.1	86.1	170.6	0	0	0	0	0	116.3
691	Q	28	Very low	27.8	Very low	170 Å²	170	136.1 Å²	136.1	79%	0.794	66%	0.655	S	S	*	*			cis	54.3	102.9	10.5	-148.4	-176.1	35	0	0	116.5
692	T	28.4	Very low	27.5	Very low	116 Å²	116	138.3 Å²	138.3	71%	0.712	67%	0.672	S	S	*	*			trans	68.9	146.6	-176.7	77	0	0	0	0	114.6
693	N	28.8	Very low	27.4	Very low	122 Å²	122	142.6 Å²	142.6	65%	0.652	69%	0.688	S	S	*	*			cis	-156.3	126.2	-22.3	-101.3	-15.8	0	0	0	104.5
694	R	26.6	Very low	27.6	Very low	238 Å²	238	142.9 Å²	142.9	90%	0.898	69%	0.689	S	S	*	*				37.1	83.8	57.5	-96.9	-166.2	-180	178.5	2.5	112.4
695	N	27.6	Very low	27.7	Very low	141 Å²	141	143.9 Å²	143.9	75%	0.754	70%	0.695	S	S	*	*			trans	-166.9	147.4	143.5	-104	-31.4	0	0	0	112.9
696	Q	27.8	Very low	27.8	Very low	176 Å²	176	142.6 Å²	142.6	82%	0.822	70%	0.697	S	S	*	*			trans	70.7	134.7	175.9	-52.6	176.3	15.4	0	0	115.3
697	T	27.8	Very low	28	Very low	119 Å²	119	140.7 Å²	140.7	73%	0.73	70%	0.699	S	S	*	*			cis	-170.5	154.9	-15.4	24.6	0	0	0	0	105.4
698	Y	25.9	Very low	28	Very low	185 Å²	185	139.1 Å²	139.1	73%	0.725	70%	0.703	S	S	*	*			cis	-160.4	152.9	10.4	-147.7	-145.4	0	0	0	110.1
699	N	28.6	Very low	28.1	Very low	101 Å²	101	138.6 Å²	138.6	54%	0.54	72%	0.717	S	S	.	*			trans	60.8	146.7	156.1	-70.7	-9.5	0	0	0	120.1
700	R	28	Very low	28.3	Very low	189 Å²	189	138.2 Å²	138.2	71%	0.713	73%	0.728	S	S	*	*			cis	-164	147.6	-15.1	-121.5	172.8	-177.2	167.8	-0.2	109.7
701	N	29	Very low	28.1	Very low	137 Å²	137	142.1 Å²	142.1	73%	0.733	73%	0.727	S	S	*	*			trans	67.9	153.1	152	-60.1	-6.1	0	0	0	119.7
702	V	28.2	Very low	28	Very low	115 Å²	115	142.5 Å²	142.5	70%	0.697	72%	0.723	S	S	*	*			cis	-174.4	149.5	-37.3	103.9	0	0	0	0	108.9
703	K	29.9	Very low	28	Very low	157 Å²	157	144 Å²	144	68%	0.683	72%	0.722	S	S	*	*			trans	66.3	162.2	170.8	-70	165.7	160.3	-76.1	0	116.9
704	E	30.7	Very low	28	Very low	135 Å²	135	144.2 Å²	144.2	63%	0.631	72%	0.723	S	S	*	*			cis	-156.4	130.6	-21.2	-114.7	156.2	-178.4	0	0	112.3
705	T	27.9	Very low	28	Very low	117 Å²	117	136.3 Å²	136.3	72%	0.718	72%	0.716	S	S	*	*			trans	45.3	140.8	139.5	56	0	0	0	0	126.2
706	T	27.9	Very low	28.2	Very low	113 Å²	113	135.4 Å²	135.4	69%	0.693	72%	0.715	S	S	*	*			trans	81.1	120.8	139.4	44.6	0	0	0	0	124.1
707	D	28.6	Very low	28.2	Very low	142 Å²	142	131.6 Å²	131.6	76%	0.759	71%	0.708	S	S	*	*				73.7	110.4	127	-54.8	-10.9	0	0	0	125.1
708	L	26	Very low	28.4	Very low	163 Å²	163	132.2 Å²	132.2	85%	0.853	71%	0.707	S	S	*	*				57.6	113.9	112.2	-148.8	81.8	0	0	0	121.5
709	G	27.5	Very low	28.6	Very low	67 Å²	67	130.1 Å²	130.1	69%	0.691	71%	0.707	S	S	*	*			trans	159.5	148.1	155.2	0	0	0	0	0	118.8
710	S	30	Very low	28.8	Very low	120 Å²	120	133.3 Å²	133.3	84%	0.839	72%	0.718	S	S	*	*			trans	41.9	126.4	155.6	47.4	0	0	0	0	120.3
711	Y	26	Very low	29	Very low	162 Å²	162	132.1 Å²	132.1	64%	0.635	72%	0.721	S	S	*	*			cis	70.4	138.7	33.5	-120.6	-72.4	0	0	0	115.5
712	Y	27.6	Very low	29.1	Very low	177 Å²	177	131.4 Å²	131.4	69%	0.694	72%	0.721	S	S	*	*			trans	78	134.7	175.9	-67.5	-66.1	0	0	0	117.4
713	Q	27.8	Very low	29.2	Very low	149 Å²	149	132.7 Å²	132.7	70%	0.696	72%	0.724	S	S	*	*				51.1	136.9	89.8	-75.2	-178.4	-89.5	0	0	113.8
714	D	28.8	Very low	29.1	Very low	125 Å²	125	129.9 Å²	129.9	67%	0.668	73%	0.725	S	S	*	*			cis	-149	178.2	9.1	-130.4	-37.5	0	0	0	113
715	G	27.5	Very low	29.1	Very low	73 Å²	73	131 Å²	131	75%	0.753	73%	0.73	S	S	*	*			trans	-151.6	29	-175.4	0	0	0	0	0	116.5
716	T	31.2	Very low	29.2	Very low	121 Å²	121	132.1 Å²	132.1	74%	0.742	73%	0.729	S	S	*	*			trans	-67.7	151.1	177	44	0	0	0	0	113.2
717	S	26.9	Very low	29.1	Very low	97 Å²	97	130.9 Å²	130.9	68%	0.678	73%	0.726	S	S	*	*			trans	-70.8	145.9	166.9	60.8	0	0	0	0	111.4
718	D	32.1	Very low	29.3	Very low	131 Å²	131	132.8 Å²	132.8	70%	0.701	73%	0.727	S	S	*	*				175.1	110.5	116.4	-81.3	-4.5	0	0	0	108.3
719	I	31.1	Very low	29.4	Very low	141 Å²	141	131.1 Å²	131.1	72%	0.723	72%	0.719	S	S	*	*				47.1	79.1	99.9	-44.8	171.3	0	0	0	113.8
720	H	31.5	Very low	29.4	Very low	169 Å²	169	133.8 Å²	133.8	78%	0.782	72%	0.717	S	S	*	*				-175.9	160.9	113	-107.2	-79	0	0	0	114.1
721	E	32.4	Very low	29.4	Very low	164 Å²	164	135.7 Å²	135.7	77%	0.766	71%	0.713	S	S	*	*			trans	67.2	110.5	158.3	-70.1	-177.4	165.3	0	0	122.6
722	T	31	Very low	29.7	Very low	121 Å²	121	133.7 Å²	133.7	74%	0.742	71%	0.713	S	S	*	*			trans	73.4	124.5	138.9	56.4	0	0	0	0	122.5
723	D	30.3	Very low	29.8	Very low	142 Å²	142	133.1 Å²	133.1	76%	0.759	72%	0.715	S	S	*	*			trans	65.5	76	133.9	-59.6	-0.8	0	0	0	121.7
724	S	27.5	Very low	30.2	Very low	99 Å²	99	131 Å²	131	69%	0.692	71%	0.714	S	S	*	*				101.5	145.6	106.6	82.1	0	0	0	0	121.3
725	H	31.8	Very low	30	Very low	159 Å²	159	135.6 Å²	135.6	74%	0.736	72%	0.723	S	S	*	*			trans	68.7	123	148.3	-71.1	-52	0	0	0	123.1
726	I	29.4	Very low	30	Very low	139 Å²	139	141.9 Å²	141.9	71%	0.713	73%	0.726	S	S	*	*			trans	70	90.8	134.9	-60.3	170.3	0	0	0	115
727	S	27.3	Very low	29.7	Very low	88 Å²	88	143.6 Å²	143.6	62%	0.615	73%	0.725	S	S	*	*				72.9	142.8	74	84.3	0	0	0	0	116.2
728	K	30.8	Very low	29.6	Very low	182 Å²	182	144.1 Å²	144.1	79%	0.791	72%	0.72	S	S	*	*			trans	80.7	152.2	175.1	-54.2	170.7	-175	173.3	0	115
729	N	28.1	Very low	29.3	Very low	128 Å²	128	145.1 Å²	145.1	68%	0.684	72%	0.719	S	S	*	*			cis	-165.5	158.2	-19.8	-108	10.5	0	0	0	109.5
730	N	29.3	Very low	29	Very low	122 Å²	122	145 Å²	145	65%	0.652	72%	0.72	S	S	*	*			trans	68.1	156.6	142.3	-72.9	23.4	0	0	0	124.4
731	E	30.1	Very low	28.7	Very low	160 Å²	160	139.3 Å²	139.3	75%	0.748	71%	0.707	S	S	*	*			trans	87.5	79.2	141.6	-80.9	150	-115.4	0	0	122.3
732	D	31.1	Very low	28.4	Very low	120 Å²	120	138.6 Å²	138.6	64%	0.642	71%	0.708	S	S	*	*				60.4	117.6	109.2	-91.1	-17.2	0	0	0	123.7
733	K	29.4	Very low	28.1	Very low	166 Å²	166	140.8 Å²	140.8	72%	0.722	71%	0.712	S	S	*	*			trans	77	177.1	132.4	-57.9	177.2	174.1	91.7	0	116.4
734	P	37.3	Very low	27.9	Very low	105 Å²	105	141.4 Å²	141.4	68%	0.682	71%	0.708	S	S	*	*				-136.8	176.3	-103.9	33.9	-9.8	0	0	0	115.6
735	Y	24.2	Very low	27.7	Very low	221 Å²	221	143.1 Å²	143.1	87%	0.867	71%	0.707	S	S	*	*			trans	171.8	174.3	130.9	-108.9	-87	0	0	0	111.3
736	Y	27.8	Very low	27.6	Very low	205 Å²	205	143.1 Å²	143.1	80%	0.804	71%	0.705	S	S	*	*			trans	-73.7	137.2	179.9	-74	-112.8	0	0	0	112.9
737	H	24.8	Very low	27.4	Very low	156 Å²	156	141.8 Å²	141.8	72%	0.722	70%	0.703	S	S	*	*				-169.1	125.7	122.6	-107.3	-68.4	0	0	0	114.4
738	N	24.9	Very low	27.5	Very low	109 Å²	109	140.7 Å²	140.7	58%	0.583	69%	0.69	S	S	*	*			trans	36.2	136.2	133	-69.5	3.5	0	0	0	123.8
739	F	24.3	Very low	27.9	Very low	151 Å²	151	138.4 Å²	138.4	66%	0.662	68%	0.682	S	S	*	*			trans	70.9	150	145.7	-75.2	-136.9	0	0	0	115.2	M745	F739-M745 HydrophobicContact CE1-CE 4.34Å; F739-M745 HydrophobicContact CZ-CE 4.12Å
740	N	25.5	Very low	28.8	Very low	139 Å²	139	135.1 Å²	135.1	74%	0.743	67%	0.666	S	S	*	*			cis	-138.1	178.5	16	-74.6	-76.4	0	0	0	111.2
741	G	25.8	Very low	30	Very low	50 Å²	50	131 Å²	131	52%	0.515	64%	0.644	S	S	.	*			trans	168.5	12.3	166.5	0	0	0	0	0	121.8
742	D	25.4	Very low	31.7	Very low	149 Å²	149	123.8 Å²	123.8	80%	0.797	61%	0.611	S	S	*	*			trans	62.8	164.2	169.1	-61.7	-30.3	0	0	0	120.5
743	M	25.3	Very low	33.6	Very low	166 Å²	166	119 Å²	119	82%	0.818	58%	0.584	S	S	*	*	S	Bend	trans	56.7	85.7	170	-163.6	170.6	173.5	0	0	116.9
744	F	25.5	Very low	35.7	Very low	156 Å²	156	113.7 Å²	113.7	68%	0.684	56%	0.56	S	S	*	*	S	Bend	cis	-128.3	76.7	9.6	-104.2	-86.2	0	0	0	111.7	K746	F744-K746 HydrophobicContact CD1-CB 4Å; F744-K746 HydrophobicContact CD1-CD 4.21Å; F744-K746 HydrophobicContact CD1-CG 3.79Å; F744-K746 HydrophobicContact CE1-CD 3.91Å; F744-K746 HydrophobicContact CE1-CG 3.93Å; F744-K746 PolarHBondContact O-N 3.33Å
745	M	23.7	Very low	37.5	Very low	135 Å²	135	108.7 Å²	108.7	67%	0.665	53%	0.527	S	S	*	.			trans	-62.4	78.2	138.2	-85.5	-74.7	-155.3	0	0	108.7	F739	F739-M745 HydrophobicContact CE1-CE 4.34Å; F739-M745 HydrophobicContact CZ-CE 4.12Å
746	K	29.3	Very low	39.9	Very low	159 Å²	159	99.1 Å²	99.1	69%	0.691	49%	0.49	S	S	*	.			trans	-102.7	99.3	143.4	-88.4	-163.4	175.4	-169.3	0	107.2	F744 I748	F744-K746 HydrophobicContact CD1-CB 4Å; F744-K746 HydrophobicContact CD1-CD 4.21Å; F744-K746 HydrophobicContact CD1-CG 3.79Å; F744-K746 HydrophobicContact CE1-CD 3.91Å; F744-K746 HydrophobicContact CE1-CG 3.93Å; F744-K746 PolarHBondContact O-N 3.33Å; K746-I748 VanDerWaalsContact C-N 3.28Å; K746-I748 PolarHBondContact O-N 3.48Å
747	T	25.1	Very low	41.9	Very low	110 Å²	110	91.8 Å²	91.8	68%	0.675	46%	0.463	S	S	*	.			trans	-37.5	94.5	149.4	33.6	0	0	0	0	110.1	Q749	T747-Q749 VanDerWaalsContact C-N 3.26Å; T747-Q749 PolarHBondContact O-N 2.97Å
748	I	29.2	Very low	43.8	Very low	65 Å²	65	88.1 Å²	88.1	33%	0.333	46%	0.455	S	S	.	.			trans	-69.6	99.4	158.4	-64.7	-178.2	0	0	0	104.3	L651 A654 K746	L651-I748 HydrophobicContact CD2-CG2 3.51Å; A654-I748 HydrophobicContact CB-CB 4.21Å; A654-I748 HydrophobicContact CB-CG2 4.17Å; K746-I748 VanDerWaalsContact C-N 3.28Å; K746-I748 PolarHBondContact O-N 3.48Å
749	Q	38.9	Very low	45.9	Very low	135 Å²	135	83.9 Å²	83.9	63%	0.631	43%	0.433	S	S	*	.			trans	-58.7	150.2	-172.7	-70.6	169.6	-100.5	0	0	110.6	T747 N751	T747-Q749 VanDerWaalsContact C-N 3.26Å; T747-Q749 PolarHBondContact O-N 2.97Å; Q749-N751 WeakPolarHBondContact CB-OD1 3.19Å; Q749-N751 PolarHBondContact O-N 2.65Å
750	V	48.1	Very low	48.5	Very low	59 Å²	59	78.2 Å²	78.2	36%	0.358	41%	0.409	S	S	.	.			trans	-75	72.7	172.6	-174.4	0	0	0	0	107	A652 N752	A652-V750 VanDerWaalsContact O-CG1 3.25Å; A652-V750 WeakPolarHBondContact O-CG1 2.9Å; V750-N752 HydrophobicContact CG1-CB 4.39Å; V750-N752 PolarHBondContact O-N 2.88Å
751	N	53.3	Low	51.2	Low	36 Å²	36	71.7 Å²	71.7	19%	0.193	38%	0.375	C	S	.	.			trans	-72.9	72.5	-176.3	-84	26.9	0	0	0	110.6	S641 D642 Y650 Q749 K753	S641-N751 PolarHBondContact O-ND2 3.41Å; D642-N751 PolarHBondContact OD1-ND2 3.45Å; Y650-N751 WeakPolarHBondContact CE2-O 3.4Å; Q749-N751 WeakPolarHBondContact CB-OD1 3.19Å; Q749-N751 PolarHBondContact O-N 2.65Å; N751-K753 PolarHBondContact O-N 2.86Å
752	N	67.8	Low	54	Low	8 Å²	8	71.5 Å²	71.5	4%	0.043	36%	0.358	C	S	.	.			trans	-82.2	61	-170.2	-160.5	20.3	0	0	0	111.8	L672 G673 S674 V750	L672-N752 WeakPolarHBondContact CA-OD1 3.27Å; G673-N752 VanDerWaalsContact N-CG 3.33Å; G673-N752 PolarHBondContact N-ND2 2.91Å; G673-N752 PolarHBondContact N-OD1 3.28Å; S674-N752 CarbonylContact C-O 2.96Å; S674-N752 PolarHBondContact N-ND2 2.89Å; S674-N752 PolarHBondContact N-O 2.72Å; S674-N752 WeakPolarHBondContact O-CB 3.42Å; S674-N752 PolarHBondContact O-ND2 3.29Å; V750-N752 HydrophobicContact CG1-CB 4.39Å; V750-N752 PolarHBondContact O-N 2.88Å
753	K	69.1	Low	56.9	Low	19 Å²	19	64.5 Å²	64.5	8%	0.083	32%	0.321	C	S	.	.			trans	-51.9	143.9	-171.1	-59.6	-161.6	-175.4	-171.8	0	113.2	N640 S641 L643 N646 Y650 N751 L755	N640-K753 VanDerWaalsContact O-CE 3.27Å; N640-K753 WeakPolarHBondContact O-CE 3.33Å; N640-K753 PolarHBondContact O-NZ 2.85Å; S641-K753 WeakPolarHBondContact O-CE 3.37Å; L643-K753 PolarHBondContact O-NZ 3.4Å; N646-K753 VanDerWaalsContact OD1-CD 3.29Å; N646-K753 WeakPolarHBondContact OD1-CD 3.27Å; Y650-K753 HydrophobicContact CD1-CD 4.33Å; Y650-K753 HydrophobicContact CD2-CD 4.32Å; Y650-K753 HydrophobicContact CD2-CG 4.01Å; Y650-K753 HydrophobicContact CE1-CB 4.36Å; Y650-K753 HydrophobicContact CE1-CD 4.43Å; Y650-K753 HydrophobicContact CE2-CB 3.89Å; Y650-K753 HydrophobicContact CE2-CD 4.43Å; Y650-K753 HydrophobicContact CE2-CG 3.83Å; Y650-K753 HydrophobicContact CG-CD 4.28Å; Y650-K753 HydrophobicContact CG-CG 4.47Å; Y650-K753 PolarHBondContact OH-O 3.32Å; N751-K753 PolarHBondContact O-N 2.86Å; K753-L755 PolarHBondContact O-N 2.76Å
754	R	73.7	Confident	59.8	Low	55 Å²	55	56.6 Å²	56.6	21%	0.208	28%	0.282	C	S	.	.			trans	-53.1	126	169.5	-60.3	175.9	-174.8	-126.8	-10.4	110.8	P570 D571 T576 N646 E675	P570-R754 PolarHBondContact O-NH1 3.23Å; D571-R754 WeakPolarHBondContact OD2-CD 3.18Å; T576-R754 HydrophobicContact CG2-CB 4.08Å; N646-R754 PolarHBondContact ND2-O 2.88Å; E675-R754 VanDerWaalsContact CD-NE 3.34Å; E675-R754 HydrophobicContact CG-CG 4.48Å; E675-R754 IonicContact OE1-NE 3.43Å; E675-R754 PolarHBondContact OE1-NE 2.89Å; E675-R754 IonicContact OE2-CZ 2.64Å; E675-R754 IonicContact OE2-NE 3.43Å; E675-R754 PolarHBondContact OE2-NE 3.19Å; E675-R754 IonicContact OE2-NH2 2.79Å; E675-R754 PolarHBondContact OE2-NH2 3.17Å
755	L	76.2	Confident	62.7	Low	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	105.3	-179.2	-60.4	162.8	0	0	0	109.9	T576 S577 I579 Y650 K753 Q757 Y761	T576-L755 CarbonylContact C-O 3.05Å; T576-L755 WeakPolarHBondContact CA-O 3.5Å; S577-L755 PolarHBondContact N-O 2.81Å; S577-L755 WeakPolarHBondContact O-CB 3.33Å; I579-L755 HydrophobicContact CD1-CD1 3.42Å; I579-L755 VanDerWaalsContact CD1-CD1 3.42Å; I579-L755 HydrophobicContact CG1-CD1 3.71Å; Y650-L755 VanDerWaalsContact OH-CD2 3.3Å; Y650-L755 WeakPolarHBondContact OH-CD2 2.92Å; K753-L755 PolarHBondContact O-N 2.76Å; L755-Q757 PolarHBondContact O-N 3.28Å; L755-Y761 HydrophobicContact CB-CD2 4.47Å; L755-Y761 HydrophobicContact CB-CE2 3.87Å; L755-Y761 HydrophobicContact CD2-CD1 3.7Å; L755-Y761 HydrophobicContact CD2-CD2 4.14Å; L755-Y761 HydrophobicContact CD2-CE1 3.56Å; L755-Y761 HydrophobicContact CD2-CE2 4.02Å; L755-Y761 HydrophobicContact CD2-CG 4Å
756	F	74	Confident	65.6	Low	19 Å²	19	43.4 Å²	43.4	8%	0.083	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	133.7	176.7	-66.8	-54.8	0	0	0	112.4	D571 Q573 P575 T576 N646 S758 T759 Y761	D571-F756 HydrophobicContact CB-CE1 4.24Å; Q573-F756 HydrophobicContact CB-CE1 3.99Å; Q573-F756 HydrophobicContact CB-CZ 3.67Å; P575-F756 WeakPolarHBondContact O-CA 3.5Å; T576-F756 HydrophobicContact CG2-CD1 3.94Å; T576-F756 HydrophobicContact CG2-CE1 4.06Å; N646-F756 HydrophobicContact CB-CD2 3.84Å; N646-F756 HydrophobicContact CB-CE2 3.83Å; N646-F756 WeakPolarHBondContact ND2-CE2 3.04Å; F756-S758 PolarHBondContact O-N 2.62Å; F756-T759 PolarHBondContact O-N 3.15Å; F756-Y761 PolarHBondContact N-OH 3.42Å; F756-Y761 WeakPolarHBondContact O-CE2 3.42Å; F756-Y761 PolarHBondContact O-OH 3.3Å
757	Q	70.7	Confident	68.3	Low	52 Å²	52	35.8 Å²	35.8	24%	0.243	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-28.3	-177.7	-66	176.3	5.1	0	0	113.3	P575 T576 L755 T759 P789 I790	P575-Q757 HydrophobicContact CB-CG 4.39Å; P575-Q757 HydrophobicContact CG-CB 4.37Å; P575-Q757 PolarHBondContact O-N 3.07Å; T576-Q757 PolarHBondContact O-NE2 2.93Å; L755-Q757 PolarHBondContact O-N 3.28Å; Q757-T759 PolarHBondContact O-N 3.36Å; Q757-T759 VanDerWaalsContact O-N 3.13Å; Q757-P789 HydrophobicContact CB-CB 4.42Å; Q757-P789 HydrophobicContact CG-CB 4.22Å; Q757-I790 HydrophobicContact CB-CG1 4.21Å; Q757-I790 VanDerWaalsContact O-CD1 3.31Å; Q757-I790 WeakPolarHBondContact O-CD1 3.34Å; Q757-I790 VanDerWaalsContact O-CG1 3.28Å; Q757-I790 WeakPolarHBondContact O-CG1 3.33Å
758	S	64.1	Low	70.9	Confident	79 Å²	79	30.6 Å²	30.6	55%	0.552	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.6	-7	177	54.2	0	0	0	0	115	F756	F756-S758 PolarHBondContact O-N 2.62Å
759	T	68.8	Low	73.3	Confident	20 Å²	20	27.5 Å²	27.5	12%	0.123	14%	0.139	C	C	.	.	S	Bend	trans	-122.2	138.4	-169.8	-57	0	0	0	0	110.6	P602 F756 Q757 Y761 P789	P602-T759 HydrophobicContact CB-CG2 3.41Å; P602-T759 VanDerWaalsContact CB-CG2 3.41Å; F756-T759 PolarHBondContact O-N 3.15Å; Q757-T759 PolarHBondContact O-N 3.36Å; Q757-T759 VanDerWaalsContact O-N 3.13Å; T759-Y761 WeakPolarHBondContact CB-OH 3.47Å; T759-Y761 HydrophobicContact CG2-CE1 3.95Å; T759-Y761 HydrophobicContact CG2-CE2 4.1Å; T759-Y761 WeakPolarHBondContact O-CD2 3.2Å; T759-Y761 WeakPolarHBondContact O-CE2 3.29Å; T759-P789 WeakPolarHBondContact O-CD 3.36Å
760	I	78.5	Confident	74.9	Confident	31 Å²	31	23.9 Å²	23.9	16%	0.159	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	137.5	174.2	-63	170.1	0	0	0	108.2	P602 E603 R786	P602-I760 CarbonylContact C-O 3.56Å; P602-I760 WeakPolarHBondContact CA-O 3.4Å; E603-I760 HydrophobicContact CB-CB 4.14Å; E603-I760 HydrophobicContact CB-CG2 4.27Å; E603-I760 PolarHBondContact N-O 3.26Å; I760-R786 HydrophobicContact CG2-CB 3.81Å; I760-R786 HydrophobicContact CG2-CG 3.9Å
761	Y	81.7	Confident	75.9	Confident	3 Å²	3	22.1 Å²	22.1	1%	0.012	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	163	-179.8	-59.3	-87.6	0	0	0	112.9	I600 S601 P602 L755 F756 T759 I787 P789	I600-Y761 HydrophobicContact CG2-CD1 4.02Å; S601-Y761 CarbonylContact O-C 3.58Å; S601-Y761 VanDerWaalsContact O-CA 3.27Å; S601-Y761 WeakPolarHBondContact O-CA 3.38Å; P602-Y761 HydrophobicContact CB-CD1 4.32Å; P602-Y761 HydrophobicContact CB-CE1 4.13Å; L755-Y761 HydrophobicContact CB-CD2 4.47Å; L755-Y761 HydrophobicContact CB-CE2 3.87Å; L755-Y761 HydrophobicContact CD2-CD1 3.7Å; L755-Y761 HydrophobicContact CD2-CD2 4.14Å; L755-Y761 HydrophobicContact CD2-CE1 3.56Å; L755-Y761 HydrophobicContact CD2-CE2 4.02Å; L755-Y761 HydrophobicContact CD2-CG 4Å; F756-Y761 PolarHBondContact N-OH 3.42Å; F756-Y761 WeakPolarHBondContact O-CE2 3.42Å; F756-Y761 PolarHBondContact O-OH 3.3Å; T759-Y761 WeakPolarHBondContact CB-OH 3.47Å; T759-Y761 HydrophobicContact CG2-CE1 3.95Å; T759-Y761 HydrophobicContact CG2-CE2 4.1Å; T759-Y761 WeakPolarHBondContact O-CD2 3.2Å; T759-Y761 WeakPolarHBondContact O-CE2 3.29Å; Y761-I787 PolarHBondContact N-O 3.49Å; Y761-I787 PolarHBondContact O-N 2.92Å; Y761-P789 HydrophobicContact CD2-CG 4.15Å; Y761-P789 HydrophobicContact CE2-CG 4.1Å
762	R	85.6	Confident	76.5	Confident	46 Å²	46	22.6 Å²	22.6	17%	0.174	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	150.1	171.2	-54.5	-177.9	-175.1	-153.8	14.1	109.8	I600 S601 E603 W783	I600-R762 WeakPolarHBondContact CA-O 3.46Å; S601-R762 PolarHBondContact N-O 3.39Å; S601-R762 PolarHBondContact O-N 2.85Å; E603-R762 IonicContact OE1-NH2 3.03Å; E603-R762 PolarHBondContact OE1-NH2 3.07Å; E603-R762 IonicContact OE2-CZ 3.33Å; E603-R762 VanDerWaalsContact OE2-CZ 3.29Å; E603-R762 IonicContact OE2-NE 3.2Å; E603-R762 PolarHBondContact OE2-NE 2.84Å; E603-R762 IonicContact OE2-NH2 2.81Å; E603-R762 PolarHBondContact OE2-NH2 3.25Å; R762-W783 VanDerWaalsContact C-CE3 3.49Å; R762-W783 HydrophobicContact CB-CB 4.15Å; R762-W783 HydrophobicContact CB-CD2 3.38Å; R762-W783 HydrophobicContact CB-CE3 3.72Å; R762-W783 HydrophobicContact CB-CG 3.57Å; R762-W783 HydrophobicContact CB-CZ2 4.5Å; R762-W783 HydrophobicContact CB-CZ3 4.4Å; R762-W783 HydrophobicContact CG-CD2 4.42Å; R762-W783 HydrophobicContact CG-CG 4.21Å; R762-W783 WeakPolarHBondContact O-CZ3 3.4Å
763	V	85.7	Confident	76.2	Confident	1 Å²	1	27.6 Å²	27.6	1%	0.006	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	144.2	-172.1	-171.5	0	0	0	0	113	P560 I581 V598 I599 I600 L672 S784 I787	P560-V763 HydrophobicContact CG-CG1 4.46Å; I581-V763 HydrophobicContact CD1-CB 3.79Å; I581-V763 HydrophobicContact CD1-CG1 3.77Å; I581-V763 HydrophobicContact CD1-CG2 3.7Å; V598-V763 HydrophobicContact CG1-CG1 3.61Å; I599-V763 CarbonylContact O-C 3.53Å; I599-V763 WeakPolarHBondContact O-CA 3.5Å; I599-V763 WeakPolarHBondContact O-CG1 3.18Å; I600-V763 HydrophobicContact CG1-CG1 4.32Å; I600-V763 HydrophobicContact CG1-CG2 4.15Å; L672-V763 HydrophobicContact CD1-CG1 4.26Å; L672-V763 HydrophobicContact CD1-CG2 4.16Å; V763-S784 PolarHBondContact N-OG 3.46Å; V763-S784 WeakPolarHBondContact O-CB 3.23Å; V763-S784 PolarHBondContact O-N 3.03Å; V763-I787 HydrophobicContact CG2-CD1 3.87Å
764	A	85.9	Confident	76.1	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	160.2	179.1	0	0	0	0	0	113.5	V598 I599 P629 T780 W783	V598-A764 WeakPolarHBondContact CA-O 3.25Å; I599-A764 PolarHBondContact N-O 2.89Å; I599-A764 PolarHBondContact O-N 3.25Å; P629-A764 HydrophobicContact CB-CB 3.53Å; P629-A764 HydrophobicContact CG-CB 3.81Å; A764-T780 HydrophobicContact CB-CG2 4.19Å; A764-W783 HydrophobicContact CB-CE3 3.82Å; A764-W783 HydrophobicContact CB-CZ3 3.87Å
765	L	87.8	Confident	75.9	Confident	1 Å²	1	27.9 Å²	27.9	1%	0.005	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	115.5	-178.1	173.2	65.2	0	0	0	111.8	I557 P560 L583 Y596 Y597 V598 T780 S781	I557-L765 HydrophobicContact CG2-CB 4.42Å; I557-L765 HydrophobicContact CG2-CD2 3.84Å; I557-L765 HydrophobicContact CG2-CG 4.1Å; P560-L765 HydrophobicContact CG-CB 4.22Å; L583-L765 HydrophobicContact CB-CD2 4.06Å; L583-L765 HydrophobicContact CD1-CD1 3.58Å; L583-L765 HydrophobicContact CD1-CD2 4.2Å; L583-L765 HydrophobicContact CD1-CG 4.47Å; L583-L765 HydrophobicContact CD2-CB 4.25Å; L583-L765 HydrophobicContact CD2-CD1 4.09Å; L583-L765 HydrophobicContact CD2-CD2 4.06Å; L583-L765 HydrophobicContact CD2-CG 4.35Å; L583-L765 HydrophobicContact CG-CD1 4.38Å; L583-L765 HydrophobicContact CG-CD2 4.33Å; Y596-L765 HydrophobicContact CD1-CD1 3.9Å; Y596-L765 HydrophobicContact CD1-CD2 4.37Å; Y596-L765 HydrophobicContact CD1-CG 4.32Å; Y597-L765 WeakPolarHBondContact O-CA 3.24Å; V598-L765 HydrophobicContact CG2-CD1 4.25Å; L765-T780 CarbonylContact O-C 3.53Å; L765-T780 WeakPolarHBondContact O-CA 3.43Å; L765-T780 VanDerWaalsContact O-CG2 3.31Å; L765-T780 WeakPolarHBondContact O-CG2 3.4Å; L765-S781 PolarHBondContact N-OG 3.13Å; L765-S781 PolarHBondContact O-N 2.83Å; L765-S781 PolarHBondContact O-OG 2.95Å
766	R	84.6	Confident	75.8	Confident	13 Å²	13	30.2 Å²	30.2	5%	0.049	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	139.5	171	-178	158.6	-175.3	176.6	-1.1	110.5	Y596 Y597 I599 D633 C778 S779 T780 H1185	Y596-R766 CarbonylContact C-O 3.6Å; Y596-R766 VanDerWaalsContact CA-O 3.23Å; Y596-R766 WeakPolarHBondContact CA-O 3.23Å; Y597-R766 HydrophobicContact CD2-CB 4.25Å; Y597-R766 HydrophobicContact CD2-CG 3.97Å; Y597-R766 PolarHBondContact N-O 3.43Å; Y597-R766 PolarHBondContact O-N 3.4Å; I599-R766 HydrophobicContact CD1-CB 3.89Å; D633-R766 IonicContact OD1-NH1 2.76Å; D633-R766 IonicContact OD1-NH2 3.95Å; R766-C778 HydrophobicContact CG-CB 4.34Å; R766-C778 PolarHBondContact NE-SG 2.97Å; R766-C778 PolarHBondContact NH2-SG 3.03Å; R766-S779 CarbonylContact C-O 3.31Å; R766-S779 VanDerWaalsContact CA-O 3.26Å; R766-S779 WeakPolarHBondContact CA-O 3.46Å; R766-S779 WeakPolarHBondContact CG-O 3.41Å; R766-T780 VanDerWaalsContact CA-OG1 3.25Å; R766-T780 WeakPolarHBondContact CA-OG1 3.44Å; R766-T780 HydrophobicContact CB-CG2 3.98Å; R766-T780 WeakPolarHBondContact CB-OG1 2.99Å; R766-T780 WeakPolarHBondContact CD-OG1 3.43Å; R766-T780 WeakPolarHBondContact CG-OG1 3.4Å; R766-H1185 VanDerWaalsContact CZ-O 3.23Å; R766-H1185 PolarHBondContact NH1-O 2.7Å; R766-H1185 PolarHBondContact NH2-O 2.85Å; R766-H1185 VanDerWaalsContact NH2-O 3.15Å
767	A	85.8	Confident	76.1	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	137.9	169.9	0	0	0	0	0	109.6	I557 V586 I593 N595 Y596 C778 S779	I557-A767 HydrophobicContact CD1-CB 3.42Å; I557-A767 VanDerWaalsContact CD1-CB 3.42Å; V586-A767 HydrophobicContact CG2-CB 4.17Å; I593-A767 HydrophobicContact CG2-CB 4.03Å; N595-A767 CarbonylContact O-C 3.43Å; N595-A767 WeakPolarHBondContact O-CA 3.26Å; Y596-A767 HydrophobicContact CD1-CB 3.37Å; Y596-A767 HydrophobicContact CE1-CB 3.31Å; Y596-A767 HydrophobicContact CG-CB 4.22Å; A767-C778 WeakPolarHBondContact O-CA 3.34Å; A767-S779 PolarHBondContact N-O 3.02Å; A767-S779 PolarHBondContact O-N 3.2Å; A767-S779 VanDerWaalsContact O-O 3.09Å
768	C	80.1	Confident	76.6	Confident	0 Å²	0	27 Å²	27	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	132.3	-171.6	-51.8	0	0	0	0	112.5	H594 N595 Y597 Q776 L777 C778	H594-C768 WeakPolarHBondContact CA-O 3.32Å; H594-C768 PolarHBondContact N-O 2.85Å; N595-C768 PolarHBondContact N-O 3.3Å; N595-C768 PolarHBondContact O-N 2.81Å; Y597-C768 HydrophobicContact CE2-CB 4.47Å; C768-Q776 HydrophobicContact CB-CB 4.29Å; C768-L777 CarbonylContact C-O 3.53Å; C768-L777 VanDerWaalsContact CA-O 3.27Å; C768-L777 WeakPolarHBondContact CA-O 3.22Å; C768-C778 HydrophobicContact CB-CB 4.04Å; C768-C778 WeakPolarHBondContact CB-SG 3.39Å; C768-C778 VanDerWaalsContact SG-CA 3.54Å; C768-C778 WeakPolarHBondContact SG-CB 3.5Å; C768-C778 CovalentContact SG-SG 2.03Å; C768-C778 PolarHBondContact SG-SG 2.97Å
769	S	78.5	Confident	77.5	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	126.4	167.3	-57.8	0	0	0	0	109.1	G591 P592 Q776 L777	G591-S769 PolarHBondContact O-OG 3.32Å; P592-S769 WeakPolarHBondContact O-CA 3.33Å; P592-S769 WeakPolarHBondContact O-CB 3.31Å; P592-S769 PolarHBondContact O-OG 2.92Å; S769-Q776 CarbonylContact O-C 3.58Å; S769-Q776 WeakPolarHBondContact O-CA 3.32Å; S769-L777 PolarHBondContact N-O 3.48Å; S769-L777 PolarHBondContact O-N 2.82Å
770	Q	73.5	Confident	78.3	Confident	60 Å²	60	22.4 Å²	22.4	28%	0.28	12%	0.123	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	114.8	-173.3	-177.5	171.2	-37.7	0	0	110.6	H594 N595 H775 Q776	H594-Q770 HydrophobicContact CB-CB 3.63Å; H594-Q770 PolarHBondContact CE1-O 3.15Å; H594-Q770 VanDerWaalsContact CE1-O 3.31Å; H594-Q770 VanDerWaalsContact CG-N 3.35Å; H594-Q770 PolarHBondContact ND1-N 3.07Å; H594-Q770 VanDerWaalsContact ND1-N 3.19Å; H594-Q770 PolarHBondContact NE2-O 3Å; N595-Q770 PolarHBondContact ND2-OE1 3.4Å; Q770-H775 CarbonylContact C-O 3Å; Q770-H775 WeakPolarHBondContact CA-O 3.03Å; Q770-Q776 HydrophobicContact CB-CG 4.11Å; Q770-Q776 HydrophobicContact CG-CG 3.98Å
771	Y	68.6	Low	78.6	Confident	22 Å²	22	21 Å²	21	9%	0.086	12%	0.116	C	C	.	.			trans	-66.4	155.6	170.5	-73.1	-78.7	0	0	0	112	E550 W551 N773 G774 H775 L777 P1142	E550-Y771 HydrophobicContact CB-CE1 4.34Å; E550-Y771 WeakPolarHBondContact CB-OH 3.32Å; W551-Y771 WeakPolarHBondContact CA-OH 3.18Å; W551-Y771 HydrophobicContact CB-CE1 4.18Å; W551-Y771 HydrophobicContact CD2-CD1 4.19Å; W551-Y771 AromaticContact CD2-CE1 3.86Å; W551-Y771 HydrophobicContact CD2-CE1 3.86Å; W551-Y771 AromaticContact CE3-CD1 3.56Å; W551-Y771 HydrophobicContact CE3-CD1 3.56Å; W551-Y771 AromaticContact CE3-CE1 3.63Å; W551-Y771 HydrophobicContact CE3-CE1 3.63Å; W551-Y771 HydrophobicContact CE3-CG 4.05Å; W551-Y771 HydrophobicContact CG-CE1 4.13Å; W551-Y771 AromaticContact CZ3-CD1 3.83Å; W551-Y771 HydrophobicContact CZ3-CD1 3.83Å; W551-Y771 HydrophobicContact CZ3-CE1 4.34Å; W551-Y771 HydrophobicContact CZ3-CG 4.23Å; W551-Y771 PolarHBondContact N-OH 3Å; W551-Y771 PolarHBondContact O-OH 3.41Å; Y771-N773 WeakPolarHBondContact CB-OD1 3.42Å; Y771-N773 PolarHBondContact O-N 2.98Å; Y771-G774 PolarHBondContact O-N 3.38Å; Y771-H775 HydrophobicContact CD2-CB 3.88Å; Y771-H775 AromaticContact CD2-ND1 3.72Å; Y771-H775 WeakPolarHBondContact CD2-O 3.39Å; Y771-H775 PolarHBondContact N-O 2.84Å; Y771-L777 HydrophobicContact CD2-CD1 4.19Å; Y771-L777 HydrophobicContact CE2-CD1 3.29Å; Y771-L777 HydrophobicContact CE2-CG 3.88Å; Y771-P1142 HydrophobicContact CE2-CB 4.39Å; Y771-P1142 HydrophobicContact CE2-CG 4.29Å
772	P	65.2	Low	78.7	Confident	46 Å²	46	24 Å²	24	30%	0.299	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-45.4	-44.4	168.9	15.6	-33.2	0	0	0	114.4	D51 L53 G774	D51-P772 HydrophobicContact CB-CB 4.44Å; D51-P772 VanDerWaalsContact OD2-C 3.31Å; D51-P772 WeakPolarHBondContact OD2-CA 3.4Å; D51-P772 WeakPolarHBondContact OD2-CB 3.27Å; L53-P772 HydrophobicContact CB-CB 3.83Å; L53-P772 HydrophobicContact CB-CG 3.73Å; L53-P772 HydrophobicContact CD1-CB 3.87Å; L53-P772 HydrophobicContact CD1-CG 3.72Å; L53-P772 HydrophobicContact CG-CB 4.44Å; L53-P772 HydrophobicContact CG-CG 4.37Å; P772-G774 PolarHBondContact O-N 3.12Å
773	N	62	Low	78.6	Confident	113 Å²	113	22.7 Å²	22.7	60%	0.604	13%	0.125	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.8	22.2	179.7	67.8	2.5	0	0	0	114.6	Y771 H775	Y771-N773 WeakPolarHBondContact CB-OD1 3.42Å; Y771-N773 PolarHBondContact O-N 2.98Å; N773-H775 PolarHBondContact O-N 3.46Å; N773-H775 WeakPolarHBondContact OD1-CB 3.4Å; N773-H775 PolarHBondContact OD1-N 3.11Å
774	G	66.5	Low	78.5	Confident	48 Å²	48	22.9 Å²	22.9	50%	0.495	13%	0.127	S	C	.	.	S	Bend	trans	74.1	-2.6	-178.3	0	0	0	0	0	114.8	Y771 P772 Q776	Y771-G774 PolarHBondContact O-N 3.38Å; P772-G774 PolarHBondContact O-N 3.12Å; G774-Q776 PolarHBondContact O-N 2.92Å
775	H	71.1	Confident	78.2	Confident	32 Å²	32	28.8 Å²	28.8	15%	0.148	16%	0.158	C	C	.	.			trans	-76.5	123.1	-171.9	-175.7	-80.4	0	0	0	113.1	Q770 Y771 N773 P1142 N1143	Q770-H775 CarbonylContact C-O 3Å; Q770-H775 WeakPolarHBondContact CA-O 3.03Å; Y771-H775 HydrophobicContact CD2-CB 3.88Å; Y771-H775 AromaticContact CD2-ND1 3.72Å; Y771-H775 WeakPolarHBondContact CD2-O 3.39Å; Y771-H775 PolarHBondContact N-O 2.84Å; N773-H775 PolarHBondContact O-N 3.46Å; N773-H775 WeakPolarHBondContact OD1-CB 3.4Å; N773-H775 PolarHBondContact OD1-N 3.11Å; H775-P1142 WeakPolarHBondContact CE1-CB 2.91Å; H775-P1142 PolarHBondContact CE1-O 2.76Å; H775-P1142 WeakPolarHBondContact ND1-CB 3.11Å; H775-P1142 PolarHBondContact NE2-O 2.87Å; H775-P1142 VanDerWaalsContact NE2-O 3.1Å; H775-N1143 WeakPolarHBondContact CD2-CA 2.83Å; H775-N1143 WeakPolarHBondContact CD2-CB 3.3Å; H775-N1143 PolarHBondContact CD2-N 2.88Å; H775-N1143 VanDerWaalsContact NE2-CA 3.34Å; H775-N1143 WeakPolarHBondContact NE2-CA 3.19Å; H775-N1143 PolarHBondContact NE2-N 2.99Å; H775-N1143 VanDerWaalsContact NE2-N 3.18Å
776	Q	74.2	Confident	77.6	Confident	49 Å²	49	36.2 Å²	36.2	23%	0.229	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	107.5	179.5	-68.8	-168.2	-11.3	0	0	114.1	N595 Y597 C768 S769 Q770 G774 C778	N595-Q776 PolarHBondContact ND2-NE2 2.81Å; Y597-Q776 PolarHBondContact OH-NE2 2.83Å; Y597-Q776 PolarHBondContact OH-OE1 3.39Å; C768-Q776 HydrophobicContact CB-CB 4.29Å; S769-Q776 CarbonylContact O-C 3.58Å; S769-Q776 WeakPolarHBondContact O-CA 3.32Å; Q770-Q776 HydrophobicContact CB-CG 4.11Å; Q770-Q776 HydrophobicContact CG-CG 3.98Å; G774-Q776 PolarHBondContact O-N 2.92Å; Q776-C778 PolarHBondContact O-N 3.32Å; Q776-C778 VanDerWaalsContact O-N 3.13Å
777	L	79.1	Confident	77.2	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	89.6	166.4	-83.8	164.3	0	0	0	110	W551 A553 P554 C768 S769 Y771 P1142 F1145	W551-L777 VanDerWaalsContact C-CD1 3.45Å; W551-L777 HydrophobicContact CB-CD1 3.73Å; W551-L777 WeakPolarHBondContact O-CD1 3.49Å; A553-L777 HydrophobicContact CB-CD2 4.43Å; P554-L777 VanDerWaalsContact CD-O 3.32Å; P554-L777 WeakPolarHBondContact CD-O 3.26Å; C768-L777 CarbonylContact C-O 3.53Å; C768-L777 VanDerWaalsContact CA-O 3.27Å; C768-L777 WeakPolarHBondContact CA-O 3.22Å; S769-L777 PolarHBondContact N-O 3.48Å; S769-L777 PolarHBondContact O-N 2.82Å; Y771-L777 HydrophobicContact CD2-CD1 4.19Å; Y771-L777 HydrophobicContact CE2-CD1 3.29Å; Y771-L777 HydrophobicContact CE2-CG 3.88Å; L777-P1142 HydrophobicContact CD2-CB 3.62Å; L777-P1142 HydrophobicContact CD2-CG 3.72Å; L777-P1142 HydrophobicContact CG-CB 3.95Å; L777-P1142 HydrophobicContact CG-CG 4.22Å; L777-F1145 HydrophobicContact CD2-CE2 3.62Å; L777-F1145 HydrophobicContact CD2-CZ 3.71Å
778	C	81.1	Confident	76.3	Confident	2 Å²	2	38 Å²	38	1%	0.014	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	133.7	-177.1	-69.1	0	0	0	0	113.7	R766 A767 C768 Q776	R766-C778 HydrophobicContact CG-CB 4.34Å; R766-C778 PolarHBondContact NE-SG 2.97Å; R766-C778 PolarHBondContact NH2-SG 3.03Å; A767-C778 WeakPolarHBondContact O-CA 3.34Å; C768-C778 HydrophobicContact CB-CB 4.04Å; C768-C778 WeakPolarHBondContact CB-SG 3.39Å; C768-C778 VanDerWaalsContact SG-CA 3.54Å; C768-C778 WeakPolarHBondContact SG-CB 3.5Å; C768-C778 CovalentContact SG-SG 2.03Å; C768-C778 PolarHBondContact SG-SG 2.97Å; Q776-C778 PolarHBondContact O-N 3.32Å; Q776-C778 VanDerWaalsContact O-N 3.13Å
779	S	83.6	Confident	75.3	Confident	4 Å²	4	38.4 Å²	38.4	3%	0.028	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	165.6	159.4	-67.8	0	0	0	0	111.8	A553 P554 I557 R766 A767 L1184	A553-S779 WeakPolarHBondContact CB-OG 3.11Å; P554-S779 WeakPolarHBondContact O-CB 3.33Å; P554-S779 PolarHBondContact O-OG 2.88Å; I557-S779 VanDerWaalsContact CD1-C 3.41Å; I557-S779 WeakPolarHBondContact CD1-O 3.33Å; R766-S779 CarbonylContact C-O 3.31Å; R766-S779 VanDerWaalsContact CA-O 3.26Å; R766-S779 WeakPolarHBondContact CA-O 3.46Å; R766-S779 WeakPolarHBondContact CG-O 3.41Å; A767-S779 PolarHBondContact N-O 3.02Å; A767-S779 PolarHBondContact O-N 3.2Å; A767-S779 VanDerWaalsContact O-O 3.09Å; S779-L1184 VanDerWaalsContact CB-CD2 3.47Å; S779-L1184 WeakPolarHBondContact OG-CD2 3.33Å
780	T	84.8	Confident	74	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	162.6	178	-51.7	0	0	0	0	110.6	I599 A764 L765 R766 T1183 H1185	I599-T780 HydrophobicContact CD1-CG2 4.48Å; A764-T780 HydrophobicContact CB-CG2 4.19Å; L765-T780 CarbonylContact O-C 3.53Å; L765-T780 WeakPolarHBondContact O-CA 3.43Å; L765-T780 VanDerWaalsContact O-CG2 3.31Å; L765-T780 WeakPolarHBondContact O-CG2 3.4Å; R766-T780 VanDerWaalsContact CA-OG1 3.25Å; R766-T780 WeakPolarHBondContact CA-OG1 3.44Å; R766-T780 HydrophobicContact CB-CG2 3.98Å; R766-T780 WeakPolarHBondContact CB-OG1 2.99Å; R766-T780 WeakPolarHBondContact CD-OG1 3.43Å; R766-T780 WeakPolarHBondContact CG-OG1 3.4Å; T780-T1183 WeakPolarHBondContact CB-O 3.38Å; T780-T1183 WeakPolarHBondContact CG2-O 3.32Å; T780-T1183 CarbonylContact O-C 3.53Å; T780-T1183 PolarHBondContact O-N 2.87Å; T780-H1185 VanDerWaalsContact CB-CD2 3.49Å; T780-H1185 WeakPolarHBondContact CB-CD2 3.43Å; T780-H1185 WeakPolarHBondContact CG2-CD2 3.16Å; T780-H1185 VanDerWaalsContact CG2-NE2 3.26Å; T780-H1185 WeakPolarHBondContact CG2-NE2 3.35Å; T780-H1185 PolarHBondContact OG1-CD2 3.49Å
781	S	86.3	Confident	72.6	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-100.4	165.7	-175.9	64.1	0	0	0	0	114.7	I557 K558 L765 T1183	I557-S781 WeakPolarHBondContact O-CB 3.34Å; K558-S781 WeakPolarHBondContact O-CB 3.2Å; L765-S781 PolarHBondContact N-OG 3.13Å; L765-S781 PolarHBondContact O-N 2.83Å; L765-S781 PolarHBondContact O-OG 2.95Å; S781-T1183 WeakPolarHBondContact O-CB 3.01Å
782	Q	83	Confident	71	Confident	66 Å²	66	49.7 Å²	49.7	31%	0.308	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-59.8	160.4	176.7	-74.4	-166.2	-14.4	0	0	111.4	Q559 S784 T1183 H1194	Q559-Q782 HydrophobicContact CB-CB 4.44Å; Q782-S784 PolarHBondContact O-N 2.87Å; Q782-T1183 WeakPolarHBondContact CA-OG1 3.11Å; Q782-H1194 PolarHBondContact NE2-O 2.79Å
783	W	83	Confident	69.3	Low	19 Å²	19	54.8 Å²	54.8	7%	0.072	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-58.1	136.6	169.6	-95.5	154.1	0	0	0	109	S601 I627 D628 P629 Y632 R762 A764	S601-W783 VanDerWaalsContact CB-CH2 3.41Å; I627-W783 PolarHBondContact O-NE1 2.86Å; D628-W783 WeakPolarHBondContact O-CZ2 3.41Å; P629-W783 VanDerWaalsContact CA-CZ2 3.5Å; P629-W783 HydrophobicContact CB-CD2 4.07Å; P629-W783 HydrophobicContact CB-CE3 3.94Å; P629-W783 HydrophobicContact CB-CH2 4.32Å; P629-W783 HydrophobicContact CB-CZ2 4.43Å; P629-W783 HydrophobicContact CB-CZ3 4.08Å; P629-W783 VanDerWaalsContact CD-CD1 3.45Å; P629-W783 VanDerWaalsContact CD-CD2 3.49Å; P629-W783 HydrophobicContact CG-CB 3.93Å; P629-W783 HydrophobicContact CG-CD2 3.48Å; P629-W783 VanDerWaalsContact CG-CD2 3.48Å; P629-W783 HydrophobicContact CG-CE3 3.64Å; P629-W783 HydrophobicContact CG-CG 3.61Å; P629-W783 HydrophobicContact CG-CZ3 4.3Å; P629-W783 VanDerWaalsContact N-CE2 3.33Å; Y632-W783 AromaticContact CE2-CH2 3.82Å; Y632-W783 HydrophobicContact CE2-CH2 3.82Å; Y632-W783 AromaticContact CE2-CZ2 3.92Å; Y632-W783 HydrophobicContact CE2-CZ2 3.92Å; R762-W783 VanDerWaalsContact C-CE3 3.49Å; R762-W783 HydrophobicContact CB-CB 4.15Å; R762-W783 HydrophobicContact CB-CD2 3.38Å; R762-W783 HydrophobicContact CB-CE3 3.72Å; R762-W783 HydrophobicContact CB-CG 3.57Å; R762-W783 HydrophobicContact CB-CZ2 4.5Å; R762-W783 HydrophobicContact CB-CZ3 4.4Å; R762-W783 HydrophobicContact CG-CD2 4.42Å; R762-W783 HydrophobicContact CG-CG 4.21Å; R762-W783 WeakPolarHBondContact O-CZ3 3.4Å; A764-W783 HydrophobicContact CB-CE3 3.82Å; A764-W783 HydrophobicContact CB-CZ3 3.87Å
784	S	84.1	Confident	67.7	Low	6 Å²	6	58 Å²	58	4%	0.042	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-52.9	163.5	158.5	74.1	0	0	0	0	111.2	V763 Q782	V763-S784 PolarHBondContact N-OG 3.46Å; V763-S784 WeakPolarHBondContact O-CB 3.23Å; V763-S784 PolarHBondContact O-N 3.03Å; Q782-S784 PolarHBondContact O-N 2.87Å
785	D	78.5	Confident	65.8	Low	124 Å²	124	60.1 Å²	60.1	66%	0.663	31%	0.313	S	S	*	.	P	Polyproline II helix	trans	-52.2	158.4	163.9	-64.6	-71.7	0	0	0	112.4	I787	D785-I787 WeakPolarHBondContact O-CG1 3.26Å; D785-I787 PolarHBondContact O-N 3.3Å
786	R	76.2	Confident	63.7	Low	157 Å²	157	65.7 Å²	65.7	59%	0.592	34%	0.344	S	S	*	.			trans	-64	112.3	178.7	-80.8	177	164.2	159.9	-5.7	111.1	E603 I760 S788	E603-R786 IonicContact OE1-CZ 2.67Å; E603-R786 IonicContact OE1-NE 2.97Å; E603-R786 PolarHBondContact OE1-NE 3.24Å; E603-R786 IonicContact OE1-NH2 3.69Å; E603-R786 PolarHBondContact OE1-NH2 3.32Å; E603-R786 IonicContact OE2-CZ 2.65Å; E603-R786 IonicContact OE2-NE 3.75Å; E603-R786 PolarHBondContact OE2-NE 2.82Å; E603-R786 IonicContact OE2-NH2 2.77Å; I760-R786 HydrophobicContact CG2-CB 3.81Å; I760-R786 HydrophobicContact CG2-CG 3.9Å; R786-S788 PolarHBondContact O-N 2.9Å
787	I	75.5	Confident	61.8	Low	3 Å²	3	67.8 Å²	67.8	2%	0.015	36%	0.36	C	S	.	.	B	Isolated β-bridge	trans	-91.9	104.6	178.5	-38.4	-179.9	0	0	0	108.7	L562 I565 I579 I581 Y761 V763 D785	L562-I787 HydrophobicContact CD1-CD1 4.35Å; L562-I787 HydrophobicContact CD1-CG2 4.43Å; L562-I787 HydrophobicContact CD2-CG2 4.33Å; I565-I787 HydrophobicContact CD1-CG2 3.56Å; I565-I787 HydrophobicContact CG1-CG2 4.1Å; I579-I787 HydrophobicContact CD1-CB 4.23Å; I579-I787 HydrophobicContact CD1-CD1 3.97Å; I579-I787 HydrophobicContact CD1-CG2 3.71Å; I579-I787 HydrophobicContact CG1-CG2 4.16Å; I579-I787 HydrophobicContact CG2-CD1 4.07Å; I579-I787 HydrophobicContact CG2-CG2 4.45Å; I581-I787 HydrophobicContact CD1-CD1 4.37Å; Y761-I787 PolarHBondContact N-O 3.49Å; Y761-I787 PolarHBondContact O-N 2.92Å; V763-I787 HydrophobicContact CG2-CD1 3.87Å; D785-I787 WeakPolarHBondContact O-CG1 3.26Å; D785-I787 PolarHBondContact O-N 3.3Å
788	S	66.9	Low	59.3	Low	47 Å²	47	78 Å²	78	33%	0.329	41%	0.405	S	S	.	.			trans	-108	103.4	-176.7	167.2	0	0	0	0	110.5	R786 I790	R786-S788 PolarHBondContact O-N 2.9Å; S788-I790 VanDerWaalsContact C-N 3.26Å; S788-I790 PolarHBondContact O-N 3.34Å
789	P	60	Low	57.1	Low	9 Å²	9	82.2 Å²	82.2	6%	0.058	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-5.3	-169.8	-5.9	21.5	0	0	0	115.2	S577 Q757 T759 Y761 N791	S577-P789 VanDerWaalsContact OG-CB 3.27Å; S577-P789 WeakPolarHBondContact OG-CB 3.38Å; Q757-P789 HydrophobicContact CB-CB 4.42Å; Q757-P789 HydrophobicContact CG-CB 4.22Å; T759-P789 WeakPolarHBondContact O-CD 3.36Å; Y761-P789 HydrophobicContact CD2-CG 4.15Å; Y761-P789 HydrophobicContact CE2-CG 4.1Å; P789-N791 VanDerWaalsContact C-N 3.34Å; P789-N791 PolarHBondContact O-N 3.27Å
790	I	51	Low	54.7	Low	101 Å²	101	89.6 Å²	89.6	52%	0.518	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-22.9	178	-96.7	162.3	0	0	0	114.3	Q757 S788	Q757-I790 HydrophobicContact CB-CG1 4.21Å; Q757-I790 VanDerWaalsContact O-CD1 3.31Å; Q757-I790 WeakPolarHBondContact O-CD1 3.34Å; Q757-I790 VanDerWaalsContact O-CG1 3.28Å; Q757-I790 WeakPolarHBondContact O-CG1 3.33Å; S788-I790 VanDerWaalsContact C-N 3.26Å; S788-I790 PolarHBondContact O-N 3.34Å
791	N	43.9	Very low	52.1	Low	108 Å²	108	96.5 Å²	96.5	58%	0.578	50%	0.503	S	S	*	.			trans	-123.4	99.2	-179	-83.3	-39	0	0	0	110.9	P789 I793	P789-N791 VanDerWaalsContact C-N 3.34Å; P789-N791 PolarHBondContact O-N 3.27Å; N791-I793 VanDerWaalsContact C-N 3.33Å; N791-I793 HydrophobicContact CB-CG1 4.48Å; N791-I793 PolarHBondContact O-N 3.35Å
792	P	34.3	Very low	49.8	Very low	110 Å²	110	105 Å²	105	71%	0.714	54%	0.54	S	S	*	.			trans	-68.9	93.1	164.8	29.1	-32.7	0	0	0	108.6	Q794	P792-Q794 PolarHBondContact O-N 3.03Å
793	I	30.6	Very low	47.6	Very low	153 Å²	153	106.3 Å²	106.3	79%	0.785	56%	0.556	S	S	*	*			trans	-66	110.7	179.9	-65.4	-179.2	0	0	0	108.9	N791 S795	N791-I793 VanDerWaalsContact C-N 3.33Å; N791-I793 HydrophobicContact CB-CG1 4.48Å; N791-I793 PolarHBondContact O-N 3.35Å; I793-S795 PolarHBondContact O-N 3.1Å
794	Q	28.5	Very low	45.1	Very low	180 Å²	180	111.4 Å²	111.4	84%	0.841	58%	0.584	S	S	*	*			trans	-59.9	115.9	174.4	-58.7	164.6	-8.5	0	0	110	P792	P792-Q794 PolarHBondContact O-N 3.03Å
795	S	26.6	Very low	42.8	Very low	92 Å²	92	115.3 Å²	115.3	64%	0.643	60%	0.6	S	S	*	*			trans	174.4	129.6	134.1	42.4	0	0	0	0	115.4	I793	I793-S795 PolarHBondContact O-N 3.1Å
796	N	26.6	Very low	41	Very low	150 Å²	150	115 Å²	115	80%	0.802	60%	0.599	S	S	*	*			trans	46.6	83.2	130.8	-50.1	-16.7	0	0	0	120.3
797	T	34.1	Very low	39.3	Very low	92 Å²	92	116.7 Å²	116.7	56%	0.564	61%	0.611	S	S	*	*			trans	-157.7	20.3	132.4	2.5	0	0	0	0	117.9	S799 K800	T797-S799 PolarHBondContact O-N 2.89Å; T797-K800 HydrophobicContact CG2-CB 4.37Å; T797-K800 HydrophobicContact CG2-CD 3.98Å; T797-K800 HydrophobicContact CG2-CG 4.1Å; T797-K800 PolarHBondContact O-N 2.72Å
798	F	27.6	Very low	37.5	Very low	214 Å²	214	122.3 Å²	122.3	94%	0.939	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.3	10.2	171.7	-138.7	-92.5	0	0	0	114.6
799	S	35	Very low	35.7	Very low	92 Å²	92	126 Å²	126	64%	0.643	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.2	-20.6	-179.5	51.2	0	0	0	0	114.5	T797	T797-S799 PolarHBondContact O-N 2.89Å
800	K	31.8	Very low	34.4	Very low	158 Å²	158	133.2 Å²	133.2	69%	0.687	69%	0.688	S	S	*	*	G	3₁₀ helix	trans	-82.3	-23.1	-175.2	-90	-172.1	175.4	-180	0	115.1	T797 K802	T797-K800 HydrophobicContact CG2-CB 4.37Å; T797-K800 HydrophobicContact CG2-CD 3.98Å; T797-K800 HydrophobicContact CG2-CG 4.1Å; T797-K800 PolarHBondContact O-N 2.72Å; K800-K802 PolarHBondContact O-N 3.35Å
801	L	30.6	Very low	33.5	Very low	146 Å²	146	139 Å²	139	76%	0.764	70%	0.704	S	S	*	*	G	3₁₀ helix	trans	-67.3	-1.4	178.4	-93.6	160.2	0	0	0	114.6
802	K	38.5	Very low	33.1	Very low	178 Å²	178	141.6 Å²	141.6	77%	0.774	72%	0.717	S	S	*	*	G	3₁₀ helix	trans	-95.4	-9.2	-172.4	-157	170.9	-179.4	-179.8	0	115.1	K800	K800-K802 PolarHBondContact O-N 3.35Å
803	S	36.4	Very low	33.5	Very low	94 Å²	94	144.2 Å²	144.2	66%	0.657	73%	0.725	S	S	*	*	S	Bend	trans	-119.2	5.4	-171.8	71.1	0	0	0	0	116.1
804	L	30.3	Very low	33.9	Very low	126 Å²	126	144.9 Å²	144.9	66%	0.66	72%	0.724	S	S	*	*	S	Bend	trans	-98.3	-0	177.9	-112.3	162.8	0	0	0	113
805	K	36.1	Very low	34.5	Very low	87 Å²	87	140.1 Å²	140.1	38%	0.378	70%	0.702	S	S	.	*	S	Bend	trans	-76.8	-25.2	-174	-100.3	171.3	173.7	-96.7	0	114.1	Y687 L688	Y687-K805 VanDerWaalsContact O-CE 3.32Å; Y687-K805 WeakPolarHBondContact O-CE 3.41Å; Y687-K805 PolarHBondContact O-NZ 3.42Å; L688-K805 HydrophobicContact CB-CG 4.34Å; L688-K805 HydrophobicContact CD1-CB 3.63Å; L688-K805 HydrophobicContact CD1-CD 4.12Å; L688-K805 HydrophobicContact CD1-CG 3.92Å; L688-K805 HydrophobicContact CG-CB 4.14Å; L688-K805 HydrophobicContact CG-CD 4.01Å; L688-K805 HydrophobicContact CG-CG 3.86Å
806	D	39.6	Very low	34.8	Very low	119 Å²	119	139.7 Å²	139.7	64%	0.636	70%	0.699	S	S	*	*	S	Bend	trans	-109.3	26.9	-154.5	-47.9	-45.3	0	0	0	114.5
807	K	41.9	Very low	34.9	Very low	192 Å²	192	134.1 Å²	134.1	84%	0.835	67%	0.671	S	S	*	*			trans	-138.2	12.2	-160.8	-107.3	-167.7	176.6	-165	0	119.8
808	I	37.8	Very low	34.3	Very low	120 Å²	120	132.7 Å²	132.7	62%	0.615	67%	0.666	S	S	*	*			trans	-119.6	11.7	-158.7	-69.1	175.9	0	0	0	116.1
809	N	27.8	Very low	34.1	Very low	125 Å²	125	124.5 Å²	124.5	67%	0.668	64%	0.635	S	S	*	*			trans	-101.2	29.4	-156.3	-89.4	0.5	0	0	0	121
810	E	33	Very low	33.5	Very low	160 Å²	160	123.7 Å²	123.7	75%	0.748	62%	0.62	S	S	*	*			trans	-139.9	107	-172.1	-64.2	-168.1	107.2	0	0	120.8
811	W	33.1	Very low	33.2	Very low	223 Å²	223	122.2 Å²	122.2	85%	0.845	62%	0.624	S	S	*	*			trans	99.2	0	139.3	-46.6	3.9	0	0	0	124
812	N	35	Very low	33.4	Very low	162 Å²	162	121.9 Å²	121.9	87%	0.866	62%	0.622	S	S	*	*				0	0	0	-62.4	-80.2	0	0	0	125.2
813	L	41.7	Very low	33.5	Very low	166 Å²	166	120 Å²	120	87%	0.869	62%	0.619	S	S	*	*				0	0	0	-72.3	168.7	0	0	0	127.3
814	H	39.7	Very low	33.4	Very low	167 Å²	167	120.8 Å²	120.8	77%	0.773	62%	0.615	S	S	*	*				0	0	0	-144.5	-36.3	0	0	0	120.1
815	E	42.4	Very low	34.1	Very low	80 Å²	80	121.9 Å²	121.9	37%	0.374	62%	0.62	S	S	.	*				0	0	0	173.5	-87.8	164.5	0	0	123.2	E226 K228	E226-E815 HydrophobicContact CB-CG 4Å; E226-E815 HydrophobicContact CG-CB 4.23Å; E226-E815 HydrophobicContact CG-CG 4.12Å; E226-E815 VanDerWaalsContact OE1-CA 3.23Å; E226-E815 WeakPolarHBondContact OE1-CA 2.94Å; K228-E815 HydrophobicContact CG-CG 4.38Å; K228-E815 WeakPolarHBondContact CG-OE1 3.19Å
816	S	32.5	Very low	35.1	Very low	83 Å²	83	119.2 Å²	119.2	58%	0.58	62%	0.617	S	S	*	*				0	0	0	57	0	0	0	0	125.8	E226 K228	E226-S816 PolarHBondContact OE1-N 2.75Å; K228-S816 PolarHBondContact NZ-O 2.86Å
817	S	27.8	Very low	35.9	Very low	32 Å²	32	116.7 Å²	116.7	22%	0.224	60%	0.603	C	S	.	*				0	0	0	65	0	0	0	0	124	K228 L235 K236 L237	K228-S817 WeakPolarHBondContact CD-OG 3.49Å; L235-S817 VanDerWaalsContact CD1-C 3.43Å; L235-S817 WeakPolarHBondContact CD1-O 3.4Å; L235-S817 WeakPolarHBondContact CD1-OG 3.43Å; L235-S817 WeakPolarHBondContact CG-OG 3.26Å; K236-S817 WeakPolarHBondContact O-CB 3.48Å; L237-S817 VanDerWaalsContact CD2-OG 3.29Å; L237-S817 WeakPolarHBondContact CD2-OG 3.26Å
818	S	20.9	Very low	36.4	Very low	63 Å²	63	110.7 Å²	110.7	44%	0.441	59%	0.585	S	S	.	*	B	Isolated β-bridge		0	0	0	59.6	0	0	0	0	123.6	L235 K236	L235-S818 VanDerWaalsContact CD1-CA 3.48Å; K236-S818 WeakPolarHBondContact CA-O 3.39Å; K236-S818 VanDerWaalsContact CB-O 3.22Å; K236-S818 WeakPolarHBondContact CB-O 3.27Å; K236-S818 VanDerWaalsContact N-C 3.33Å; K236-S818 PolarHBondContact N-O 3.37Å; K236-S818 PolarHBondContact O-N 3.48Å
819	S	24	Very low	37.6	Very low	41 Å²	41	107.4 Å²	107.4	29%	0.287	57%	0.573	S	S	.	*				0	0	0	75.9	0	0	0	0	130.3	Q193 E232 T234	Q193-S819 PolarHBondContact NE2-O 3.01Å; E232-S819 WeakPolarHBondContact OE2-CA 3.43Å; E232-S819 PolarHBondContact OE2-N 2.76Å; T234-S819 PolarHBondContact O-N 2.78Å
820	F	22.1	Very low	39.8	Very low	76 Å²	76	102.9 Å²	102.9	33%	0.333	56%	0.556	S	S	.	*				0	-169.3	0	-179.7	-111.1	0	0	0	119.5	V185 A195 T234	V185-F820 HydrophobicContact CG1-CD2 4.18Å; V185-F820 HydrophobicContact CG1-CE2 3.74Å; V185-F820 HydrophobicContact CG1-CZ 4.49Å; A195-F820 HydrophobicContact CB-CD1 4.48Å; T234-F820 HydrophobicContact CG2-CB 3.18Å; T234-F820 HydrophobicContact CG2-CD1 3.4Å; T234-F820 HydrophobicContact CG2-CG 3.55Å; T234-F820 VanDerWaalsContact OG1-CB 3.27Å; T234-F820 WeakPolarHBondContact OG1-CB 3.36Å; T234-F820 PolarHBondContact OG1-N 2.7Å
821	T	26.5	Very low	41.5	Very low	127 Å²	127	97.7 Å²	97.7	78%	0.779	53%	0.533	S	S	*	.			trans	-147.7	-74.4	177.7	-36.6	0	0	0	0	126.3
822	I	33.7	Very low	43.2	Very low	139 Å²	139	93.9 Å²	93.9	71%	0.713	53%	0.527	S	S	*	.			trans	-127.8	147.8	-133	-169.2	170.1	0	0	0	122.9
823	I	41.7	Very low	45.2	Very low	138 Å²	138	86.5 Å²	86.5	71%	0.708	49%	0.488	S	S	*	.			trans	-145.7	-65	-179.2	-69.1	-167.8	0	0	0	126.1
824	L	34.7	Very low	46.8	Very low	110 Å²	110	82.5 Å²	82.5	58%	0.576	46%	0.464	S	S	*	.			trans	-58	-26.1	-132.4	-143.5	72.5	0	0	0	130.3	G826	L824-G826 PolarHBondContact O-N 2.95Å
825	I	44.6	Very low	48.3	Very low	150 Å²	150	76.8 Å²	76.8	77%	0.769	45%	0.445	S	S	*	.			trans	-74.6	-11.6	-152.9	-73.8	171.7	0	0	0	119	L827	I825-L827 PolarHBondContact O-N 2.72Å; I825-L827 VanDerWaalsContact O-N 3.11Å
826	G	56	Low	50	Low	31 Å²	31	75.8 Å²	75.8	32%	0.32	44%	0.442	S	S	.	.			trans	-77.7	7.1	-157.8	0	0	0	0	0	120.5	L824	L824-G826 PolarHBondContact O-N 2.95Å
827	L	57.4	Low	52.1	Low	66 Å²	66	71.9 Å²	71.9	35%	0.346	41%	0.414	S	S	.	.			trans	-98.8	-28.3	-153.2	-61.3	176.2	0	0	0	117.1	N112 D113 I825 S829	N112-L827 HydrophobicContact CB-CB 3.67Å; D113-L827 HydrophobicContact CB-CD1 4.13Å; I825-L827 PolarHBondContact O-N 2.72Å; I825-L827 VanDerWaalsContact O-N 3.11Å; L827-S829 PolarHBondContact O-N 2.8Å
828	S	53.1	Low	54.3	Low	65 Å²	65	70.8 Å²	70.8	46%	0.455	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-62.5	-38.6	-167.5	-33.4	0	0	0	0	116.2	N112 G830	N112-S828 VanDerWaalsContact CG-CA 3.42Å; N112-S828 PolarHBondContact ND2-OG 3.43Å; S828-G830 VanDerWaalsContact C-N 3.35Å; S828-G830 PolarHBondContact O-N 2.81Å
829	S	61.4	Low	56.8	Low	52 Å²	52	72.1 Å²	72.1	36%	0.364	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-85.9	-1.6	-162.1	83.6	0	0	0	0	115.5	K311 L827	K311-S829 WeakPolarHBondContact CE-OG 3.42Å; K311-S829 PolarHBondContact NZ-O 3.23Å; K311-S829 VanDerWaalsContact NZ-O 3.13Å; L827-S829 PolarHBondContact O-N 2.8Å
830	G	75	Confident	59.4	Low	29 Å²	29	72 Å²	72	30%	0.299	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-85.8	-31.7	178.5	0	0	0	0	0	114.6	S828 F833 F834	S828-G830 VanDerWaalsContact C-N 3.35Å; S828-G830 PolarHBondContact O-N 2.81Å; G830-F833 WeakPolarHBondContact O-CB 3.45Å; G830-F833 PolarHBondContact O-N 3.28Å; G830-F834 WeakPolarHBondContact O-CD2 3.06Å; G830-F834 PolarHBondContact O-N 2.92Å
831	L	68.3	Low	61.9	Low	52 Å²	52	68.4 Å²	68.4	27%	0.272	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-45.5	-165.3	-64	178.5	0	0	0	114.5	N112 H114 F833 F834	N112-L831 WeakPolarHBondContact O-CD1 3.36Å; H114-L831 HydrophobicContact CB-CD1 4.44Å; H114-L831 HydrophobicContact CB-CD2 3.77Å; L831-F833 PolarHBondContact O-N 3.38Å; L831-F834 PolarHBondContact O-N 2.87Å
832	I	69.9	Low	64.1	Low	142 Å²	142	63.7 Å²	63.7	73%	0.728	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-36.8	172.5	-66.9	171.6	0	0	0	110.1	A835	I832-A835 VanDerWaalsContact O-CB 3.3Å; I832-A835 WeakPolarHBondContact O-CB 3.35Å; I832-A835 PolarHBondContact O-N 3.08Å
833	F	75.2	Confident	66.1	Low	7 Å²	7	58.7 Å²	58.7	3%	0.031	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-73.1	-47.8	-172.5	171.8	-87	0	0	0	111.7	Y287 N334 L335 S336 G830 L831 A835 I836	Y287-F833 AromaticContact CD1-CE2 3.76Å; Y287-F833 HydrophobicContact CD1-CE2 3.76Å; Y287-F833 HydrophobicContact CD1-CZ 4.25Å; Y287-F833 HydrophobicContact CE1-CE2 4.38Å; N334-F833 HydrophobicContact CB-CD1 3.99Å; N334-F833 HydrophobicContact CB-CE1 3.42Å; N334-F833 VanDerWaalsContact CB-CE1 3.42Å; N334-F833 HydrophobicContact CB-CZ 4.37Å; L335-F833 WeakPolarHBondContact O-CE2 3.44Å; L335-F833 WeakPolarHBondContact O-CZ 3.13Å; S336-F833 WeakPolarHBondContact OG-CD2 3.38Å; S336-F833 WeakPolarHBondContact OG-CG 3.46Å; G830-F833 WeakPolarHBondContact O-CB 3.45Å; G830-F833 PolarHBondContact O-N 3.28Å; L831-F833 PolarHBondContact O-N 3.38Å; F833-A835 PolarHBondContact O-N 3.4Å; F833-I836 PolarHBondContact O-N 3.22Å
834	F	76	Confident	67.8	Low	83 Å²	83	52.3 Å²	52.3	36%	0.364	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-55.2	-6.4	172.9	-90.9	-121.3	0	0	0	113.4	N334 R400 D401 P403 G830 L831	N334-F834 HydrophobicContact CB-CD2 4.41Å; N334-F834 HydrophobicContact CB-CE2 4.22Å; N334-F834 WeakPolarHBondContact ND2-CD1 3.34Å; N334-F834 VanDerWaalsContact ND2-CD2 3.3Å; N334-F834 WeakPolarHBondContact ND2-CD2 2.46Å; N334-F834 WeakPolarHBondContact ND2-CE1 3.27Å; N334-F834 WeakPolarHBondContact ND2-CE2 2.9Å; N334-F834 WeakPolarHBondContact ND2-CG 3.49Å; N334-F834 WeakPolarHBondContact ND2-CZ 3.45Å; R400-F834 VanDerWaalsContact O-CD1 3.28Å; R400-F834 WeakPolarHBondContact O-CD1 3.38Å; R400-F834 WeakPolarHBondContact O-CE1 3.45Å; D401-F834 CarbonylContact C-O 3.54Å; D401-F834 VanDerWaalsContact CA-O 3.29Å; D401-F834 WeakPolarHBondContact CA-O 3.17Å; D401-F834 WeakPolarHBondContact CB-O 3.12Å; D401-F834 WeakPolarHBondContact O-CB 3.29Å; D401-F834 VanDerWaalsContact O-CD1 3.23Å; D401-F834 WeakPolarHBondContact O-CD1 3.34Å; P403-F834 HydrophobicContact CG-CD1 4.35Å; P403-F834 HydrophobicContact CG-CE1 4.29Å; G830-F834 WeakPolarHBondContact O-CD2 3.06Å; G830-F834 PolarHBondContact O-N 2.92Å; L831-F834 PolarHBondContact O-N 2.87Å
835	A	71.4	Confident	69.6	Low	47 Å²	47	47.3 Å²	47.3	39%	0.388	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-73.6	-30.6	176.8	0	0	0	0	0	114.1	Q402 I832 F833	Q402-A835 PolarHBondContact NE2-O 3.28Å; Q402-A835 VanDerWaalsContact NE2-O 3.13Å; I832-A835 VanDerWaalsContact O-CB 3.3Å; I832-A835 WeakPolarHBondContact O-CB 3.35Å; I832-A835 PolarHBondContact O-N 3.08Å; F833-A835 PolarHBondContact O-N 3.4Å
836	I	77.1	Confident	70.7	Confident	58 Å²	58	50 Å²	50	30%	0.297	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.4	-42.5	-148	-19	175.2	0	0	0	115.9	Y287 D401 F833 S838 T839	Y287-I836 HydrophobicContact CE1-CB 3.83Å; Y287-I836 HydrophobicContact CE1-CD1 4.31Å; Y287-I836 HydrophobicContact CE1-CG2 4.27Å; Y287-I836 WeakPolarHBondContact OH-CB 3.41Å; Y287-I836 WeakPolarHBondContact OH-CG2 3.44Å; D401-I836 PolarHBondContact OD1-N 2.89Å; F833-I836 PolarHBondContact O-N 3.22Å; I836-S838 PolarHBondContact O-N 2.94Å; I836-S838 VanDerWaalsContact O-N 3.09Å; I836-T839 PolarHBondContact O-N 3.07Å; I836-T839 PolarHBondContact O-OG1 3.21Å
837	L	78.4	Confident	71.4	Confident	1 Å²	1	52.1 Å²	52.1	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-61.7	-16.5	171.5	164.9	70.5	0	0	0	110.7	Y287 I288 D398 D401 T839 I840 L841	Y287-L837 HydrophobicContact CD1-CB 4.41Å; Y287-L837 HydrophobicContact CD2-CB 3.37Å; Y287-L837 HydrophobicContact CD2-CD1 3.79Å; Y287-L837 HydrophobicContact CD2-CG 4.14Å; Y287-L837 HydrophobicContact CE2-CB 4.05Å; Y287-L837 HydrophobicContact CG-CB 3.57Å; Y287-L837 HydrophobicContact CG-CD1 4.33Å; Y287-L837 HydrophobicContact CG-CG 4.39Å; I288-L837 HydrophobicContact CD1-CD1 4.28Å; I288-L837 HydrophobicContact CG1-CD1 4.28Å; I288-L837 HydrophobicContact CG1-CD2 4.07Å; D398-L837 HydrophobicContact CB-CD1 4.03Å; D398-L837 HydrophobicContact CB-CD2 3.94Å; D398-L837 HydrophobicContact CB-CG 4.18Å; D401-L837 VanDerWaalsContact CG-CA 3.47Å; D401-L837 WeakPolarHBondContact OD1-CA 3.3Å; D401-L837 WeakPolarHBondContact OD1-CB 3.17Å; D401-L837 PolarHBondContact OD1-N 3.46Å; D401-L837 WeakPolarHBondContact OD2-CA 3.45Å; D401-L837 WeakPolarHBondContact OD2-CB 3.37Å; D401-L837 VanDerWaalsContact OD2-CD2 3.26Å; D401-L837 WeakPolarHBondContact OD2-CD2 3.45Å; D401-L837 WeakPolarHBondContact OD2-CG 3.41Å; L837-T839 VanDerWaalsContact C-N 3.26Å; L837-T839 PolarHBondContact O-N 3.26Å; L837-I840 HydrophobicContact CD1-CB 4.47Å; L837-I840 HydrophobicContact CD1-CG2 4.01Å; L837-I840 PolarHBondContact O-N 3.32Å; L837-L841 WeakPolarHBondContact O-CB 3.23Å; L837-L841 PolarHBondContact O-N 2.89Å
838	S	73.9	Confident	72	Confident	10 Å²	10	50.5 Å²	50.5	7%	0.07	28%	0.275	C	S	.	.	H	α-helix	trans	-58.9	-33.3	169.3	-162.8	0	0	0	0	114.3	D401 Q402 I836 L841 G842	D401-S838 VanDerWaalsContact CB-N 3.27Å; D401-S838 PolarHBondContact OD1-N 3.06Å; D401-S838 VanDerWaalsContact OD1-N 3.13Å; D401-S838 PolarHBondContact OD2-N 3.48Å; Q402-S838 WeakPolarHBondContact CB-OG 3.38Å; Q402-S838 VanDerWaalsContact CD-CB 3.41Å; Q402-S838 WeakPolarHBondContact CG-OG 3.3Å; Q402-S838 PolarHBondContact OE1-OG 2.9Å; I836-S838 PolarHBondContact O-N 2.94Å; I836-S838 VanDerWaalsContact O-N 3.09Å; S838-L841 WeakPolarHBondContact O-CB 2.95Å; S838-G842 PolarHBondContact O-N 3.27Å
839	T	72	Confident	72.2	Confident	91 Å²	91	50.1 Å²	50.1	56%	0.558	27%	0.265	S	S	*	.	H	α-helix	trans	-82.7	-37.2	-176.1	67	0	0	0	0	111.4	I836 L837 G842	I836-T839 PolarHBondContact O-N 3.07Å; I836-T839 PolarHBondContact O-OG1 3.21Å; L837-T839 VanDerWaalsContact C-N 3.26Å; L837-T839 PolarHBondContact O-N 3.26Å; T839-G842 PolarHBondContact O-N 3.2Å
840	I	78.3	Confident	72.1	Confident	37 Å²	37	53.1 Å²	53.1	19%	0.19	27%	0.273	C	S	.	.	H	α-helix	trans	-59.9	-51	165.6	-85.6	-166.5	0	0	0	109.5	Q286 Y287 I395 F396 L837 G842 C843	Q286-I840 HydrophobicContact CG-CD1 4.18Å; Y287-I840 HydrophobicContact CD2-CD1 3.93Å; Y287-I840 HydrophobicContact CE2-CB 4.36Å; Y287-I840 HydrophobicContact CE2-CD1 3.61Å; Y287-I840 HydrophobicContact CE2-CG1 3.98Å; I395-I840 HydrophobicContact CG2-CG2 4.22Å; I395-I840 VanDerWaalsContact O-O 3.06Å; F396-I840 WeakPolarHBondContact O-CG2 3.42Å; L837-I840 HydrophobicContact CD1-CB 4.47Å; L837-I840 HydrophobicContact CD1-CG2 4.01Å; L837-I840 PolarHBondContact O-N 3.32Å; I840-G842 VanDerWaalsContact C-N 3.32Å; I840-G842 PolarHBondContact O-N 2.8Å; I840-C843 PolarHBondContact O-N 2.82Å; I840-C843 VanDerWaalsContact O-N 3.1Å
841	L	76.3	Confident	71.5	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.01	29%	0.287	C	S	.	.	H	α-helix	trans	-46.2	-56.1	174.4	159.2	95.1	0	0	0	109.6	M397 D398 I399 F406 L837 S838 C843 I844	M397-L841 HydrophobicContact CB-CD1 3.44Å; M397-L841 VanDerWaalsContact CB-CD1 3.44Å; M397-L841 HydrophobicContact CB-CG 4.28Å; M397-L841 HydrophobicContact CE-CD1 4.45Å; M397-L841 HydrophobicContact CE-CG 4.09Å; M397-L841 WeakPolarHBondContact CE-O 3.28Å; M397-L841 HydrophobicContact CG-CB 3.94Å; M397-L841 HydrophobicContact CG-CD1 3.25Å; M397-L841 HydrophobicContact CG-CG 3.6Å; M397-L841 WeakPolarHBondContact CG-O 3.22Å; M397-L841 HydrophobicContact SD-CB 4.46Å; M397-L841 HydrophobicContact SD-CD1 3.26Å; M397-L841 WeakPolarHBondContact SD-CD1 3.46Å; M397-L841 HydrophobicContact SD-CG 3.54Å; M397-L841 VanDerWaalsContact SD-CG 3.54Å; D398-L841 VanDerWaalsContact C-CD1 3.41Å; D398-L841 WeakPolarHBondContact O-CD1 3.44Å; I399-L841 HydrophobicContact CG1-CD1 4.34Å; F406-L841 HydrophobicContact CD2-CD2 4.33Å; F406-L841 HydrophobicContact CE1-CD1 4.05Å; F406-L841 HydrophobicContact CE2-CD1 4.16Å; F406-L841 HydrophobicContact CE2-CD2 3.42Å; F406-L841 VanDerWaalsContact CE2-CD2 3.42Å; F406-L841 HydrophobicContact CE2-CG 4.16Å; F406-L841 HydrophobicContact CZ-CD1 3.64Å; F406-L841 HydrophobicContact CZ-CD2 3.63Å; F406-L841 HydrophobicContact CZ-CG 3.83Å; L837-L841 WeakPolarHBondContact O-CB 3.23Å; L837-L841 PolarHBondContact O-N 2.89Å; S838-L841 WeakPolarHBondContact O-CB 2.95Å; L841-C843 PolarHBondContact O-N 3.02Å; L841-I844 PolarHBondContact O-N 3.1Å; L841-I844 VanDerWaalsContact O-N 3.13Å
842	G	72.6	Confident	70.8	Confident	28 Å²	28	59.6 Å²	59.6	29%	0.289	30%	0.297	S	S	.	.	H	α-helix	trans	-38.9	-25.1	178.4	0	0	0	0	0	117.3	S838 T839 I840	S838-G842 PolarHBondContact O-N 3.27Å; T839-G842 PolarHBondContact O-N 3.2Å; I840-G842 VanDerWaalsContact C-N 3.32Å; I840-G842 PolarHBondContact O-N 2.8Å
843	C	74.9	Confident	69.9	Low	33 Å²	33	57.4 Å²	57.4	22%	0.223	29%	0.286	C	S	.	.	H	α-helix	trans	-94.1	-20	-177.4	-68.5	0	0	0	0	118.2	F394 I395 I840 L841 R847	F394-C843 WeakPolarHBondContact CA-O 3.31Å; I395-C843 HydrophobicContact CB-CB 3.71Å; I395-C843 HydrophobicContact CD1-CB 3.99Å; I395-C843 HydrophobicContact CG1-CB 4.35Å; I395-C843 HydrophobicContact CG2-CB 4.44Å; I395-C843 PolarHBondContact N-O 3.3Å; I395-C843 CarbonylContact O-C 3.55Å; I840-C843 PolarHBondContact O-N 2.82Å; I840-C843 VanDerWaalsContact O-N 3.1Å; L841-C843 PolarHBondContact O-N 3.02Å; C843-R847 PolarHBondContact O-N 3.31Å
844	I	76.8	Confident	68.3	Low	4 Å²	4	63.5 Å²	63.5	2%	0.021	31%	0.309	C	S	.	.	H	α-helix	trans	-80	-18.6	180	-140	147.2	0	0	0	115.1	F394 I395 F396 M397 L841 R848	F394-I844 HydrophobicContact CB-CB 4.48Å; F394-I844 HydrophobicContact CB-CG1 3.81Å; F394-I844 VanDerWaalsContact CD1-O 3.22Å; F394-I844 WeakPolarHBondContact CD1-O 3.27Å; F394-I844 WeakPolarHBondContact O-CD1 3.19Å; F394-I844 WeakPolarHBondContact O-CG1 3.35Å; I395-I844 VanDerWaalsContact C-CB 3.42Å; I395-I844 VanDerWaalsContact N-CA 3.3Å; I395-I844 VanDerWaalsContact O-CA 3.31Å; I395-I844 WeakPolarHBondContact O-CA 3.45Å; I395-I844 WeakPolarHBondContact O-CB 3.5Å; I395-I844 PolarHBondContact O-N 2.67Å; F396-I844 VanDerWaalsContact CA-CD1 3.46Å; F396-I844 HydrophobicContact CB-CD1 4.23Å; F396-I844 HydrophobicContact CD1-CD1 4.37Å; F396-I844 HydrophobicContact CD2-CD1 3.61Å; F396-I844 HydrophobicContact CE2-CD1 4.02Å; F396-I844 HydrophobicContact CG-CD1 3.81Å; M397-I844 HydrophobicContact CB-CG2 3.54Å; M397-I844 HydrophobicContact CG-CB 4.44Å; M397-I844 HydrophobicContact CG-CG2 3.75Å; M397-I844 VanDerWaalsContact N-CG2 3.28Å; L841-I844 PolarHBondContact O-N 3.1Å; L841-I844 VanDerWaalsContact O-N 3.13Å; I844-R848 VanDerWaalsContact CD1-NH2 3.34Å; I844-R848 VanDerWaalsContact CG1-CZ 3.45Å
845	L	72.3	Confident	66.8	Low	6 Å²	6	69.2 Å²	69.2	3%	0.031	33%	0.328	C	S	.	.	H	α-helix	trans	-99.1	-24.8	176.4	-49	-178.1	0	0	0	110.5	F394 M397 A432 N433 Y526 R527	F394-L845 WeakPolarHBondContact CE1-O 3.32Å; M397-L845 HydrophobicContact CB-CD1 4.46Å; M397-L845 HydrophobicContact CB-CG 4.37Å; M397-L845 HydrophobicContact CE-CB 3.71Å; M397-L845 HydrophobicContact CE-CD1 3.76Å; M397-L845 HydrophobicContact CE-CG 3.61Å; M397-L845 HydrophobicContact CG-CD1 4.03Å; M397-L845 HydrophobicContact CG-CD2 4.49Å; M397-L845 HydrophobicContact CG-CG 3.81Å; M397-L845 HydrophobicContact SD-CB 4.14Å; M397-L845 HydrophobicContact SD-CD1 3.04Å; M397-L845 WeakPolarHBondContact SD-CD1 3.48Å; M397-L845 HydrophobicContact SD-CD2 4.45Å; M397-L845 HydrophobicContact SD-CG 3.33Å; M397-L845 WeakPolarHBondContact SD-CG 3.05Å; A432-L845 HydrophobicContact CB-CB 3.85Å; A432-L845 WeakPolarHBondContact O-CD1 3.36Å; N433-L845 HydrophobicContact CB-CB 3.83Å; N433-L845 HydrophobicContact CB-CD1 3.73Å; N433-L845 HydrophobicContact CB-CD2 3.59Å; N433-L845 HydrophobicContact CB-CG 3.82Å; N433-L845 VanDerWaalsContact ND2-CD2 3.31Å; N433-L845 WeakPolarHBondContact ND2-CD2 3.35Å; Y526-L845 HydrophobicContact CD1-CD1 4.34Å; R527-L845 WeakPolarHBondContact O-CD2 3.42Å
846	R	68.7	Low	65.3	Low	206 Å²	206	71 Å²	71	78%	0.777	34%	0.338	S	S	*	.	H	α-helix	trans	-83.1	-33.9	175.8	-175.6	169.7	-175	-153.1	-0.3	116.3	F394	F394-R846 WeakPolarHBondContact CE1-O 3.44Å; F394-R846 VanDerWaalsContact CZ-C 3.48Å; F394-R846 WeakPolarHBondContact CZ-O 3.43Å
847	R	71.5	Confident	63.6	Low	76 Å²	76	74.8 Å²	74.8	29%	0.287	36%	0.356	S	S	.	.	H	α-helix	trans	-82	-34.6	160.6	-29.3	-164.7	-149.1	140.4	-11.5	125.5	H392 N393 F394 I395 C843 K849 Q850	H392-R847 HydrophobicContact CB-CB 4.34Å; N393-R847 WeakPolarHBondContact O-CD 3.4Å; N393-R847 PolarHBondContact O-NH1 2.91Å; F394-R847 HydrophobicContact CB-CB 3.81Å; F394-R847 HydrophobicContact CD1-CB 3.62Å; F394-R847 HydrophobicContact CD2-CB 2.59Å; F394-R847 HydrophobicContact CD2-CG 4.14Å; F394-R847 WeakPolarHBondContact CD2-O 3.33Å; F394-R847 HydrophobicContact CE1-CB 3.94Å; F394-R847 WeakPolarHBondContact CE1-O 3.2Å; F394-R847 HydrophobicContact CE2-CB 2.96Å; F394-R847 HydrophobicContact CE2-CG 4.32Å; F394-R847 WeakPolarHBondContact CE2-O 3.34Å; F394-R847 HydrophobicContact CG-CB 2.95Å; F394-R847 HydrophobicContact CG-CG 4.32Å; F394-R847 WeakPolarHBondContact CG-O 3.39Å; F394-R847 HydrophobicContact CZ-CB 3.65Å; F394-R847 VanDerWaalsContact CZ-N 3.3Å; F394-R847 WeakPolarHBondContact CZ-O 3.49Å; I395-R847 VanDerWaalsContact CD1-NH1 3.28Å; C843-R847 PolarHBondContact O-N 3.31Å; R847-K849 VanDerWaalsContact C-N 3.26Å; R847-K849 PolarHBondContact O-N 2.98Å; R847-Q850 PolarHBondContact O-N 3.14Å
848	R	69.7	Low	61.7	Low	32 Å²	32	81.2 Å²	81.2	12%	0.121	39%	0.389	C	S	.	.	H	α-helix	trans	-52.5	-33.3	158.2	-63.2	152.9	177	-166.3	-12.8	112.5	F394 L529 I844 Q850 Q851 L852	F394-R848 HydrophobicContact CB-CG 4.36Å; F394-R848 HydrophobicContact CD1-CB 4.27Å; F394-R848 VanDerWaalsContact CD2-N 3.28Å; L529-R848 HydrophobicContact CD1-CB 4Å; L529-R848 HydrophobicContact CD1-CG 3.8Å; L529-R848 PolarHBondContact O-NH1 3.38Å; L529-R848 PolarHBondContact O-NH2 2.63Å; I844-R848 VanDerWaalsContact CD1-NH2 3.34Å; I844-R848 VanDerWaalsContact CG1-CZ 3.45Å; R848-Q850 PolarHBondContact O-N 3.04Å; R848-Q851 PolarHBondContact O-N 2.82Å; R848-L852 PolarHBondContact O-N 2.8Å
849	K	56	Low	59.9	Low	56 Å²	56	88.4 Å²	88.4	24%	0.243	42%	0.422	C	S	.	.	H	α-helix	trans	-66	-30.4	179.3	-162	157.7	-173.6	156.2	0	114	F394 L488 R847 I853	F394-K849 HydrophobicContact CE1-CB 3.91Å; L488-K849 VanDerWaalsContact CD1-NZ 3.34Å; R847-K849 VanDerWaalsContact C-N 3.26Å; R847-K849 PolarHBondContact O-N 2.98Å; K849-I853 WeakPolarHBondContact O-CD1 3.21Å; K849-I853 WeakPolarHBondContact O-CG1 3.01Å
850	Q	60.7	Low	58.3	Low	115 Å²	115	87.8 Å²	87.8	54%	0.537	42%	0.421	S	S	.	.	H	α-helix	trans	-80.8	-19.8	173.3	-77.1	174.7	-23.4	0	0	113.3	F394 R847 R848	F394-Q850 HydrophobicContact CE2-CB 4.11Å; F394-Q850 HydrophobicContact CZ-CB 3.58Å; F394-Q850 HydrophobicContact CZ-CG 3.75Å; R847-Q850 PolarHBondContact O-N 3.14Å; R848-Q850 PolarHBondContact O-N 3.04Å
851	Q	62	Low	56.1	Low	124 Å²	124	92.3 Å²	92.3	58%	0.579	45%	0.446	S	S	*	.	H	α-helix	trans	-79.8	-33.2	177.7	-69.7	-177.8	-24.1	0	0	112.3	R848	R848-Q851 PolarHBondContact O-N 2.82Å
852	L	53.9	Low	54	Low	93 Å²	93	98.9 Å²	98.9	49%	0.487	48%	0.481	S	S	.	.	H	α-helix	trans	-68.6	-44.7	176.5	-74.5	165	0	0	0	112.8	R848 R854 R855	R848-L852 PolarHBondContact O-N 2.8Å; L852-R854 PolarHBondContact O-N 2.87Å; L852-R855 PolarHBondContact O-N 3.49Å
853	I	50.9	Low	52.2	Low	96 Å²	96	103 Å²	103	49%	0.492	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-20.8	179.5	-65.3	169.3	0	0	0	112.5	K849	K849-I853 WeakPolarHBondContact O-CD1 3.21Å; K849-I853 WeakPolarHBondContact O-CG1 3.01Å
854	R	42	Very low	50.3	Low	135 Å²	135	109.9 Å²	109.9	51%	0.509	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-5.3	179.2	-147.6	179.4	-174.5	-173.3	0.9	114.2	L852	L852-R854 PolarHBondContact O-N 2.87Å
855	R	42.7	Very low	48.2	Very low	203 Å²	203	115.8 Å²	115.8	77%	0.766	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.5	-40.2	175.4	-78	-174.6	169.5	175.5	-3.6	113.2	L852 M857 L858	L852-R855 PolarHBondContact O-N 3.49Å; R855-M857 PolarHBondContact O-N 3.37Å; R855-L858 PolarHBondContact O-N 2.79Å
856	S	41	Very low	46.4	Very low	85 Å²	85	119.7 Å²	119.7	59%	0.594	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	-13.9	178.7	50.9	0	0	0	0	114.8
857	M	40.5	Very low	45	Very low	137 Å²	137	114.5 Å²	114.5	68%	0.675	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	5.1	178.3	-76.6	-81.5	-140.2	0	0	114.4	R855	R855-M857 PolarHBondContact O-N 3.37Å
858	L	38.8	Very low	43.4	Very low	137 Å²	137	117.9 Å²	117.9	72%	0.717	59%	0.587	S	S	*	*	S	Bend	trans	-114.7	-11.6	-174.6	-99.8	160.4	0	0	0	115	R855	R855-L858 PolarHBondContact O-N 2.79Å
859	E	37.1	Very low	41.9	Very low	160 Å²	160	120.6 Å²	120.6	75%	0.748	60%	0.603	S	S	*	*	S	Bend	trans	-101.2	-12.6	180	-67.4	177	135.5	0	0	113	N861	E859-N861 PolarHBondContact O-N 3.44Å
860	S	37.1	Very low	40.8	Very low	79 Å²	79	126.6 Å²	126.6	55%	0.552	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	-8.7	-176.9	53.5	0	0	0	0	115.7
861	N	33.2	Very low	39.7	Very low	132 Å²	132	128.6 Å²	128.6	71%	0.706	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.9	-1.2	-171.1	-85.8	-33.7	0	0	0	115.9	E859	E859-N861 PolarHBondContact O-N 3.44Å
862	N	32.7	Very low	38.5	Very low	139 Å²	139	127 Å²	127	74%	0.743	62%	0.623	S	S	*	*	S	Bend	trans	-95.5	-12	-178.6	-76.3	-19.9	0	0	0	114.8	H864	N862-H864 PolarHBondContact O-N 3.43Å; N862-H864 VanDerWaalsContact O-N 3.16Å
863	N	34	Very low	37.4	Very low	114 Å²	114	127.6 Å²	127.6	61%	0.61	63%	0.626	S	S	*	*			trans	-87.2	22.4	-172	-63.7	3.4	0	0	0	114.1	L865	N863-L865 PolarHBondContact O-N 3Å
864	H	33.9	Very low	36.7	Very low	178 Å²	178	127 Å²	127	82%	0.824	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	14.4	179.6	-156.8	-65.7	0	0	0	113.3	N862	N862-H864 PolarHBondContact O-N 3.43Å; N862-H864 VanDerWaalsContact O-N 3.16Å
865	L	33.3	Very low	36.5	Very low	129 Å²	129	126.6 Å²	126.6	68%	0.675	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.6	-38.7	178.8	-145.9	70.1	0	0	0	112.9	N863 V867 Q868	N863-L865 PolarHBondContact O-N 3Å; L865-V867 VanDerWaalsContact C-N 3.35Å; L865-V867 PolarHBondContact O-N 2.87Å; L865-Q868 PolarHBondContact O-N 2.97Å
866	D	34.9	Very low	36.1	Very low	88 Å²	88	120.6 Å²	120.6	47%	0.471	62%	0.622	S	S	.	*	H	α-helix	trans	-75.5	-21.3	-171.6	-59.4	-52.6	0	0	0	114.1	Q868 I869 Y870	D866-Q868 PolarHBondContact O-N 2.95Å; D866-Q868 VanDerWaalsContact O-N 3.15Å; D866-I869 PolarHBondContact O-N 3.08Å; D866-Y870 PolarHBondContact O-N 2.7Å
867	V	39.9	Very low	35.6	Very low	96 Å²	96	124 Å²	124	58%	0.582	63%	0.63	S	S	*	*	H	α-helix	trans	-63.9	-17.1	175.6	177.6	0	0	0	0	112.6	L865 R871	L865-V867 VanDerWaalsContact C-N 3.35Å; L865-V867 PolarHBondContact O-N 2.87Å; V867-R871 PolarHBondContact O-NH1 2.69Å
868	Q	38.2	Very low	35.2	Very low	147 Å²	147	127.4 Å²	127.4	69%	0.687	64%	0.642	S	S	*	*	H	α-helix	trans	-93.1	-40.2	173.6	-159.3	148.8	-18.6	0	0	111.5	L865 D866 Y870 R871	L865-Q868 PolarHBondContact O-N 2.97Å; D866-Q868 PolarHBondContact O-N 2.95Å; D866-Q868 VanDerWaalsContact O-N 3.15Å; Q868-Y870 PolarHBondContact O-N 2.97Å; Q868-R871 PolarHBondContact O-N 3.25Å; Q868-R871 VanDerWaalsContact O-N 3.12Å
869	I	37.5	Very low	34.6	Very low	89 Å²	89	125.1 Å²	125.1	46%	0.456	64%	0.637	S	S	.	*	H	α-helix	trans	-61.2	-44.9	176.2	-63.6	174.3	0	0	0	111.3	D866 R871 D872 L873	D866-I869 PolarHBondContact O-N 3.08Å; I869-R871 PolarHBondContact O-N 3.44Å; I869-D872 PolarHBondContact O-N 3.09Å; I869-L873 HydrophobicContact CG2-CD1 3.72Å; I869-L873 PolarHBondContact O-N 3.11Å; I869-L873 VanDerWaalsContact O-N 3.17Å
870	Y	31.9	Very low	34.2	Very low	183 Å²	183	125.9 Å²	125.9	72%	0.718	64%	0.641	S	S	*	*	H	α-helix	trans	-62.7	-24.8	176.1	-113	-89.7	0	0	0	113.9	D866 Q868 S874	D866-Y870 PolarHBondContact O-N 2.7Å; Q868-Y870 PolarHBondContact O-N 2.97Å; Y870-S874 WeakPolarHBondContact O-CB 3.36Å; Y870-S874 PolarHBondContact O-N 3.18Å; Y870-S874 PolarHBondContact O-OG 2.8Å
871	R	37.5	Very low	33.8	Very low	156 Å²	156	128.2 Å²	128.2	59%	0.589	65%	0.647	S	S	*	*	H	α-helix	trans	-84.2	-10.9	-176.6	-172.4	174.1	-93.3	115.4	-13.3	113.2	V867 Q868 I869 K875	V867-R871 PolarHBondContact O-NH1 2.69Å; Q868-R871 PolarHBondContact O-N 3.25Å; Q868-R871 VanDerWaalsContact O-N 3.12Å; I869-R871 PolarHBondContact O-N 3.44Å; R871-K875 WeakPolarHBondContact O-CE 3.39Å; R871-K875 PolarHBondContact O-NZ 2.79Å; R871-K875 VanDerWaalsContact O-NZ 3.08Å
872	D	36.9	Very low	33.5	Very low	91 Å²	91	128.1 Å²	128.1	49%	0.487	65%	0.651	S	S	.	*	H	α-helix	trans	-112.3	-34.6	176.4	-69.4	-34.8	0	0	0	113.1	I869 S874 K875	I869-D872 PolarHBondContact O-N 3.09Å; D872-S874 VanDerWaalsContact C-N 3.26Å; D872-S874 PolarHBondContact O-N 3.37Å; D872-K875 WeakPolarHBondContact O-CB 3.49Å; D872-K875 PolarHBondContact O-N 3.32Å; D872-K875 IonicContact OD1-NZ 2.63Å; D872-K875 PolarHBondContact OD1-NZ 2.71Å
873	L	32.4	Very low	33.2	Very low	106 Å²	106	125.5 Å²	125.5	56%	0.555	64%	0.644	S	S	*	*	H	α-helix	trans	-63.7	-29.6	169.7	-89.6	151.5	0	0	0	113.2	I869 K875 S876	I869-L873 HydrophobicContact CG2-CD1 3.72Å; I869-L873 PolarHBondContact O-N 3.11Å; I869-L873 VanDerWaalsContact O-N 3.17Å; L873-K875 PolarHBondContact O-N 3.33Å; L873-S876 PolarHBondContact O-N 3.21Å; L873-S876 PolarHBondContact O-OG 2.92Å
874	S	36.4	Very low	32.9	Very low	84 Å²	84	124.7 Å²	124.7	59%	0.587	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	-7.9	173.1	46.6	0	0	0	0	114.1	Y870 D872	Y870-S874 WeakPolarHBondContact O-CB 3.36Å; Y870-S874 PolarHBondContact O-N 3.18Å; Y870-S874 PolarHBondContact O-OG 2.8Å; D872-S874 VanDerWaalsContact C-N 3.26Å; D872-S874 PolarHBondContact O-N 3.37Å
875	K	37.6	Very low	32.6	Very low	125 Å²	125	122.6 Å²	122.6	54%	0.543	64%	0.643	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.1	-10.3	175.4	-59.5	170.5	-170.7	147.5	0	113.5	R871 D872 L873	R871-K875 WeakPolarHBondContact O-CE 3.39Å; R871-K875 PolarHBondContact O-NZ 2.79Å; R871-K875 VanDerWaalsContact O-NZ 3.08Å; D872-K875 WeakPolarHBondContact O-CB 3.49Å; D872-K875 PolarHBondContact O-N 3.32Å; D872-K875 IonicContact OD1-NZ 2.63Å; D872-K875 PolarHBondContact OD1-NZ 2.71Å; L873-K875 PolarHBondContact O-N 3.33Å
876	S	34.1	Very low	32.4	Very low	77 Å²	77	122.1 Å²	122.1	54%	0.538	65%	0.65	S	S	.	*	S	Bend	trans	-110.7	8.5	-171.1	65.6	0	0	0	0	115.4	L873	L873-S876 PolarHBondContact O-N 3.21Å; L873-S876 PolarHBondContact O-OG 2.92Å
877	M	30.8	Very low	32.1	Very low	157 Å²	157	125.4 Å²	125.4	77%	0.773	67%	0.668	S	S	*	*	S	Bend	trans	-127.2	-12.5	172.2	-78	-170.7	170.4	0	0	114.9
878	F	30.6	Very low	31.7	Very low	209 Å²	209	125.6 Å²	125.6	92%	0.917	67%	0.671	S	S	*	*	S	Bend	trans	-126.1	47.5	170.1	-76.9	-73.6	0	0	0	111.8
879	S	27.4	Very low	31.2	Very low	89 Å²	89	129.5 Å²	129.5	62%	0.622	68%	0.679	S	S	*	*			trans	-151	102.1	165.1	-172.3	0	0	0	0	109.2
880	E	28.6	Very low	30.8	Very low	176 Å²	176	130.4 Å²	130.4	82%	0.822	69%	0.689	S	S	*	*			trans	-153.8	110.1	148.1	-118.5	-179	-156	0	0	112.9
881	N	28.9	Very low	30.7	Very low	127 Å²	127	130.9 Å²	130.9	68%	0.679	70%	0.695	S	S	*	*			trans	54.9	100.9	142.3	-59.2	-20.6	0	0	0	120.1	S883	N881-S883 VanDerWaalsContact C-N 3.34Å; N881-S883 PolarHBondContact O-N 2.89Å
882	V	26.4	Very low	30.1	Very low	131 Å²	131	127.7 Å²	127.7	79%	0.794	70%	0.696	S	S	*	*			trans	-53	101.5	133.1	171.9	0	0	0	0	108.5	T884	V882-T884 VanDerWaalsContact C-N 3.33Å; V882-T884 HydrophobicContact CG1-CG2 3.91Å; V882-T884 PolarHBondContact O-N 2.78Å
883	S	26	Very low	29.9	Very low	84 Å²	84	133.9 Å²	133.9	59%	0.587	71%	0.714	S	S	*	*			trans	-76.6	78.2	-179	50.3	0	0	0	0	111.8	N881	N881-S883 VanDerWaalsContact C-N 3.34Å; N881-S883 PolarHBondContact O-N 2.89Å
884	T	26.8	Very low	29.8	Very low	97 Å²	97	132.8 Å²	132.8	60%	0.595	72%	0.715	S	S	*	*			trans	-104	148.6	170	47.7	0	0	0	0	111.3	V882	V882-T884 VanDerWaalsContact C-N 3.33Å; V882-T884 HydrophobicContact CG1-CG2 3.91Å; V882-T884 PolarHBondContact O-N 2.78Å
885	T	28.7	Very low	29.9	Very low	133 Å²	133	134.6 Å²	134.6	82%	0.816	73%	0.725	S	S	*	*			trans	67.7	63.3	176.4	63.9	0	0	0	0	117.4
886	S	28.6	Very low	29.5	Very low	120 Å²	120	137.3 Å²	137.3	84%	0.839	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-68.6	147.7	131.8	54.4	0	0	0	0	109.4
887	N	28.6	Very low	29.5	Very low	156 Å²	156	140.3 Å²	140.3	83%	0.834	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-81.3	165.4	-168.1	-106.5	-34	0	0	0	113.5
888	P	31.1	Very low	29.6	Very low	100 Å²	100	141.4 Å²	141.4	65%	0.649	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-95.7	153.3	-150.8	36.3	-39.3	0	0	0	115.4
889	R	28.1	Very low	29.7	Very low	229 Å²	229	135.9 Å²	135.9	86%	0.864	74%	0.735	S	S	*	*				166.7	144	112.3	-93	172.8	170.5	164.1	-2	114.5
890	T	30.4	Very low	30	Very low	109 Å²	109	137.3 Å²	137.3	67%	0.669	74%	0.736	S	S	*	*			trans	65.4	117.2	146.4	49.6	0	0	0	0	122.9
891	K	28.2	Very low	30.4	Very low	192 Å²	192	134.6 Å²	134.6	84%	0.835	73%	0.727	S	S	*	*			trans	75.8	143.5	132.6	-64.4	177.5	-180	-178.9	0	117.5
892	C	26.5	Very low	30.6	Very low	90 Å²	90	134.5 Å²	134.5	61%	0.608	73%	0.727	S	S	*	*			cis	-164.4	161.1	-3.9	-124	0	0	0	0	114.5
893	Y	32	Very low	31	Very low	220 Å²	220	134.2 Å²	134.2	86%	0.863	72%	0.721	S	S	*	*			trans	70.8	119.1	154.9	-70.7	-62.3	0	0	0	124
894	S	31	Very low	31.3	Very low	84 Å²	84	136.9 Å²	136.9	59%	0.587	73%	0.729	S	S	*	*			trans	-98.6	165.5	158.2	63.5	0	0	0	0	111.9
895	P	36.7	Very low	31.6	Very low	121 Å²	121	137.9 Å²	137.9	79%	0.786	74%	0.739	S	S	*	*				-146	155.6	97.3	23.3	-0.8	0	0	0	114.6
896	K	31.2	Very low	31.5	Very low	183 Å²	183	139 Å²	139	80%	0.796	74%	0.74	S	S	*	*			cis	90.3	158.9	46.6	-70	-176.4	178.9	-177.8	0	115.8
897	V	33.6	Very low	31.5	Very low	139 Å²	139	140.5 Å²	140.5	84%	0.842	74%	0.735	S	S	*	*			trans	91.1	131.7	167.2	-178.3	0	0	0	0	115.7
898	K	33.2	Very low	31.5	Very low	181 Å²	181	139.5 Å²	139.5	79%	0.787	73%	0.73	S	S	*	*			cis	-163.4	-176.2	-18	-132	-164.2	167.2	-166.1	0	115.3
899	T	32.4	Very low	31.4	Very low	92 Å²	92	140 Å²	140	56%	0.564	74%	0.736	S	S	*	*			trans	-60.1	169.7	171.2	56.1	0	0	0	0	118
900	N	34.3	Very low	31.4	Very low	120 Å²	120	138.3 Å²	138.3	64%	0.642	74%	0.738	S	S	*	*				177.3	156.7	61.7	-130.8	14.1	0	0	0	115.5
901	N	35.7	Very low	31.2	Very low	118 Å²	118	139.2 Å²	139.2	63%	0.631	75%	0.745	S	S	*	*			trans	61.9	156.7	147.9	-64	1.3	0	0	0	122.1
902	N	34.2	Very low	31.2	Very low	125 Å²	125	135.9 Å²	135.9	67%	0.668	75%	0.746	S	S	*	*			cis	-169	162.1	-22.7	-103.7	-4	0	0	0	113.2
903	N	34.5	Very low	31.3	Very low	125 Å²	125	135.9 Å²	135.9	67%	0.668	75%	0.747	S	S	*	*			trans	78	107.4	150.3	-65.2	-3.3	0	0	0	124.5
904	N	31.2	Very low	31	Very low	141 Å²	141	136 Å²	136	75%	0.754	75%	0.747	S	S	*	*				82.4	142	119.6	-64.3	-5.9	0	0	0	125.2
905	S	33	Very low	30.9	Very low	117 Å²	117	140.2 Å²	140.2	82%	0.818	76%	0.756	S	S	*	*			trans	73.4	149.9	163.6	75.2	0	0	0	0	118.1
906	L	28.1	Very low	30.6	Very low	158 Å²	158	142.2 Å²	142.2	83%	0.827	76%	0.759	S	S	*	*			cis	-165.4	156.5	-33.4	-170.1	70.4	0	0	0	106.4
907	M	28.6	Very low	30.4	Very low	151 Å²	151	138.8 Å²	138.8	74%	0.744	75%	0.749	S	S	*	*			trans	80.1	128.7	171.8	-52.2	-173.8	68.5	0	0	118.7
908	N	28.4	Very low	30.2	Very low	134 Å²	134	139.2 Å²	139.2	72%	0.717	75%	0.746	S	S	*	*			trans	70.5	106.1	146.2	-61.1	0.9	0	0	0	122.3
909	S	28.8	Very low	30.1	Very low	112 Å²	112	137.4 Å²	137.4	78%	0.783	74%	0.74	S	S	*	*			trans	66.3	100.1	135.3	57.1	0	0	0	0	121.7
910	Q	28.3	Very low	29.9	Very low	193 Å²	193	138.5 Å²	138.5	90%	0.902	74%	0.742	S	S	*	*			trans	54.3	113.8	141.1	-64.3	-161.9	-39	0	0	120.8
911	P	24.7	Very low	29.6	Very low	128 Å²	128	140.9 Å²	140.9	83%	0.831	75%	0.75	S	S	*	*			trans	-100.3	147.5	175	37.4	-32.3	0	0	0	114.5
912	S	29.4	Very low	29.2	Very low	122 Å²	122	138.9 Å²	138.9	85%	0.853	76%	0.757	S	S	*	*			trans	-146.9	77.3	156.1	52.3	0	0	0	0	111.8
913	S	28.1	Very low	28.9	Very low	89 Å²	89	137.1 Å²	137.1	62%	0.622	75%	0.754	S	S	*	*			trans	-44.2	159.6	162	46.9	0	0	0	0	115.3
914	Y	26.8	Very low	28.7	Very low	222 Å²	222	138.7 Å²	138.7	87%	0.871	75%	0.752	S	S	*	*			cis	-164	133.2	-23.5	-82.5	-54.6	0	0	0	103.3
915	F	27.6	Very low	28.7	Very low	174 Å²	174	135.7 Å²	135.7	76%	0.763	74%	0.742	S	S	*	*				71.5	116.6	51	-123.2	-66	0	0	0	116
916	L	31.1	Very low	28.9	Very low	162 Å²	162	133.5 Å²	133.5	85%	0.848	73%	0.725	S	S	*	*			trans	174.4	153.2	149.6	-95.3	177.3	0	0	0	109.1
917	N	26.7	Very low	29	Very low	111 Å²	111	129.3 Å²	129.3	59%	0.594	71%	0.709	S	S	*	*				-161.8	-174.1	-66.2	-127.6	-12.4	0	0	0	109.5
918	L	29.1	Very low	29.2	Very low	149 Å²	149	128.8 Å²	128.8	78%	0.78	71%	0.709	S	S	*	*			trans	83.4	133.9	167.4	-60.5	120.7	0	0	0	118.1
919	H	30.2	Very low	29.3	Very low	142 Å²	142	127.7 Å²	127.7	66%	0.657	71%	0.712	S	S	*	*			cis	-167.2	150.5	-19.8	-134.9	-105.1	0	0	0	110.6
920	N	28.6	Very low	29.3	Very low	115 Å²	115	126.9 Å²	126.9	62%	0.615	71%	0.706	S	S	*	*			trans	54.1	143.9	144.6	-86.2	26.2	0	0	0	123.1
921	E	28.7	Very low	29.3	Very low	170 Å²	170	125.7 Å²	125.7	79%	0.794	71%	0.706	S	S	*	*			cis	-140.1	145.4	-16	-58.5	-165	155.1	0	0	107.5
922	G	27.8	Very low	29.5	Very low	76 Å²	76	123.2 Å²	123.2	78%	0.784	70%	0.704	S	S	*	*				105.7	150.5	85.1	0	0	0	0	0	110.3
923	S	27.7	Very low	29.4	Very low	88 Å²	88	125.6 Å²	125.6	62%	0.615	71%	0.706	S	S	*	*			cis	-158.3	139.5	-5.7	47.1	0	0	0	0	107.1
924	Y	29.8	Very low	29.4	Very low	159 Å²	159	126.6 Å²	126.6	62%	0.624	71%	0.71	S	S	*	*				-177.3	166.4	77.7	-95.5	-82.1	0	0	0	109.6	N615	N615-Y924 WeakPolarHBondContact CB-O 3.48Å
925	S	30.6	Very low	29.4	Very low	77 Å²	77	122.1 Å²	122.1	54%	0.538	70%	0.7	S	S	.	*			trans	-150.2	-172.1	-172.4	-42.9	0	0	0	0	111	V614	V614-S925 WeakPolarHBondContact CG2-O 3.37Å; V614-S925 CarbonylContact O-C 3.56Å; V614-S925 VanDerWaalsContact O-CA 3.26Å; V614-S925 WeakPolarHBondContact O-CA 3.3Å
926	P	37.1	Very low	29.3	Very low	72 Å²	72	120 Å²	120	47%	0.468	70%	0.695	S	S	.	*			cis	-126.8	-173.3	-14.9	36.3	-15.6	0	0	0	112.7	V614	V614-P926 PolarHBondContact N-O 2.73Å; V614-P926 CarbonylContact O-C 3.48Å; V614-P926 WeakPolarHBondContact O-CA 3.29Å; V614-P926 VanDerWaalsContact O-O 3.07Å
927	S	31.3	Very low	29	Very low	70 Å²	70	117.8 Å²	117.8	49%	0.49	69%	0.685	S	S	.	*				160.2	153.8	91.7	45.5	0	0	0	0	109.7
928	N	31.6	Very low	29	Very low	140 Å²	140	120.4 Å²	120.4	75%	0.749	69%	0.691	S	S	*	*			cis	-157	150.1	-0.5	-108.3	-3.4	0	0	0	111.5
929	S	30.9	Very low	28.9	Very low	111 Å²	111	118.8 Å²	118.8	78%	0.776	69%	0.689	S	S	*	*			trans	57.5	147	153.8	56.1	0	0	0	0	121.8
930	S	28.9	Very low	28.8	Very low	94 Å²	94	119.3 Å²	119.3	66%	0.657	69%	0.692	S	S	*	*			cis	-175.1	150.9	-17.3	53.1	0	0	0	0	112.5
931	N	28	Very low	28.9	Very low	168 Å²	168	118.2 Å²	118.2	90%	0.898	69%	0.691	S	S	*	*			trans	75.2	115.4	157.1	-55.1	-18.4	0	0	0	120.4
932	G	30.1	Very low	28.9	Very low	77 Å²	77	114.6 Å²	114.6	79%	0.794	68%	0.677	S	S	*	*			trans	-172	148.4	167.8	0	0	0	0	0	111.2
933	I	26.7	Very low	29	Very low	172 Å²	172	116.1 Å²	116.1	88%	0.882	67%	0.672	S	S	*	*			trans	-135.9	149.1	-168.6	-83.2	177.2	0	0	0	109.5
934	P	28	Very low	28.9	Very low	110 Å²	110	115.4 Å²	115.4	71%	0.714	68%	0.678	S	S	*	*			trans	-97.4	-177.7	-134.8	39.4	-39.5	0	0	0	115.1
935	I	26.2	Very low	28.7	Very low	128 Å²	128	109.8 Å²	109.8	66%	0.656	67%	0.669	S	S	*	*			trans	-167.2	126	140.4	-98.8	146.9	0	0	0	113.1
936	L	26.4	Very low	28.4	Very low	128 Å²	128	113.5 Å²	113.5	67%	0.67	68%	0.682	S	S	*	*			trans	25	111.5	158.4	-69.7	160.5	0	0	0	121.5
937	N	25.6	Very low	27.8	Very low	117 Å²	117	113 Å²	113	63%	0.626	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-79.5	155.9	158.7	-63.2	-16	0	0	0	112
938	F	25.8	Very low	27.6	Very low	165 Å²	165	116 Å²	116	72%	0.724	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-80.4	146.3	149.1	-83.6	-90.5	0	0	0	109.3	Y1128	F938-Y1128 HydrophobicContact CE2-CD1 4.44Å; F938-Y1128 HydrophobicContact CZ-CD1 4.23Å
939	P	28	Very low	27.3	Very low	115 Å²	115	111.7 Å²	111.7	75%	0.747	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-80.1	135	-159.6	-15.4	31.7	0	0	0	114.4	P941	P939-P941 WeakPolarHBondContact O-CD 3.31Å
940	H	26.7	Very low	27	Very low	153 Å²	153	111.6 Å²	111.6	71%	0.708	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-74.1	124.6	154.1	-89.8	-70.6	0	0	0	109.7	N942	H940-N942 PolarHBondContact O-N 3.04Å
941	P	32	Very low	26.9	Very low	93 Å²	93	112.9 Å²	112.9	60%	0.604	67%	0.67	S	S	*	*			trans	-95.6	79	163.9	35.5	-28.5	0	0	0	109.8	P939	P939-P941 WeakPolarHBondContact O-CD 3.31Å
942	N	28.1	Very low	26.8	Very low	94 Å²	94	112.7 Å²	112.7	50%	0.503	66%	0.664	S	S	.	*			trans	-91	139.8	163.6	-96.7	-36.7	0	0	0	109.3	H940 N1308	H940-N942 PolarHBondContact O-N 3.04Å; N942-N1308 PolarHBondContact OD1-ND2 3.28Å
943	T	29.5	Very low	26.8	Very low	108 Å²	108	116.9 Å²	116.9	66%	0.663	67%	0.667	S	S	*	*	S	Bend	trans	58.6	122.4	172.1	58.2	0	0	0	0	118.2
944	G	26.7	Very low	26.7	Very low	72 Å²	72	113.7 Å²	113.7	74%	0.742	66%	0.66	S	S	*	*			trans	82.8	133.1	167.6	0	0	0	0	0	114.6
945	G	23.8	Very low	26.9	Very low	42 Å²	42	114 Å²	114	43%	0.433	66%	0.662	S	S	.	*			cis	89.2	64.2	-0.3	0	0	0	0	0	114
946	L	25.5	Very low	26.9	Very low	155 Å²	155	114 Å²	114	81%	0.812	66%	0.662	S	S	*	*			trans	-153.6	113.5	166.2	-124.1	169.5	0	0	0	111.4	V948	L946-V948 HydrophobicContact CD2-CG2 4.32Å
947	T	23.8	Very low	26.9	Very low	61 Å²	61	111.2 Å²	111.2	37%	0.374	66%	0.658	S	S	.	*			trans	-96.5	107.6	179.9	49.6	0	0	0	0	111.3	I1318	T947-I1318 HydrophobicContact CG2-CB 4.28Å; T947-I1318 HydrophobicContact CG2-CD1 4.28Å; T947-I1318 HydrophobicContact CG2-CG2 3.81Å
948	V	28.3	Very low	26.9	Very low	132 Å²	132	113.6 Å²	113.6	80%	0.8	67%	0.67	S	S	*	*			trans	-142.4	132.9	162	-173.7	0	0	0	0	107.6	L946	L946-V948 HydrophobicContact CD2-CG2 4.32Å
949	G	25.1	Very low	26.9	Very low	51 Å²	51	110 Å²	110	53%	0.526	67%	0.665	S	S	.	*			cis	127.6	81.1	2	0	0	0	0	0	111.8
950	I	24.5	Very low	26.8	Very low	108 Å²	108	109.2 Å²	109.2	55%	0.554	66%	0.663	S	S	*	*			trans	42	110.9	155.8	-36.5	176	0	0	0	116.7	T1321	I950-T1321 HydrophobicContact CD1-CG2 4.47Å
951	N	26	Very low	26.9	Very low	121 Å²	121	108.7 Å²	108.7	65%	0.647	67%	0.665	S	S	*	*				-178.8	146.7	113.4	-94.6	-53.7	0	0	0	113.4
952	Q	27.1	Very low	26.6	Very low	164 Å²	164	112.8 Å²	112.8	77%	0.766	68%	0.676	S	S	*	*			trans	28.9	125.6	133.7	-49.4	165.5	23.4	0	0	116.4
953	I	29.4	Very low	26.6	Very low	165 Å²	165	115.9 Å²	115.9	85%	0.846	69%	0.692	S	S	*	*				-151.5	159.1	60.5	-80.4	163.5	0	0	0	111.8
954	S	25.2	Very low	26.5	Very low	106 Å²	106	116.4 Å²	116.4	74%	0.741	70%	0.695	S	S	*	*			trans	-66	166.7	-176.6	-50.6	0	0	0	0	116.1
955	P	31.7	Very low	26.5	Very low	116 Å²	116	121.6 Å²	121.6	75%	0.753	70%	0.704	S	S	*	*			trans	-87.6	-162	-175.2	37.6	-37.6	0	0	0	114
956	L	25	Very low	26.7	Very low	127 Å²	127	123.3 Å²	123.3	67%	0.665	71%	0.709	S	S	*	*			trans	82	148.6	-167.7	-72.4	82.6	0	0	0	114.3
957	A	26.5	Very low	26.8	Very low	71 Å²	71	123.2 Å²	123.2	59%	0.587	71%	0.71	S	S	*	*			cis	-171.1	172	-22.7	0	0	0	0	0	109
958	L	25.5	Very low	27	Very low	166 Å²	166	128.3 Å²	128.3	87%	0.869	73%	0.733	S	S	*	*			trans	65.5	156.3	170.5	-83.9	70.6	0	0	0	115.2
959	S	27	Very low	26.9	Very low	90 Å²	90	126.8 Å²	126.8	63%	0.629	73%	0.729	S	S	*	*			cis	-162.2	148.6	-15.6	46.9	0	0	0	0	110.7
960	S	25.3	Very low	27.3	Very low	99 Å²	99	129.2 Å²	129.2	69%	0.692	74%	0.735	S	S	*	*			trans	14.8	114.8	150.4	60.1	0	0	0	0	119.5
961	N	28	Very low	27.5	Very low	142 Å²	142	130.8 Å²	130.8	76%	0.759	75%	0.75	S	S	*	*				-158.4	118.1	123.7	-93	-29.7	0	0	0	108.2
962	Q	26.7	Very low	27.5	Very low	178 Å²	178	129.7 Å²	129.7	83%	0.832	74%	0.743	S	S	*	*				60	91.6	100.1	-68.6	-167.2	-3.7	0	0	114.1
963	L	27.1	Very low	27.5	Very low	159 Å²	159	127.3 Å²	127.3	83%	0.832	74%	0.739	S	S	*	*			trans	-175.1	82.1	149.9	-96.5	159	0	0	0	104.9
964	T	29.2	Very low	27.4	Very low	119 Å²	119	130.6 Å²	130.6	73%	0.73	74%	0.741	S	S	*	*				83.7	141.5	94.3	51.5	0	0	0	0	113.6	S966	T964-S966 PolarHBondContact O-N 3.12Å
965	I	26.7	Very low	27.5	Very low	182 Å²	182	130 Å²	130	93%	0.933	74%	0.737	S	S	*	*	S	Bend	trans	-89.2	102.7	-164.2	-60.2	167.4	0	0	0	110.8
966	S	27.1	Very low	27.2	Very low	78 Å²	78	129.6 Å²	129.6	55%	0.545	73%	0.732	S	S	.	*			trans	-153.5	168.2	160.8	59.5	0	0	0	0	110.7	T964 L968	T964-S966 PolarHBondContact O-N 3.12Å; S966-L968 PolarHBondContact O-N 2.92Å
967	D	28	Very low	27.3	Very low	153 Å²	153	133.3 Å²	133.3	82%	0.818	74%	0.739	S	S	*	*	S	Bend	trans	69.6	20.5	156.9	-43.5	-45.2	0	0	0	119.8
968	L	27.4	Very low	27.3	Very low	167 Å²	167	138 Å²	138	87%	0.874	75%	0.751	S	S	*	*			trans	-132.2	124	165.6	-93.4	166.3	0	0	0	113	S966	S966-L968 PolarHBondContact O-N 2.92Å
969	S	27.3	Very low	27.3	Very low	101 Å²	101	136.4 Å²	136.4	71%	0.706	74%	0.743	S	S	*	*			trans	73.9	142.9	175.6	-159.3	0	0	0	0	116.9
970	P	33.1	Very low	27.3	Very low	101 Å²	101	138 Å²	138	66%	0.656	75%	0.749	S	S	*	*			cis	-130.1	169.6	-33.9	35.6	-20.8	0	0	0	113.1
971	V	28.6	Very low	27.3	Very low	142 Å²	142	143.1 Å²	143.1	86%	0.861	75%	0.753	S	S	*	*			trans	-127.6	74.4	161.7	-170.5	0	0	0	0	110.4
972	I	25.9	Very low	27.4	Very low	98 Å²	98	143.4 Å²	143.4	50%	0.503	76%	0.755	S	S	.	*			trans	-71.3	165.1	144.8	-66.5	172.3	0	0	0	107
973	T	26.8	Very low	27.6	Very low	113 Å²	113	143.8 Å²	143.8	69%	0.693	75%	0.754	S	S	*	*			trans	75.3	84.7	177.6	-47.8	0	0	0	0	115.6
974	R	27.4	Very low	27.8	Very low	234 Å²	234	140.5 Å²	140.5	88%	0.883	74%	0.744	S	S	*	*			trans	-145.6	47.7	143.5	-146.3	175.1	-171.7	167.3	4.8	115.2
975	S	26.7	Very low	27.8	Very low	94 Å²	94	142.6 Å²	142.6	66%	0.657	75%	0.746	S	S	*	*			trans	-71.5	159.2	142.4	48.3	0	0	0	0	109.9
976	V	26.5	Very low	27.9	Very low	108 Å²	108	139 Å²	139	66%	0.655	74%	0.737	S	S	*	*			trans	75.9	148.9	178.1	-162.1	0	0	0	0	114.9
977	Y	27	Very low	28.2	Very low	205 Å²	205	140.4 Å²	140.4	80%	0.804	74%	0.744	S	S	*	*			trans	67.3	91.3	-171.3	-60.4	-75.5	0	0	0	113.5
978	M	25.4	Very low	28.3	Very low	168 Å²	168	139.3 Å²	139.3	83%	0.828	74%	0.743	S	S	*	*			cis	62.6	123.5	45.4	-95.6	-69.5	-169.4	0	0	114.8
979	N	25.9	Very low	28.4	Very low	134 Å²	134	142.5 Å²	142.5	72%	0.717	74%	0.743	S	S	*	*			trans	65.7	109.9	163.3	-90.2	-18.9	0	0	0	122.8
980	T	26.5	Very low	28.5	Very low	122 Å²	122	141.7 Å²	141.7	75%	0.748	74%	0.737	S	S	*	*				38.9	118.5	121.8	54	0	0	0	0	120.6
981	R	26.1	Very low	28.2	Very low	208 Å²	208	144.7 Å²	144.7	79%	0.785	75%	0.745	S	S	*	*			trans	-161.3	125.5	142.3	-129.8	172.2	-177.2	153.5	1.6	115.2
982	N	29.9	Very low	28.2	Very low	147 Å²	147	144.2 Å²	144.2	79%	0.786	74%	0.737	S	S	*	*			trans	156.1	114.9	153.3	-89.4	-32.3	0	0	0	107.6
983	K	31.6	Very low	28.2	Very low	187 Å²	187	144.4 Å²	144.4	81%	0.813	75%	0.747	S	S	*	*	S	Bend	cis	-145.9	160.9	-7.9	-60.6	176.7	-174.7	174.1	0	106.9
984	S	29.8	Very low	28.3	Very low	90 Å²	90	144 Å²	144	63%	0.629	75%	0.749	S	S	*	*			cis	-117.7	-121	-0.4	23.6	0	0	0	0	108.4
985	E	30.2	Very low	28.6	Very low	163 Å²	163	141 Å²	141	76%	0.762	75%	0.75	S	S	*	*			cis	-119.7	-143.6	-27.8	-72	-157.7	140	0	0	110
986	S	28.6	Very low	28.8	Very low	107 Å²	107	140.4 Å²	140.4	75%	0.748	75%	0.752	S	S	*	*			trans	-155	176.1	-160.1	67.9	0	0	0	0	112.6
987	P	33.4	Very low	28.9	Very low	106 Å²	106	143.2 Å²	143.2	69%	0.688	76%	0.762	S	S	*	*				-136.6	179.5	-60.3	39.3	-24.7	0	0	0	112
988	T	30.1	Very low	29	Very low	130 Å²	130	142 Å²	142	80%	0.798	77%	0.768	S	S	*	*				177.2	143.2	126.5	24.8	0	0	0	0	113.7
989	R	29.8	Very low	29.2	Very low	235 Å²	235	137.2 Å²	137.2	89%	0.887	76%	0.761	S	S	*	*			trans	56.4	150.2	153	-77.5	-178.3	161.7	162.1	-6	120.8
990	S	28.5	Very low	29.4	Very low	84 Å²	84	141.1 Å²	141.1	59%	0.587	77%	0.771	S	S	*	*			cis	-177.2	146.9	-28.6	46.2	0	0	0	0	111.1
991	M	27.9	Very low	29.6	Very low	164 Å²	164	141.1 Å²	141.1	81%	0.808	77%	0.771	S	S	*	*			trans	68.3	162.8	157.1	-68.8	174.1	77.6	0	0	118.3
992	N	27.3	Very low	29.8	Very low	131 Å²	131	136.2 Å²	136.2	70%	0.701	76%	0.76	S	S	*	*			cis	-167.3	152.2	-44.9	-105.8	3	0	0	0	110
993	S	27.4	Very low	29.8	Very low	103 Å²	103	139.8 Å²	139.8	72%	0.72	76%	0.764	S	S	*	*			trans	59.2	142.1	149.4	57.1	0	0	0	0	123.2
994	S	28.1	Very low	29.8	Very low	104 Å²	104	138.4 Å²	138.4	73%	0.727	77%	0.765	S	S	*	*			trans	62.9	93.2	146	61.4	0	0	0	0	120.8
995	D	33.5	Very low	29.8	Very low	170 Å²	170	140.8 Å²	140.8	91%	0.909	77%	0.77	S	S	*	*			trans	-164	161.3	136.9	-94.8	-31.3	0	0	0	107.4
996	A	30.7	Very low	29.7	Very low	83 Å²	83	138.1 Å²	138.1	69%	0.686	77%	0.766	S	S	*	*			cis	-157.3	160.4	-41.9	0	0	0	0	0	108
997	L	28.5	Very low	29.8	Very low	166 Å²	166	139 Å²	139	87%	0.869	77%	0.773	S	S	*	*			trans	-51.4	131.1	-174.1	-73.9	57.4	0	0	0	115.6
998	I	30.4	Very low	29.7	Very low	181 Å²	181	142.7 Å²	142.7	93%	0.928	78%	0.778	S	S	*	*			trans	-179	136.9	139.5	-91.5	146.2	0	0	0	107.2
999	G	29.3	Very low	29.8	Very low	66 Å²	66	143.8 Å²	143.8	68%	0.68	78%	0.784	S	S	*	*			cis	-142.3	128.9	-14.9	0	0	0	0	0	109.2
1000	K	30.2	Very low	29.8	Very low	216 Å²	216	135.3 Å²	135.3	94%	0.939	77%	0.77	S	S	*	*			trans	-113.8	52.2	-161.5	-165.1	179.2	179.9	177.3	0	112.1
1001	T	29.6	Very low	29.9	Very low	122 Å²	122	138.4 Å²	138.4	75%	0.748	79%	0.785	S	S	*	*			trans	-141	19.1	-151.4	-21.1	0	0	0	0	118.8
1002	I	30.3	Very low	30.2	Very low	106 Å²	106	136.3 Å²	136.3	54%	0.544	78%	0.782	S	S	.	*	S	Bend	trans	-132.8	34.9	173.7	-27	179.4	0	0	0	115.1	I1005 L1021	I1002-I1005 HydrophobicContact CG2-CD1 4.34Å; I1002-L1021 HydrophobicContact CD1-CD1 4.15Å; I1002-L1021 HydrophobicContact CD1-CD2 4.47Å
1003	Y	30.2	Very low	30.6	Very low	222 Å²	222	134.6 Å²	134.6	87%	0.871	77%	0.773	S	S	*	*	S	Bend	trans	-126.5	18	166.5	-81.1	-77.8	0	0	0	113.5
1004	N	31.3	Very low	31.1	Very low	158 Å²	158	136.8 Å²	136.8	85%	0.845	78%	0.775	S	S	*	*			trans	-135.9	66.4	173.1	-92.3	-27.9	0	0	0	110.1
1005	I	30.5	Very low	31.5	Very low	140 Å²	140	138 Å²	138	72%	0.718	77%	0.772	S	S	*	*			trans	-105.3	109.7	160.7	-60.6	-179.6	0	0	0	106.4	I1002	I1002-I1005 HydrophobicContact CG2-CD1 4.34Å
1006	P	28.9	Very low	32	Very low	106 Å²	106	135.7 Å²	135.7	69%	0.688	76%	0.756	S	S	*	*			trans	-61.6	151	179.5	-23.8	34.6	0	0	0	112.3	K1008	P1006-K1008 PolarHBondContact O-N 2.8Å
1007	S	28.9	Very low	32.5	Very low	127 Å²	127	136.4 Å²	136.4	89%	0.888	75%	0.748	S	S	*	*	S	Bend	trans	-74.5	65.4	177.7	44.2	0	0	0	0	113
1008	K	31.7	Very low	33	Very low	183 Å²	183	133.7 Å²	133.7	80%	0.796	73%	0.73	S	S	*	*			trans	-162.5	144.6	171.9	-103.2	151.6	-174.4	176.8	0	109.6	P1006	P1006-K1008 PolarHBondContact O-N 2.8Å
1009	V	32.1	Very low	33.7	Very low	153 Å²	153	129 Å²	129	93%	0.927	71%	0.707	S	S	*	*			trans	66.8	138.6	-163.1	-167.4	0	0	0	0	110.4
1010	G	30.4	Very low	34.5	Very low	57 Å²	57	131.3 Å²	131.3	59%	0.588	70%	0.7	S	S	*	*			cis	162.7	141.3	-2.2	0	0	0	0	0	107.9	T1012	G1010-T1012 PolarHBondContact O-N 3.37Å
1011	T	29.9	Very low	35.1	Very low	149 Å²	149	123.8 Å²	123.8	91%	0.914	67%	0.67	S	S	*	*			trans	-76.1	90.5	-163.7	47.7	0	0	0	0	114.5
1012	T	34.2	Very low	36.1	Very low	120 Å²	120	121.3 Å²	121.3	74%	0.736	65%	0.654	S	S	*	*	S	Bend	trans	-153.4	128.8	161.7	38.5	0	0	0	0	113.1	G1010 I1014	G1010-T1012 PolarHBondContact O-N 3.37Å; T1012-I1014 PolarHBondContact O-N 3.16Å
1013	N	37.2	Very low	36.8	Very low	95 Å²	95	126.4 Å²	126.4	51%	0.508	67%	0.666	S	S	.	*			trans	42.4	65.7	154	-60.1	8.8	0	0	0	119.9	L1015 E1016 N1017	N1013-L1015 VanDerWaalsContact C-N 3.35Å; N1013-E1016 HydrophobicContact CB-CB 4.45Å; N1013-E1016 HydrophobicContact CB-CG 4.34Å; N1013-E1016 WeakPolarHBondContact CB-OE2 3.29Å; N1013-E1016 PolarHBondContact ND2-OE2 3.11Å; N1013-N1017 PolarHBondContact O-ND2 3Å
1014	I	36.6	Very low	37.7	Very low	148 Å²	148	120.9 Å²	120.9	76%	0.759	65%	0.652	S	S	*	*	H	α-helix	trans	-65.1	-37.7	164.6	-63.6	173	0	0	0	111.7	T1012 E1016 N1017 F1018	T1012-I1014 PolarHBondContact O-N 3.16Å; I1014-E1016 PolarHBondContact O-N 2.95Å; I1014-N1017 PolarHBondContact O-N 3.47Å; I1014-F1018 PolarHBondContact O-N 3.48Å; I1014-F1018 VanDerWaalsContact O-N 3.08Å
1015	L	37.1	Very low	37.8	Very low	129 Å²	129	116.6 Å²	116.6	68%	0.675	65%	0.645	S	S	*	*	H	α-helix	trans	-70	-30.6	-171.2	-166.3	66.8	0	0	0	113.6	N1013 N1019	N1013-L1015 VanDerWaalsContact C-N 3.35Å; L1015-N1019 PolarHBondContact O-N 3.25Å; L1015-N1019 PolarHBondContact O-ND2 3.47Å
1016	E	43.9	Very low	38.2	Very low	122 Å²	122	114.6 Å²	114.6	57%	0.57	64%	0.64	S	S	*	*	H	α-helix	trans	-69.2	-49.8	175.2	-68.2	-178.1	141.3	0	0	110.7	N1013 I1014 F1018 N1019 Q1020	N1013-E1016 HydrophobicContact CB-CB 4.45Å; N1013-E1016 HydrophobicContact CB-CG 4.34Å; N1013-E1016 WeakPolarHBondContact CB-OE2 3.29Å; N1013-E1016 PolarHBondContact ND2-OE2 3.11Å; I1014-E1016 PolarHBondContact O-N 2.95Å; E1016-F1018 VanDerWaalsContact C-N 3.29Å; E1016-F1018 PolarHBondContact O-N 3.32Å; E1016-N1019 PolarHBondContact O-N 2.95Å; E1016-N1019 VanDerWaalsContact O-N 3.12Å; E1016-Q1020 WeakPolarHBondContact O-CB 3.16Å; E1016-Q1020 PolarHBondContact O-N 3.12Å
1017	N	41.3	Very low	38.5	Very low	98 Å²	98	114.3 Å²	114.3	52%	0.524	63%	0.632	S	S	.	*	H	α-helix	trans	-57.3	-39.6	176.6	-72.6	-69.4	0	0	0	112.5	N1013 I1014 Q1020 L1021	N1013-N1017 PolarHBondContact O-ND2 3Å; I1014-N1017 PolarHBondContact O-N 3.47Å; N1017-Q1020 PolarHBondContact O-N 3.13Å; N1017-L1021 WeakPolarHBondContact O-CG 3.3Å; N1017-L1021 PolarHBondContact O-N 2.99Å
1018	F	40.1	Very low	39.2	Very low	110 Å²	110	113.4 Å²	113.4	48%	0.482	61%	0.614	S	S	.	*	H	α-helix	trans	-63.9	-46.2	175.3	-172.3	-93.3	0	0	0	112.2	I1014 E1016 Q1020 L1021 V1022	I1014-F1018 PolarHBondContact O-N 3.48Å; I1014-F1018 VanDerWaalsContact O-N 3.08Å; E1016-F1018 VanDerWaalsContact C-N 3.29Å; E1016-F1018 PolarHBondContact O-N 3.32Å; F1018-Q1020 PolarHBondContact O-N 2.98Å; F1018-L1021 PolarHBondContact O-N 3.46Å; F1018-V1022 HydrophobicContact CD1-CG2 4.34Å; F1018-V1022 HydrophobicContact CE1-CG2 4.02Å; F1018-V1022 HydrophobicContact CZ-CG2 4.36Å; F1018-V1022 WeakPolarHBondContact O-CG2 3.48Å; F1018-V1022 PolarHBondContact O-N 3.12Å; F1018-V1022 VanDerWaalsContact O-N 3.13Å
1019	N	44.1	Very low	39.7	Very low	83 Å²	83	109.9 Å²	109.9	44%	0.444	60%	0.602	S	S	.	*	H	α-helix	trans	-65.8	-27.9	176.4	-79.7	-68.9	0	0	0	112.8	L1015 E1016 R1023	L1015-N1019 PolarHBondContact O-N 3.25Å; L1015-N1019 PolarHBondContact O-ND2 3.47Å; E1016-N1019 PolarHBondContact O-N 2.95Å; E1016-N1019 VanDerWaalsContact O-N 3.12Å; N1019-R1023 WeakPolarHBondContact O-CG 3.43Å; N1019-R1023 PolarHBondContact O-N 3.48Å
1020	Q	47.2	Very low	40.4	Very low	114 Å²	114	110 Å²	110	53%	0.533	59%	0.592	S	S	.	*	H	α-helix	trans	-73.7	-48.1	176.8	-159.5	156	-2.9	0	0	111.1	E1016 N1017 F1018 V1022 R1023 D1024	E1016-Q1020 WeakPolarHBondContact O-CB 3.16Å; E1016-Q1020 PolarHBondContact O-N 3.12Å; N1017-Q1020 PolarHBondContact O-N 3.13Å; F1018-Q1020 PolarHBondContact O-N 2.98Å; Q1020-V1022 VanDerWaalsContact C-N 3.25Å; Q1020-V1022 PolarHBondContact O-N 2.95Å; Q1020-R1023 WeakPolarHBondContact O-CA 3.25Å; Q1020-R1023 WeakPolarHBondContact O-CB 3.45Å; Q1020-R1023 PolarHBondContact O-N 3.41Å; Q1020-D1024 VanDerWaalsContact O-CG 3.24Å; Q1020-D1024 PolarHBondContact O-N 3.39Å
1021	L	42.4	Very low	41.6	Very low	58 Å²	58	114.3 Å²	114.3	30%	0.304	59%	0.591	S	S	.	*	H	α-helix	trans	-60	-31.9	174.7	-70.7	167.6	0	0	0	113.6	I1002 N1017 F1018 G1025 T1026 L1027	I1002-L1021 HydrophobicContact CD1-CD1 4.15Å; I1002-L1021 HydrophobicContact CD1-CD2 4.47Å; N1017-L1021 WeakPolarHBondContact O-CG 3.3Å; N1017-L1021 PolarHBondContact O-N 2.99Å; F1018-L1021 PolarHBondContact O-N 3.46Å; L1021-G1025 PolarHBondContact O-N 3.3Å; L1021-T1026 PolarHBondContact O-N 2.58Å; L1021-T1026 PolarHBondContact O-OG1 3.44Å; L1021-L1027 HydrophobicContact CB-CD1 4.48Å
1022	V	50.5	Low	43.1	Very low	69 Å²	69	115.2 Å²	115.2	42%	0.418	59%	0.587	S	S	.	*	H	α-helix	trans	-72.7	-34.6	173	172.1	0	0	0	0	112.2	F1018 Q1020 G1025	F1018-V1022 HydrophobicContact CD1-CG2 4.34Å; F1018-V1022 HydrophobicContact CE1-CG2 4.02Å; F1018-V1022 HydrophobicContact CZ-CG2 4.36Å; F1018-V1022 WeakPolarHBondContact O-CG2 3.48Å; F1018-V1022 PolarHBondContact O-N 3.12Å; F1018-V1022 VanDerWaalsContact O-N 3.13Å; Q1020-V1022 VanDerWaalsContact C-N 3.25Å; Q1020-V1022 PolarHBondContact O-N 2.95Å; V1022-G1025 PolarHBondContact O-N 3.45Å
1023	R	44.6	Very low	45.2	Very low	213 Å²	213	115 Å²	115	80%	0.804	59%	0.588	S	S	*	*	H	α-helix	trans	-68.6	-36	171.9	-74.4	174.8	-172.5	-155.9	4.1	112.3	N1019 Q1020 G1025	N1019-R1023 WeakPolarHBondContact O-CG 3.43Å; N1019-R1023 PolarHBondContact O-N 3.48Å; Q1020-R1023 WeakPolarHBondContact O-CA 3.25Å; Q1020-R1023 WeakPolarHBondContact O-CB 3.45Å; Q1020-R1023 PolarHBondContact O-N 3.41Å; R1023-G1025 PolarHBondContact O-N 2.65Å
1024	D	48.6	Very low	47.4	Very low	107 Å²	107	113.6 Å²	113.6	57%	0.572	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	-0.4	-179.5	-59.9	-21	0	0	0	112.7	Q1020 T1026	Q1020-D1024 VanDerWaalsContact O-CG 3.24Å; Q1020-D1024 PolarHBondContact O-N 3.39Å; D1024-T1026 PolarHBondContact O-N 3.06Å
1025	G	34.5	Very low	49.7	Very low	68 Å²	68	109.1 Å²	109.1	70%	0.701	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	76.1	20.4	167.1	0	0	0	0	0	116.1	L1021 V1022 R1023	L1021-G1025 PolarHBondContact O-N 3.3Å; V1022-G1025 PolarHBondContact O-N 3.45Å; R1023-G1025 PolarHBondContact O-N 2.65Å
1026	T	39.1	Very low	51.9	Low	98 Å²	98	107 Å²	107	60%	0.601	55%	0.552	S	S	*	*			trans	-104.6	3.3	-166	51.1	0	0	0	0	116.7	L1021 D1024	L1021-T1026 PolarHBondContact O-N 2.58Å; L1021-T1026 PolarHBondContact O-OG1 3.44Å; D1024-T1026 PolarHBondContact O-N 3.06Å
1027	L	33.8	Very low	53.7	Low	100 Å²	100	108.6 Å²	108.6	52%	0.524	56%	0.56	S	S	.	*			trans	-126.4	123.4	178.7	-99.7	88.9	0	0	0	113.8	L1021	L1021-L1027 HydrophobicContact CB-CD1 4.48Å
1028	E	44.3	Very low	55.6	Low	108 Å²	108	108.7 Å²	108.7	51%	0.505	56%	0.557	S	S	.	*			trans	-76.7	129.7	159.7	-74.9	-165.6	117.7	0	0	110.2	H1030 R1068	E1028-H1030 PolarHBondContact O-N 2.86Å; E1028-H1030 VanDerWaalsContact O-N 3.07Å; E1028-R1068 IonicContact OE1-CZ 2.81Å; E1028-R1068 IonicContact OE1-NH2 3.4Å; E1028-R1068 PolarHBondContact OE1-NH2 2.61Å
1029	I	42.4	Very low	57.8	Low	109 Å²	109	104.4 Å²	104.4	56%	0.559	54%	0.538	S	S	*	.			trans	-83.2	86.4	-175.7	-52.9	177.5	0	0	0	111
1030	H	47.1	Very low	59.6	Low	154 Å²	154	104.9 Å²	104.9	71%	0.713	54%	0.537	S	S	*	.			trans	-86.1	110	163	-88	-74.3	0	0	0	110.8	E1028	E1028-H1030 PolarHBondContact O-N 2.86Å; E1028-H1030 VanDerWaalsContact O-N 3.07Å
1031	R	55.5	Low	61.2	Low	148 Å²	148	104.6 Å²	104.6	56%	0.558	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-72.2	146.2	166	-80.3	-171.2	173.2	-160.9	1.8	110.9	E1057	R1031-E1057 WeakPolarHBondContact CD-OE1 3.31Å; R1031-E1057 IonicContact CZ-OE1 2.82Å; R1031-E1057 IonicContact CZ-OE2 2.69Å; R1031-E1057 IonicContact NE-OE1 3.21Å; R1031-E1057 IonicContact NH1-OE1 3.17Å; R1031-E1057 PolarHBondContact NH1-OE1 2.99Å; R1031-E1057 IonicContact NH1-OE2 2.7Å; R1031-E1057 PolarHBondContact NH1-OE2 2.93Å
1032	M	61.5	Low	63	Low	169 Å²	169	103.6 Å²	103.6	83%	0.833	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-73.4	155.2	169.6	-100.2	174.4	58.7	0	0	111.8
1033	P	78.5	Confident	64.4	Low	116 Å²	116	100.5 Å²	100.5	75%	0.753	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-61.8	147	169.8	-20.4	33.1	0	0	0	112.5
1034	I	82.8	Confident	66	Low	64 Å²	64	94.5 Å²	94.5	33%	0.328	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-88.8	124.3	174.8	-58.1	165.5	0	0	0	109	F1039 V1042 Y1290	I1034-F1039 HydrophobicContact CG2-CD2 4.01Å; I1034-V1042 HydrophobicContact CD1-CG1 4.2Å; I1034-V1042 HydrophobicContact CG2-CG2 3.99Å; I1034-Y1290 HydrophobicContact CD1-CE1 4.22Å
1035	P	83.7	Confident	67.3	Low	55 Å²	55	94.6 Å²	94.6	36%	0.357	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-63.4	147.1	171.2	-21.1	33.5	0	0	0	112.2	E1037 Q1038 F1039	P1035-E1037 VanDerWaalsContact CB-OE2 3.22Å; P1035-E1037 WeakPolarHBondContact CB-OE2 3.1Å; P1035-E1037 PolarHBondContact O-N 3.42Å; P1035-Q1038 HydrophobicContact CB-CB 4.5Å; P1035-Q1038 HydrophobicContact CB-CG 4.47Å; P1035-Q1038 PolarHBondContact O-N 2.83Å; P1035-Q1038 VanDerWaalsContact O-N 3.09Å; P1035-F1039 PolarHBondContact O-N 2.99Å; P1035-F1039 VanDerWaalsContact O-N 3.15Å
1036	V	83.2	Confident	69.4	Low	84 Å²	84	91.6 Å²	91.6	51%	0.509	46%	0.456	S	S	.	.	H	α-helix	trans	-61.8	-35.4	-177.5	176.1	0	0	0	0	111.1	Q1038 F1039 I1297	V1036-Q1038 VanDerWaalsContact C-N 3.27Å; V1036-Q1038 PolarHBondContact O-N 3.12Å; V1036-F1039 VanDerWaalsContact O-CB 3.29Å; V1036-F1039 WeakPolarHBondContact O-CB 3.35Å; V1036-F1039 PolarHBondContact O-N 3.07Å; V1036-I1297 HydrophobicContact CG1-CD1 4.14Å; V1036-I1297 HydrophobicContact CG1-CG1 4.2Å; V1036-I1297 HydrophobicContact CG1-CG2 3.69Å
1037	E	81.9	Confident	71	Confident	156 Å²	156	89.4 Å²	89.4	73%	0.729	44%	0.437	S	S	*	.	H	α-helix	trans	-63	-33.2	178.8	-55.5	72.8	-160	0	0	111.9	P1035	P1035-E1037 VanDerWaalsContact CB-OE2 3.22Å; P1035-E1037 WeakPolarHBondContact CB-OE2 3.1Å; P1035-E1037 PolarHBondContact O-N 3.42Å
1038	Q	82.5	Confident	72.9	Confident	100 Å²	100	88.3 Å²	88.3	47%	0.467	43%	0.432	S	S	.	.	H	α-helix	trans	-94.1	-7.1	180	-66.3	177.2	-11.3	0	0	112.6	P1035 V1036 Q1040 E1041 V1042	P1035-Q1038 HydrophobicContact CB-CB 4.5Å; P1035-Q1038 HydrophobicContact CB-CG 4.47Å; P1035-Q1038 PolarHBondContact O-N 2.83Å; P1035-Q1038 VanDerWaalsContact O-N 3.09Å; V1036-Q1038 VanDerWaalsContact C-N 3.27Å; V1036-Q1038 PolarHBondContact O-N 3.12Å; Q1038-Q1040 PolarHBondContact O-N 2.72Å; Q1038-E1041 WeakPolarHBondContact O-CB 3.43Å; Q1038-E1041 PolarHBondContact O-N 3.09Å; Q1038-V1042 WeakPolarHBondContact O-CG2 2.85Å; Q1038-V1042 PolarHBondContact O-N 3.41Å
1039	F	85.9	Confident	74.5	Confident	20 Å²	20	87.7 Å²	87.7	9%	0.088	43%	0.432	C	S	.	.	H	α-helix	trans	-64.2	-39.7	-171	-164.5	-101.8	0	0	0	112.9	I1034 P1035 V1036 E1041 I1043 Y1290 L1293 L1294 I1297	I1034-F1039 HydrophobicContact CG2-CD2 4.01Å; P1035-F1039 PolarHBondContact O-N 2.99Å; P1035-F1039 VanDerWaalsContact O-N 3.15Å; V1036-F1039 VanDerWaalsContact O-CB 3.29Å; V1036-F1039 WeakPolarHBondContact O-CB 3.35Å; V1036-F1039 PolarHBondContact O-N 3.07Å; F1039-E1041 VanDerWaalsContact C-N 3.35Å; F1039-I1043 HydrophobicContact CD1-CD1 3.76Å; F1039-I1043 HydrophobicContact CE1-CD1 3.51Å; F1039-I1043 HydrophobicContact CZ-CD1 4.2Å; F1039-I1043 WeakPolarHBondContact O-CG1 3.34Å; F1039-I1043 PolarHBondContact O-N 2.94Å; F1039-Y1290 HydrophobicContact CE1-CD1 4.16Å; F1039-Y1290 WeakPolarHBondContact CE1-O 2.94Å; F1039-Y1290 AromaticContact CE2-CD1 3.69Å; F1039-Y1290 HydrophobicContact CE2-CD1 3.69Å; F1039-Y1290 AromaticContact CE2-CE1 3.71Å; F1039-Y1290 HydrophobicContact CE2-CE1 3.71Å; F1039-Y1290 AromaticContact CZ-CD1 3.38Å; F1039-Y1290 HydrophobicContact CZ-CD1 3.38Å; F1039-Y1290 AromaticContact CZ-CE1 3.91Å; F1039-Y1290 HydrophobicContact CZ-CE1 3.91Å; F1039-Y1290 HydrophobicContact CZ-CG 4.27Å; F1039-L1293 HydrophobicContact CE1-CB 3.6Å; F1039-L1293 HydrophobicContact CZ-CB 3.63Å; F1039-L1293 HydrophobicContact CZ-CD1 3.87Å; F1039-L1293 HydrophobicContact CZ-CG 4.42Å; F1039-L1294 HydrophobicContact CD1-CB 4.09Å; F1039-L1294 HydrophobicContact CE1-CB 3.98Å; F1039-I1297 HydrophobicContact CB-CD1 4.49Å; F1039-I1297 HydrophobicContact CD1-CD1 3.72Å; F1039-I1297 HydrophobicContact CE1-CD1 4.15Å; F1039-I1297 HydrophobicContact CG-CD1 4.15Å
1040	Q	81.2	Confident	76.1	Confident	92 Å²	92	85.3 Å²	85.3	43%	0.43	42%	0.42	S	S	.	.	H	α-helix	trans	-66.4	-36.6	173.2	-173.7	172.7	-8.2	0	0	111.9	Q1038 Y1044 L1294 H1410	Q1038-Q1040 PolarHBondContact O-N 2.72Å; Q1040-Y1044 VanDerWaalsContact O-CB 3.29Å; Q1040-Y1044 WeakPolarHBondContact O-CB 3.44Å; Q1040-Y1044 PolarHBondContact O-N 3.35Å; Q1040-L1294 HydrophobicContact CB-CD1 3.73Å; Q1040-L1294 HydrophobicContact CG-CD1 4.02Å; Q1040-L1294 HydrophobicContact CG-CD2 4.37Å; Q1040-H1410 PolarHBondContact NE2-O 3.18Å; Q1040-H1410 VanDerWaalsContact NE2-O 3.15Å
1041	E	80.4	Confident	77.6	Confident	109 Å²	109	79 Å²	79	51%	0.509	39%	0.391	S	S	.	.	H	α-helix	trans	-68.3	-40.6	177.8	-59.1	-171.1	157.3	0	0	111.9	Q1038 F1039 Y1044 Q1045	Q1038-E1041 WeakPolarHBondContact O-CB 3.43Å; Q1038-E1041 PolarHBondContact O-N 3.09Å; F1039-E1041 VanDerWaalsContact C-N 3.35Å; E1041-Y1044 PolarHBondContact O-N 2.9Å; E1041-Q1045 WeakPolarHBondContact O-CB 3.01Å; E1041-Q1045 VanDerWaalsContact O-CG 3.27Å; E1041-Q1045 WeakPolarHBondContact O-CG 3.42Å; E1041-Q1045 PolarHBondContact O-N 2.78Å
1042	V	80.5	Confident	78.7	Confident	37 Å²	37	75.3 Å²	75.3	22%	0.224	38%	0.381	C	S	.	.	H	α-helix	trans	-63.8	-43.3	176	172.7	0	0	0	0	111.3	I1034 Q1038 Y1044 S1046 F1054	I1034-V1042 HydrophobicContact CD1-CG1 4.2Å; I1034-V1042 HydrophobicContact CG2-CG2 3.99Å; Q1038-V1042 WeakPolarHBondContact O-CG2 2.85Å; Q1038-V1042 PolarHBondContact O-N 3.41Å; V1042-Y1044 VanDerWaalsContact C-N 3.32Å; V1042-Y1044 PolarHBondContact O-N 3.25Å; V1042-S1046 WeakPolarHBondContact O-CB 3.17Å; V1042-S1046 PolarHBondContact O-N 3.05Å; V1042-S1046 PolarHBondContact O-OG 2.94Å; V1042-F1054 HydrophobicContact CG1-CE1 4.33Å
1043	I	80.7	Confident	79.4	Confident	3 Å²	3	68.9 Å²	68.9	2%	0.015	35%	0.353	C	S	.	.	H	α-helix	trans	-63.8	-40.3	174.2	-70.1	164.7	0	0	0	110.5	F1039 S1046 R1047 F1054 Y1290 L1294	F1039-I1043 HydrophobicContact CD1-CD1 3.76Å; F1039-I1043 HydrophobicContact CE1-CD1 3.51Å; F1039-I1043 HydrophobicContact CZ-CD1 4.2Å; F1039-I1043 WeakPolarHBondContact O-CG1 3.34Å; F1039-I1043 PolarHBondContact O-N 2.94Å; I1043-S1046 PolarHBondContact O-N 2.97Å; I1043-R1047 WeakPolarHBondContact O-CB 3.04Å; I1043-R1047 WeakPolarHBondContact O-CG 3.42Å; I1043-R1047 PolarHBondContact O-N 3.26Å; I1043-F1054 HydrophobicContact CG1-CE2 4.47Å; I1043-F1054 HydrophobicContact CG1-CZ 3.97Å; I1043-Y1290 HydrophobicContact CD1-CD1 4.01Å; I1043-Y1290 HydrophobicContact CD1-CG 4.49Å; I1043-Y1290 WeakPolarHBondContact CD1-O 3.2Å; I1043-Y1290 HydrophobicContact CG1-CD1 3.82Å; I1043-Y1290 HydrophobicContact CG1-CG 4.34Å; I1043-L1294 HydrophobicContact CB-CD2 4.38Å; I1043-L1294 HydrophobicContact CD1-CB 3.59Å; I1043-L1294 HydrophobicContact CD1-CD2 3.68Å; I1043-L1294 HydrophobicContact CD1-CG 4.16Å; I1043-L1294 HydrophobicContact CG2-CD2 4.14Å
1044	Y	77.1	Confident	79.5	Confident	87 Å²	87	63.5 Å²	63.5	34%	0.341	32%	0.317	S	S	.	.	H	α-helix	trans	-66.6	-46.7	177.7	172.9	-136.1	0	0	0	113	Q1040 E1041 V1042 S1046 R1047 N1048 H1410	Q1040-Y1044 VanDerWaalsContact O-CB 3.29Å; Q1040-Y1044 WeakPolarHBondContact O-CB 3.44Å; Q1040-Y1044 PolarHBondContact O-N 3.35Å; E1041-Y1044 PolarHBondContact O-N 2.9Å; V1042-Y1044 VanDerWaalsContact C-N 3.32Å; V1042-Y1044 PolarHBondContact O-N 3.25Å; Y1044-S1046 PolarHBondContact O-N 3.43Å; Y1044-R1047 WeakPolarHBondContact O-CA 3.21Å; Y1044-R1047 WeakPolarHBondContact O-CB 3.15Å; Y1044-R1047 PolarHBondContact O-N 3.04Å; Y1044-N1048 VanDerWaalsContact CE2-CG 3.42Å; Y1044-N1048 WeakPolarHBondContact CE2-ND2 3.06Å; Y1044-N1048 WeakPolarHBondContact CE2-OD1 3.45Å; Y1044-N1048 PolarHBondContact O-N 3.44Å; Y1044-N1048 PolarHBondContact OH-ND2 3.04Å; Y1044-H1410 AromaticContact CD2-CD2 3.47Å; Y1044-H1410 VanDerWaalsContact CD2-CD2 3.47Å; Y1044-H1410 WeakPolarHBondContact CD2-CD2 3.46Å; Y1044-H1410 AromaticContact CD2-CE1 3.53Å; Y1044-H1410 AromaticContact CD2-CG 3.81Å; Y1044-H1410 AromaticContact CD2-ND1 3.81Å; Y1044-H1410 AromaticContact CD2-NE2 3.3Å; Y1044-H1410 VanDerWaalsContact CD2-NE2 3.3Å; Y1044-H1410 WeakPolarHBondContact CD2-NE2 3.42Å; Y1044-H1410 AromaticContact CE2-CD2 3.77Å; Y1044-H1410 AromaticContact CE2-CE1 2.96Å; Y1044-H1410 WeakPolarHBondContact CE2-CE1 3.06Å; Y1044-H1410 AromaticContact CE2-CG 3.99Å; Y1044-H1410 AromaticContact CE2-ND1 3.49Å; Y1044-H1410 WeakPolarHBondContact CE2-ND1 3.29Å; Y1044-H1410 AromaticContact CE2-NE2 3.14Å; Y1044-H1410 WeakPolarHBondContact CE2-NE2 3.43Å; Y1044-H1410 AromaticContact CZ-CE1 3.47Å; Y1044-H1410 VanDerWaalsContact CZ-CE1 3.47Å; Y1044-H1410 AromaticContact CZ-ND1 3.7Å
1045	Q	77.5	Confident	79.4	Confident	110 Å²	110	62.2 Å²	62.2	51%	0.514	31%	0.31	S	S	.	.	H	α-helix	trans	-60.2	-35.1	175.1	-71.4	172	25.7	0	0	111.4	E1041 N1049	E1041-Q1045 WeakPolarHBondContact O-CB 3.01Å; E1041-Q1045 VanDerWaalsContact O-CG 3.27Å; E1041-Q1045 WeakPolarHBondContact O-CG 3.42Å; E1041-Q1045 PolarHBondContact O-N 2.78Å; Q1045-N1049 WeakPolarHBondContact O-CB 3.37Å; Q1045-N1049 VanDerWaalsContact O-CG 3.31Å; Q1045-N1049 PolarHBondContact O-ND2 3.46Å
1046	S	76.8	Confident	79.2	Confident	4 Å²	4	65 Å²	65	3%	0.028	32%	0.318	C	S	.	.	H	α-helix	trans	-68.9	-40.5	172.4	-54.5	0	0	0	0	112	V1042 I1043 Y1044 N1048 N1049 Y1051 S1053 F1054	V1042-S1046 WeakPolarHBondContact O-CB 3.17Å; V1042-S1046 PolarHBondContact O-N 3.05Å; V1042-S1046 PolarHBondContact O-OG 2.94Å; I1043-S1046 PolarHBondContact O-N 2.97Å; Y1044-S1046 PolarHBondContact O-N 3.43Å; S1046-N1048 VanDerWaalsContact C-N 3.32Å; S1046-N1048 PolarHBondContact O-N 3.28Å; S1046-N1049 CarbonylContact O-C 2.86Å; S1046-N1049 PolarHBondContact O-N 2.93Å; S1046-Y1051 VanDerWaalsContact O-CA 3.27Å; S1046-Y1051 WeakPolarHBondContact O-CA 3.16Å; S1046-Y1051 WeakPolarHBondContact O-CD1 3.01Å; S1046-Y1051 PolarHBondContact O-N 3.31Å; S1046-S1053 VanDerWaalsContact CA-OG 3.26Å; S1046-S1053 WeakPolarHBondContact CA-OG 3.41Å; S1046-S1053 WeakPolarHBondContact CB-OG 3.31Å; S1046-S1053 PolarHBondContact OG-OG 2.67Å; S1046-F1054 VanDerWaalsContact CB-CE2 3.45Å; S1046-F1054 WeakPolarHBondContact OG-CZ 3.22Å
1047	R	72.6	Confident	79.1	Confident	53 Å²	53	62 Å²	62	20%	0.2	30%	0.299	C	S	.	.	H	α-helix	trans	-65.7	-25.6	176.9	-81.4	-178	176.5	162.3	5.4	115.3	N474 N475 I1043 Y1044 Y1051 Y1412	N474-R1047 PolarHBondContact OD1-O 2.89Å; N474-R1047 VanDerWaalsContact OD1-O 3.12Å; N475-R1047 PolarHBondContact ND2-O 2.9Å; N475-R1047 PolarHBondContact OD1-O 3.01Å; I1043-R1047 WeakPolarHBondContact O-CB 3.04Å; I1043-R1047 WeakPolarHBondContact O-CG 3.42Å; I1043-R1047 PolarHBondContact O-N 3.26Å; Y1044-R1047 WeakPolarHBondContact O-CA 3.21Å; Y1044-R1047 WeakPolarHBondContact O-CB 3.15Å; Y1044-R1047 PolarHBondContact O-N 3.04Å; R1047-Y1051 HydrophobicContact CB-CE1 4.17Å; R1047-Y1051 HydrophobicContact CG-CD1 4.22Å; R1047-Y1051 HydrophobicContact CG-CE1 3.25Å; R1047-Y1051 WeakPolarHBondContact CG-OH 3.08Å; R1047-Y1051 PolarHBondContact NE-OH 2.63Å; R1047-Y1051 PolarHBondContact NH2-OH 3.31Å; R1047-Y1412 VanDerWaalsContact NH2-CE1 3.28Å
1048	N	74.8	Confident	79.1	Confident	77 Å²	77	54.8 Å²	54.8	41%	0.412	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-18.2	175.6	-79.7	-6.6	0	0	0	113.4	N474 Y1044 S1046	N474-N1048 PolarHBondContact OD1-O 3.2Å; Y1044-N1048 VanDerWaalsContact CE2-CG 3.42Å; Y1044-N1048 WeakPolarHBondContact CE2-ND2 3.06Å; Y1044-N1048 WeakPolarHBondContact CE2-OD1 3.45Å; Y1044-N1048 PolarHBondContact O-N 3.44Å; Y1044-N1048 PolarHBondContact OH-ND2 3.04Å; S1046-N1048 VanDerWaalsContact C-N 3.32Å; S1046-N1048 PolarHBondContact O-N 3.28Å
1049	N	78.3	Confident	79	Confident	94 Å²	94	51 Å²	51	50%	0.503	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-125	55.5	-164.9	-67.3	-15.9	0	0	0	110.5	Q1045 S1046 Y1051 I1052	Q1045-N1049 WeakPolarHBondContact O-CB 3.37Å; Q1045-N1049 VanDerWaalsContact O-CG 3.31Å; Q1045-N1049 PolarHBondContact O-ND2 3.46Å; S1046-N1049 CarbonylContact O-C 2.86Å; S1046-N1049 PolarHBondContact O-N 2.93Å; N1049-Y1051 PolarHBondContact O-N 2.98Å; N1049-I1052 VanDerWaalsContact O-CB 3.3Å; N1049-I1052 WeakPolarHBondContact O-CB 3.31Å; N1049-I1052 PolarHBondContact O-N 3.03Å
1050	N	75.8	Confident	78.6	Confident	59 Å²	59	52.2 Å²	52.2	32%	0.316	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.2	-12.7	168.5	14.6	2	0	0	0	114.9	D473 N474 N475 I1052	D473-N1050 PolarHBondContact O-ND2 2.7Å; N474-N1050 PolarHBondContact N-ND2 3.06Å; N474-N1050 PolarHBondContact ND2-OD1 3.43Å; N474-N1050 PolarHBondContact OD1-N 2.85Å; N474-N1050 PolarHBondContact OD1-OD1 3.1Å; N475-N1050 WeakPolarHBondContact CA-O 3.06Å; N475-N1050 PolarHBondContact N-O 3.14Å; N1050-I1052 HydrophobicContact CB-CD1 4Å; N1050-I1052 HydrophobicContact CB-CG1 4.29Å; N1050-I1052 PolarHBondContact O-N 2.87Å
1051	Y	79.3	Confident	78.3	Confident	22 Å²	22	48.3 Å²	48.3	9%	0.086	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.3	23.8	-143	-68.5	-56.7	0	0	0	113.8	N475 E476 S1046 R1047 N1049 S1053 F1054 Q1055 Q1287	N475-Y1051 HydrophobicContact CB-CD2 3.09Å; N475-Y1051 HydrophobicContact CB-CE2 3.37Å; N475-Y1051 HydrophobicContact CB-CG 3.91Å; N475-Y1051 WeakPolarHBondContact OD1-CD2 3.32Å; N475-Y1051 VanDerWaalsContact OD1-CG 3.3Å; N475-Y1051 PolarHBondContact OD1-N 3.18Å; E476-Y1051 HydrophobicContact CB-CD2 4.47Å; E476-Y1051 HydrophobicContact CG-CD2 3.76Å; E476-Y1051 HydrophobicContact CG-CE2 4.04Å; S1046-Y1051 VanDerWaalsContact O-CA 3.27Å; S1046-Y1051 WeakPolarHBondContact O-CA 3.16Å; S1046-Y1051 WeakPolarHBondContact O-CD1 3.01Å; S1046-Y1051 PolarHBondContact O-N 3.31Å; R1047-Y1051 HydrophobicContact CB-CE1 4.17Å; R1047-Y1051 HydrophobicContact CG-CD1 4.22Å; R1047-Y1051 HydrophobicContact CG-CE1 3.25Å; R1047-Y1051 WeakPolarHBondContact CG-OH 3.08Å; R1047-Y1051 PolarHBondContact NE-OH 2.63Å; R1047-Y1051 PolarHBondContact NH2-OH 3.31Å; N1049-Y1051 PolarHBondContact O-N 2.98Å; Y1051-S1053 PolarHBondContact O-N 3.1Å; Y1051-F1054 AromaticContact CD1-CD2 3.71Å; Y1051-F1054 HydrophobicContact CD1-CD2 3.71Å; Y1051-F1054 HydrophobicContact CD1-CE2 4.08Å; Y1051-F1054 HydrophobicContact CE1-CD2 4.13Å; Y1051-F1054 HydrophobicContact CE1-CE2 4.09Å; Y1051-F1054 HydrophobicContact CG-CD2 4.45Å; Y1051-F1054 PolarHBondContact O-N 3.5Å; Y1051-F1054 VanDerWaalsContact O-N 3.08Å; Y1051-Q1055 PolarHBondContact O-N 3.27Å; Y1051-Q1287 PolarHBondContact OH-OE1 2.84Å; Y1051-Q1287 VanDerWaalsContact OH-OE1 3.09Å
1052	I	77.6	Confident	78	Confident	71 Å²	71	45.8 Å²	45.8	36%	0.364	23%	0.227	S	C	.	.	H	α-helix	trans	-61.3	-31.7	-178.7	-71.4	154.2	0	0	0	111.1	N1049 N1050 Q1055 Q1056	N1049-I1052 VanDerWaalsContact O-CB 3.3Å; N1049-I1052 WeakPolarHBondContact O-CB 3.31Å; N1049-I1052 PolarHBondContact O-N 3.03Å; N1050-I1052 HydrophobicContact CB-CD1 4Å; N1050-I1052 HydrophobicContact CB-CG1 4.29Å; N1050-I1052 PolarHBondContact O-N 2.87Å; I1052-Q1055 PolarHBondContact O-N 3.22Å; I1052-Q1056 HydrophobicContact CG2-CG 4.22Å; I1052-Q1056 VanDerWaalsContact CG2-NE2 3.32Å; I1052-Q1056 WeakPolarHBondContact O-CB 3.36Å; I1052-Q1056 WeakPolarHBondContact O-CG 3.31Å; I1052-Q1056 PolarHBondContact O-N 3.15Å
1053	S	75.7	Confident	77.6	Confident	34 Å²	34	48.4 Å²	48.4	24%	0.238	24%	0.236	C	C	.	.	H	α-helix	trans	-62.1	-44.7	173.2	44.9	0	0	0	0	112.9	S1046 Y1051 E1057	S1046-S1053 VanDerWaalsContact CA-OG 3.26Å; S1046-S1053 WeakPolarHBondContact CA-OG 3.41Å; S1046-S1053 WeakPolarHBondContact CB-OG 3.31Å; S1046-S1053 PolarHBondContact OG-OG 2.67Å; Y1051-S1053 PolarHBondContact O-N 3.1Å; S1053-E1057 WeakPolarHBondContact O-CB 3.43Å; S1053-E1057 PolarHBondContact O-N 3.39Å
1054	F	81.8	Confident	77.1	Confident	2 Å²	2	51.2 Å²	51.2	1%	0.009	25%	0.251	C	S	.	.	H	α-helix	trans	-72.1	-32.8	174.8	-68.2	-32.9	0	0	0	111.5	V1042 I1043 S1046 Y1051 E1057 F1058 Y1286 Q1287 Y1290	V1042-F1054 HydrophobicContact CG1-CE1 4.33Å; I1043-F1054 HydrophobicContact CG1-CE2 4.47Å; I1043-F1054 HydrophobicContact CG1-CZ 3.97Å; S1046-F1054 VanDerWaalsContact CB-CE2 3.45Å; S1046-F1054 WeakPolarHBondContact OG-CZ 3.22Å; Y1051-F1054 AromaticContact CD1-CD2 3.71Å; Y1051-F1054 HydrophobicContact CD1-CD2 3.71Å; Y1051-F1054 HydrophobicContact CD1-CE2 4.08Å; Y1051-F1054 HydrophobicContact CE1-CD2 4.13Å; Y1051-F1054 HydrophobicContact CE1-CE2 4.09Å; Y1051-F1054 HydrophobicContact CG-CD2 4.45Å; Y1051-F1054 PolarHBondContact O-N 3.5Å; Y1051-F1054 VanDerWaalsContact O-N 3.08Å; F1054-E1057 PolarHBondContact O-N 3.38Å; F1054-F1058 VanDerWaalsContact O-CB 3.32Å; F1054-F1058 WeakPolarHBondContact O-CB 3.4Å; F1054-F1058 PolarHBondContact O-N 2.9Å; F1054-Y1286 HydrophobicContact CB-CD1 4.47Å; F1054-Y1286 HydrophobicContact CB-CE1 4.47Å; F1054-Y1286 HydrophobicContact CD1-CE1 4.38Å; F1054-Q1287 HydrophobicContact CD2-CG 4Å; F1054-Y1290 HydrophobicContact CD1-CD2 4.39Å; F1054-Y1290 AromaticContact CD1-CE2 3.95Å; F1054-Y1290 HydrophobicContact CD1-CE2 3.95Å; F1054-Y1290 HydrophobicContact CE1-CD1 4.03Å; F1054-Y1290 AromaticContact CE1-CD2 3.95Å; F1054-Y1290 HydrophobicContact CE1-CD2 3.95Å; F1054-Y1290 AromaticContact CE1-CE1 3.72Å; F1054-Y1290 HydrophobicContact CE1-CE1 3.72Å; F1054-Y1290 AromaticContact CE1-CE2 3.6Å; F1054-Y1290 HydrophobicContact CE1-CE2 3.6Å; F1054-Y1290 HydrophobicContact CE1-CG 4.14Å; F1054-Y1290 AromaticContact CE1-CZ 3.48Å; F1054-Y1290 VanDerWaalsContact CE1-CZ 3.48Å; F1054-Y1290 HydrophobicContact CE2-CD2 4.48Å; F1054-Y1290 HydrophobicContact CE2-CG 4.39Å; F1054-Y1290 AromaticContact CZ-CD1 3.78Å; F1054-Y1290 HydrophobicContact CZ-CD1 3.78Å; F1054-Y1290 AromaticContact CZ-CD2 3.99Å; F1054-Y1290 HydrophobicContact CZ-CD2 3.99Å; F1054-Y1290 AromaticContact CZ-CE1 3.95Å; F1054-Y1290 HydrophobicContact CZ-CE1 3.95Å; F1054-Y1290 HydrophobicContact CZ-CE2 4.12Å; F1054-Y1290 AromaticContact CZ-CG 3.81Å; F1054-Y1290 HydrophobicContact CZ-CG 3.81Å
1055	Q	81	Confident	76.6	Confident	37 Å²	37	48.1 Å²	48.1	17%	0.173	24%	0.242	C	C	.	.	H	α-helix	trans	-64.7	-46.7	172.5	-173.8	-178.5	31.7	0	0	112.7	P477 Y1051 I1052 E1057 F1058 Q1059	P477-Q1055 HydrophobicContact CG-CB 4.23Å; P477-Q1055 HydrophobicContact CG-CG 3.84Å; P477-Q1055 VanDerWaalsContact CG-NE2 3.34Å; Y1051-Q1055 PolarHBondContact O-N 3.27Å; I1052-Q1055 PolarHBondContact O-N 3.22Å; Q1055-E1057 VanDerWaalsContact C-N 3.3Å; Q1055-E1057 PolarHBondContact O-N 3.09Å; Q1055-F1058 PolarHBondContact O-N 2.82Å; Q1055-Q1059 HydrophobicContact CG-CG 4.38Å; Q1055-Q1059 VanDerWaalsContact O-CB 3.29Å; Q1055-Q1059 WeakPolarHBondContact O-CB 3.37Å; Q1055-Q1059 VanDerWaalsContact O-CG 3.3Å; Q1055-Q1059 WeakPolarHBondContact O-CG 3.41Å; Q1055-Q1059 PolarHBondContact O-N 3Å
1056	Q	78.4	Confident	76.2	Confident	114 Å²	114	47.3 Å²	47.3	53%	0.533	25%	0.249	S	C	.	.	H	α-helix	trans	-62.3	-39.2	175.9	-73.7	170.7	2.9	0	0	111.3	I1052 T1060	I1052-Q1056 HydrophobicContact CG2-CG 4.22Å; I1052-Q1056 VanDerWaalsContact CG2-NE2 3.32Å; I1052-Q1056 WeakPolarHBondContact O-CB 3.36Å; I1052-Q1056 WeakPolarHBondContact O-CG 3.31Å; I1052-Q1056 PolarHBondContact O-N 3.15Å; Q1056-T1060 VanDerWaalsContact O-CB 3.3Å; Q1056-T1060 WeakPolarHBondContact O-CB 3.18Å; Q1056-T1060 PolarHBondContact O-N 3.4Å; Q1056-T1060 PolarHBondContact O-OG1 2.84Å
1057	E	80.4	Confident	75.4	Confident	20 Å²	20	52.4 Å²	52.4	9%	0.093	28%	0.28	C	S	.	.	H	α-helix	trans	-65.1	-50.7	175.1	-178.7	158.7	-138.5	0	0	112.1	R1031 S1053 F1054 Q1055 Q1059 T1060 I1061 Y1286 Y1290	R1031-E1057 WeakPolarHBondContact CD-OE1 3.31Å; R1031-E1057 IonicContact CZ-OE1 2.82Å; R1031-E1057 IonicContact CZ-OE2 2.69Å; R1031-E1057 IonicContact NE-OE1 3.21Å; R1031-E1057 IonicContact NH1-OE1 3.17Å; R1031-E1057 PolarHBondContact NH1-OE1 2.99Å; R1031-E1057 IonicContact NH1-OE2 2.7Å; R1031-E1057 PolarHBondContact NH1-OE2 2.93Å; S1053-E1057 WeakPolarHBondContact O-CB 3.43Å; S1053-E1057 PolarHBondContact O-N 3.39Å; F1054-E1057 PolarHBondContact O-N 3.38Å; Q1055-E1057 VanDerWaalsContact C-N 3.3Å; Q1055-E1057 PolarHBondContact O-N 3.09Å; E1057-Q1059 PolarHBondContact O-N 3.32Å; E1057-T1060 WeakPolarHBondContact O-CB 3.39Å; E1057-T1060 PolarHBondContact O-N 3.43Å; E1057-T1060 VanDerWaalsContact O-N 3.12Å; E1057-I1061 HydrophobicContact CG-CD1 4.14Å; E1057-I1061 WeakPolarHBondContact O-CG1 3.35Å; E1057-I1061 PolarHBondContact O-N 3.28Å; E1057-Y1286 HydrophobicContact CG-CE1 4.21Å; E1057-Y1286 VanDerWaalsContact CG-OH 3.31Å; E1057-Y1286 WeakPolarHBondContact CG-OH 3.15Å; E1057-Y1286 PolarHBondContact OE2-OH 2.73Å; E1057-Y1290 PolarHBondContact OE2-OH 3.42Å
1058	F	81.7	Confident	75.1	Confident	5 Å²	5	55.5 Å²	55.5	2%	0.022	29%	0.291	C	S	.	.	H	α-helix	trans	-59.6	-47	178.3	-172.9	-114.7	0	0	0	111.7	F1054 Q1055 T1060 I1061 E1062 I1280 Q1283 Y1286	F1054-F1058 VanDerWaalsContact O-CB 3.32Å; F1054-F1058 WeakPolarHBondContact O-CB 3.4Å; F1054-F1058 PolarHBondContact O-N 2.9Å; Q1055-F1058 PolarHBondContact O-N 2.82Å; F1058-T1060 VanDerWaalsContact C-N 3.28Å; F1058-T1060 PolarHBondContact O-N 2.98Å; F1058-I1061 WeakPolarHBondContact O-CB 3.39Å; F1058-I1061 PolarHBondContact O-N 3.13Å; F1058-I1061 VanDerWaalsContact O-N 3.13Å; F1058-E1062 HydrophobicContact CE1-CG 4.4Å; F1058-E1062 WeakPolarHBondContact O-CG 3.37Å; F1058-E1062 PolarHBondContact O-N 2.79Å; F1058-I1280 HydrophobicContact CE2-CB 4.35Å; F1058-I1280 HydrophobicContact CE2-CG2 3.64Å; F1058-I1280 HydrophobicContact CZ-CG2 4.22Å; F1058-Q1283 HydrophobicContact CB-CG 4.27Å; F1058-Q1283 HydrophobicContact CD1-CB 4.22Å; F1058-Q1283 HydrophobicContact CD1-CG 4.26Å; F1058-Q1283 HydrophobicContact CG-CG 4.3Å; F1058-Y1286 HydrophobicContact CB-CD1 4.4Å; F1058-Y1286 HydrophobicContact CD2-CG 4.22Å
1059	Q	82	Confident	74.5	Confident	20 Å²	20	62.4 Å²	62.4	9%	0.093	31%	0.313	C	S	.	.	H	α-helix	trans	-66.4	-26	176.1	-69.7	179.1	-3.4	0	0	113.5	E478 Q1055 E1057 Q1063	E478-Q1059 PolarHBondContact OE2-NE2 2.74Å; E478-Q1059 VanDerWaalsContact OE2-NE2 3.12Å; Q1055-Q1059 HydrophobicContact CG-CG 4.38Å; Q1055-Q1059 VanDerWaalsContact O-CB 3.29Å; Q1055-Q1059 WeakPolarHBondContact O-CB 3.37Å; Q1055-Q1059 VanDerWaalsContact O-CG 3.3Å; Q1055-Q1059 WeakPolarHBondContact O-CG 3.41Å; Q1055-Q1059 PolarHBondContact O-N 3Å; E1057-Q1059 PolarHBondContact O-N 3.32Å; Q1059-Q1063 VanDerWaalsContact O-CG 3.27Å; Q1059-Q1063 WeakPolarHBondContact O-CG 3.42Å; Q1059-Q1063 PolarHBondContact O-N 3.39Å; Q1059-Q1063 VanDerWaalsContact O-N 3.11Å; Q1059-Q1063 PolarHBondContact O-NE2 3.19Å
1060	T	76.4	Confident	74.4	Confident	47 Å²	47	59.7 Å²	59.7	29%	0.288	30%	0.299	S	S	.	.	H	α-helix	trans	-71.6	-41	171.6	-60.3	0	0	0	0	110.9	Q1056 E1057 F1058 E1062 Q1063 I1064	Q1056-T1060 VanDerWaalsContact O-CB 3.3Å; Q1056-T1060 WeakPolarHBondContact O-CB 3.18Å; Q1056-T1060 PolarHBondContact O-N 3.4Å; Q1056-T1060 PolarHBondContact O-OG1 2.84Å; E1057-T1060 WeakPolarHBondContact O-CB 3.39Å; E1057-T1060 PolarHBondContact O-N 3.43Å; E1057-T1060 VanDerWaalsContact O-N 3.12Å; F1058-T1060 VanDerWaalsContact C-N 3.28Å; F1058-T1060 PolarHBondContact O-N 2.98Å; T1060-E1062 VanDerWaalsContact C-N 3.32Å; T1060-E1062 PolarHBondContact O-N 3.09Å; T1060-Q1063 PolarHBondContact O-N 3.4Å; T1060-I1064 HydrophobicContact CG2-CD1 3.86Å; T1060-I1064 HydrophobicContact CG2-CG1 4.46Å; T1060-I1064 WeakPolarHBondContact O-CG1 3.32Å; T1060-I1064 PolarHBondContact O-N 2.75Å
1061	I	75.8	Confident	74.7	Confident	10 Å²	10	59.1 Å²	59.1	5%	0.051	30%	0.299	C	S	.	.	H	α-helix	trans	-60.9	-42.7	174	-65.7	164	0	0	0	110.3	E1057 F1058 S1065 N1270 Y1286	E1057-I1061 HydrophobicContact CG-CD1 4.14Å; E1057-I1061 WeakPolarHBondContact O-CG1 3.35Å; E1057-I1061 PolarHBondContact O-N 3.28Å; F1058-I1061 WeakPolarHBondContact O-CB 3.39Å; F1058-I1061 PolarHBondContact O-N 3.13Å; F1058-I1061 VanDerWaalsContact O-N 3.13Å; I1061-S1065 WeakPolarHBondContact O-CB 3.36Å; I1061-S1065 PolarHBondContact O-N 2.82Å; I1061-S1065 PolarHBondContact O-OG 3.35Å; I1061-N1270 HydrophobicContact CD1-CB 3.89Å; I1061-N1270 HydrophobicContact CG1-CB 4.21Å; I1061-N1270 HydrophobicContact CG2-CB 4.22Å; I1061-Y1286 HydrophobicContact CD1-CE2 4.22Å
1062	E	74.4	Confident	74.9	Confident	55 Å²	55	58.8 Å²	58.8	26%	0.257	30%	0.301	S	S	.	.	H	α-helix	trans	-57.7	-51.8	174.2	-59.3	-124.5	105.3	0	0	111.6	F1058 T1060 I1064 S1065 S1066 R1273	F1058-E1062 HydrophobicContact CE1-CG 4.4Å; F1058-E1062 WeakPolarHBondContact O-CG 3.37Å; F1058-E1062 PolarHBondContact O-N 2.79Å; T1060-E1062 VanDerWaalsContact C-N 3.32Å; T1060-E1062 PolarHBondContact O-N 3.09Å; E1062-I1064 PolarHBondContact O-N 2.86Å; E1062-S1065 PolarHBondContact O-N 3.47Å; E1062-S1065 VanDerWaalsContact O-N 3.15Å; E1062-S1065 PolarHBondContact O-OG 2.81Å; E1062-S1066 PolarHBondContact O-N 3.23Å; E1062-S1066 PolarHBondContact O-OG 2.78Å; E1062-R1273 IonicContact OE1-CZ 2.95Å; E1062-R1273 VanDerWaalsContact OE1-CZ 3.23Å; E1062-R1273 IonicContact OE1-NH1 2.72Å; E1062-R1273 PolarHBondContact OE1-NH1 2.9Å; E1062-R1273 IonicContact OE1-NH2 3.19Å; E1062-R1273 PolarHBondContact OE1-NH2 3.46Å
1063	Q	72.1	Confident	75.3	Confident	92 Å²	92	59.2 Å²	59.2	43%	0.43	31%	0.306	S	S	.	.	H	α-helix	trans	-60.6	-44.5	-179.7	-74.6	165.9	64	0	0	112.6	Q1059 T1060 S1065 S1066 T1067	Q1059-Q1063 VanDerWaalsContact O-CG 3.27Å; Q1059-Q1063 WeakPolarHBondContact O-CG 3.42Å; Q1059-Q1063 PolarHBondContact O-N 3.39Å; Q1059-Q1063 VanDerWaalsContact O-N 3.11Å; Q1059-Q1063 PolarHBondContact O-NE2 3.19Å; T1060-Q1063 PolarHBondContact O-N 3.4Å; Q1063-S1065 VanDerWaalsContact C-N 3.33Å; Q1063-S1065 PolarHBondContact O-N 3.11Å; Q1063-S1066 PolarHBondContact O-N 3.27Å; Q1063-S1066 PolarHBondContact O-OG 2.74Å; Q1063-T1067 WeakPolarHBondContact O-CG2 3.36Å; Q1063-T1067 PolarHBondContact O-N 3.35Å; Q1063-T1067 VanDerWaalsContact O-N 3.11Å; Q1063-T1067 PolarHBondContact O-OG1 3.33Å
1064	I	68.7	Low	75.8	Confident	63 Å²	63	60.3 Å²	60.3	32%	0.323	31%	0.308	S	S	.	.	H	α-helix	trans	-63.8	-39.2	175.7	-66.7	169.2	0	0	0	110.9	T1060 E1062 T1067	T1060-I1064 HydrophobicContact CG2-CD1 3.86Å; T1060-I1064 HydrophobicContact CG2-CG1 4.46Å; T1060-I1064 WeakPolarHBondContact O-CG1 3.32Å; T1060-I1064 PolarHBondContact O-N 2.75Å; E1062-I1064 PolarHBondContact O-N 2.86Å; I1064-T1067 PolarHBondContact O-OG1 3.28Å; I1064-T1067 VanDerWaalsContact O-OG1 3.12Å
1065	S	68.6	Low	76.1	Confident	21 Å²	21	60.2 Å²	60.2	15%	0.147	31%	0.307	C	S	.	.	H	α-helix	trans	-68.4	-32.5	176.9	70	0	0	0	0	113.3	I1061 E1062 Q1063	I1061-S1065 WeakPolarHBondContact O-CB 3.36Å; I1061-S1065 PolarHBondContact O-N 2.82Å; I1061-S1065 PolarHBondContact O-OG 3.35Å; E1062-S1065 PolarHBondContact O-N 3.47Å; E1062-S1065 VanDerWaalsContact O-N 3.15Å; E1062-S1065 PolarHBondContact O-OG 2.81Å; Q1063-S1065 VanDerWaalsContact C-N 3.33Å; Q1063-S1065 PolarHBondContact O-N 3.11Å
1066	S	67.2	Low	76.3	Confident	94 Å²	94	62 Å²	62	66%	0.657	32%	0.318	S	S	*	.	H	α-helix	trans	-80.9	-23.9	-179.7	69.2	0	0	0	0	114.8	E1062 Q1063	E1062-S1066 PolarHBondContact O-N 3.23Å; E1062-S1066 PolarHBondContact O-OG 2.78Å; Q1063-S1066 PolarHBondContact O-N 3.27Å; Q1063-S1066 PolarHBondContact O-OG 2.74Å
1067	T	61.8	Low	76.7	Confident	111 Å²	111	59.3 Å²	59.3	68%	0.681	31%	0.307	S	S	*	.	H	α-helix	trans	-81.5	-19.7	-179	43.5	0	0	0	0	113.5	Q1063 I1064	Q1063-T1067 WeakPolarHBondContact O-CG2 3.36Å; Q1063-T1067 PolarHBondContact O-N 3.35Å; Q1063-T1067 VanDerWaalsContact O-N 3.11Å; Q1063-T1067 PolarHBondContact O-OG1 3.33Å; I1064-T1067 PolarHBondContact O-OG1 3.28Å; I1064-T1067 VanDerWaalsContact O-OG1 3.12Å
1068	R	65.4	Low	76.7	Confident	117 Å²	117	64.4 Å²	64.4	44%	0.442	34%	0.335	S	S	.	.	S	Bend	trans	-92.9	109.2	175.3	-69.1	-174.4	174.5	-170.3	-0.3	110.2	E1028 I1070	E1028-R1068 IonicContact OE1-CZ 2.81Å; E1028-R1068 IonicContact OE1-NH2 3.4Å; E1028-R1068 PolarHBondContact OE1-NH2 2.61Å; R1068-I1070 HydrophobicContact CB-CG1 4.45Å; R1068-I1070 PolarHBondContact O-N 2.82Å
1069	Y	62.1	Low	76.8	Confident	222 Å²	222	68 Å²	68	87%	0.871	35%	0.353	S	S	*	.			trans	-68.1	99.8	172	-172.8	-90.2	0	0	0	110.1
1070	I	75.4	Confident	77.1	Confident	38 Å²	38	67 Å²	67	20%	0.195	35%	0.349	C	S	.	.			trans	-100.4	124.4	175.6	-55.9	172.6	0	0	0	108.6	R1068 Y1092 C1094 L1274	R1068-I1070 HydrophobicContact CB-CG1 4.45Å; R1068-I1070 PolarHBondContact O-N 2.82Å; I1070-Y1092 HydrophobicContact CB-CD1 3.91Å; I1070-Y1092 HydrophobicContact CB-CD2 4.38Å; I1070-Y1092 HydrophobicContact CB-CE1 3.98Å; I1070-Y1092 HydrophobicContact CB-CE2 4.44Å; I1070-Y1092 HydrophobicContact CB-CG 4.13Å; I1070-Y1092 HydrophobicContact CD1-CD2 4.04Å; I1070-Y1092 HydrophobicContact CD1-CE2 3.7Å; I1070-Y1092 HydrophobicContact CG2-CD1 3.6Å; I1070-Y1092 HydrophobicContact CG2-CD2 3.82Å; I1070-Y1092 HydrophobicContact CG2-CE1 4.17Å; I1070-Y1092 HydrophobicContact CG2-CE2 4.36Å; I1070-Y1092 HydrophobicContact CG2-CG 3.41Å; I1070-Y1092 VanDerWaalsContact CG2-CG 3.41Å; I1070-C1094 VanDerWaalsContact CG2-SG 3.59Å; I1070-L1274 HydrophobicContact CD1-CD2 4.35Å
1071	S	83	Confident	77.7	Confident	47 Å²	47	69.4 Å²	69.4	33%	0.329	36%	0.355	S	S	.	.			trans	-64.4	137.4	-178.9	-170.1	0	0	0	0	111.6	V1073 Y1092 D1093	S1071-V1073 WeakPolarHBondContact OG-CG2 3.39Å; S1071-Y1092 CarbonylContact O-C 3.13Å; S1071-Y1092 WeakPolarHBondContact O-CA 3.29Å; S1071-D1093 WeakPolarHBondContact CB-OD2 3.32Å; S1071-D1093 PolarHBondContact O-N 3.05Å; S1071-D1093 PolarHBondContact OG-OD2 2.68Å
1072	A	83.7	Confident	78.3	Confident	14 Å²	14	72.3 Å²	72.3	12%	0.116	38%	0.376	C	S	.	.			trans	-136	40.4	173	0	0	0	0	0	110.3	H1074 S1075 N1076 L1090 Y1092 D1093	A1072-H1074 VanDerWaalsContact C-N 3.35Å; A1072-H1074 PolarHBondContact O-N 2.79Å; A1072-S1075 PolarHBondContact O-N 3.01Å; A1072-N1076 PolarHBondContact O-N 2.72Å; A1072-N1076 PolarHBondContact O-ND2 3.31Å; A1072-L1090 HydrophobicContact CB-CB 4.14Å; A1072-L1090 HydrophobicContact CB-CD1 4.3Å; A1072-Y1092 HydrophobicContact CB-CD1 4.49Å; A1072-D1093 WeakPolarHBondContact CA-OD2 3.27Å; A1072-D1093 PolarHBondContact N-OD2 3.06Å
1073	V	84.9	Confident	79.1	Confident	80 Å²	80	70.4 Å²	70.4	49%	0.485	37%	0.367	S	S	.	.	H	α-helix	trans	-60.7	-43.2	-177.2	169.3	0	0	0	0	110.5	S1071 S1075 N1076 L1077 D1093	S1071-V1073 WeakPolarHBondContact OG-CG2 3.39Å; V1073-S1075 VanDerWaalsContact C-N 3.31Å; V1073-S1075 PolarHBondContact O-N 2.77Å; V1073-N1076 CarbonylContact O-C 3.51Å; V1073-N1076 PolarHBondContact O-N 2.8Å; V1073-L1077 WeakPolarHBondContact O-CG 3.02Å; V1073-L1077 PolarHBondContact O-N 3.09Å; V1073-D1093 PolarHBondContact N-OD1 2.81Å; V1073-D1093 PolarHBondContact N-OD2 3.2Å
1074	H	87.3	Confident	80.1	Confident	58 Å²	58	66.5 Å²	66.5	27%	0.269	35%	0.349	S	S	.	.	H	α-helix	trans	-63.6	-37.2	-179.9	-63	84.3	0	0	0	112	A1072 N1076 N1080 D1093 R1096 Y1119	A1072-H1074 VanDerWaalsContact C-N 3.35Å; A1072-H1074 PolarHBondContact O-N 2.79Å; H1074-N1076 VanDerWaalsContact C-N 3.26Å; H1074-N1076 PolarHBondContact O-N 3.02Å; H1074-N1080 WeakPolarHBondContact O-CB 3.48Å; H1074-N1080 PolarHBondContact O-ND2 3.47Å; H1074-D1093 WeakPolarHBondContact CB-OD1 3.2Å; H1074-D1093 IonicContact CE1-OD1 3.61Å; H1074-D1093 IonicContact CG-OD1 3.41Å; H1074-D1093 PolarHBondContact N-OD1 2.78Å; H1074-D1093 IonicContact ND1-OD1 3.31Å; H1074-D1093 PolarHBondContact ND1-OD1 2.88Å; H1074-R1096 PolarHBondContact CD2-NH2 3.05Å; H1074-R1096 VanDerWaalsContact CG-NE 3.27Å; H1074-R1096 PolarHBondContact ND1-NE 2.96Å; H1074-R1096 PolarHBondContact NE2-NH2 2.73Å; H1074-Y1119 HydrophobicContact CB-CD2 3.87Å; H1074-Y1119 HydrophobicContact CB-CE2 4.36Å
1075	S	88.1	Confident	81.1	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-67.6	-25.6	173.7	-59.7	0	0	0	0	113.9	A1072 V1073 N1084 A1091 Y1119	A1072-S1075 PolarHBondContact O-N 3.01Å; V1073-S1075 VanDerWaalsContact C-N 3.31Å; V1073-S1075 PolarHBondContact O-N 2.77Å; S1075-N1084 PolarHBondContact O-ND2 2.76Å; S1075-A1091 PolarHBondContact OG-N 3.24Å; S1075-A1091 PolarHBondContact OG-O 2.86Å; S1075-Y1119 VanDerWaalsContact CB-OH 3.28Å; S1075-Y1119 WeakPolarHBondContact CB-OH 3.27Å; S1075-Y1119 VanDerWaalsContact OG-CE2 3.23Å; S1075-Y1119 WeakPolarHBondContact OG-CE2 2.93Å; S1075-Y1119 PolarHBondContact OG-OH 2.76Å
1076	N	86.1	Confident	82	Confident	75 Å²	75	63.2 Å²	63.2	40%	0.401	33%	0.33	S	S	.	.	H	α-helix	trans	-96.1	-7.9	-178.1	-76.9	-64.7	0	0	0	114.1	A1072 V1073 H1074 D1078 K1081	A1072-N1076 PolarHBondContact O-N 2.72Å; A1072-N1076 PolarHBondContact O-ND2 3.31Å; V1073-N1076 CarbonylContact O-C 3.51Å; V1073-N1076 PolarHBondContact O-N 2.8Å; H1074-N1076 VanDerWaalsContact C-N 3.26Å; H1074-N1076 PolarHBondContact O-N 3.02Å; N1076-D1078 PolarHBondContact O-N 2.81Å; N1076-K1081 WeakPolarHBondContact O-CE 3.37Å; N1076-K1081 PolarHBondContact O-NZ 3.28Å
1077	L	84.8	Confident	82.8	Confident	57 Å²	57	63.5 Å²	63.5	30%	0.298	33%	0.33	S	S	.	.	S	Bend	trans	-56.3	134.6	165.3	-62.8	177.3	0	0	0	109.2	V1073 I1079 N1080 K1081	V1073-L1077 WeakPolarHBondContact O-CG 3.02Å; V1073-L1077 PolarHBondContact O-N 3.09Å; L1077-I1079 VanDerWaalsContact C-N 3.27Å; L1077-I1079 HydrophobicContact CB-CG2 4.03Å; L1077-I1079 PolarHBondContact O-N 3.12Å; L1077-N1080 HydrophobicContact CB-CB 4.4Å; L1077-N1080 CarbonylContact O-C 3.58Å; L1077-N1080 WeakPolarHBondContact O-CA 3.24Å; L1077-N1080 WeakPolarHBondContact O-CB 3.34Å; L1077-N1080 PolarHBondContact O-N 3.36Å; L1077-K1081 PolarHBondContact O-N 3.46Å
1078	D	81.7	Confident	83.9	Confident	126 Å²	126	62.5 Å²	62.5	67%	0.674	32%	0.32	S	S	*	.	H	α-helix	trans	-60.7	-34.5	-172.5	-64	-72.7	0	0	0	113.6	N1076 N1080 K1081	N1076-D1078 PolarHBondContact O-N 2.81Å; D1078-N1080 PolarHBondContact O-N 2.77Å; D1078-K1081 PolarHBondContact O-N 3.11Å; D1078-K1081 IonicContact OD1-NZ 2.69Å; D1078-K1081 PolarHBondContact OD1-NZ 2.74Å; D1078-K1081 IonicContact OD2-NZ 2.82Å
1079	I	82.7	Confident	84.9	Confident	80 Å²	80	57.6 Å²	57.6	41%	0.41	30%	0.302	S	S	.	.	H	α-helix	trans	-59.9	-21.8	171.2	-169.7	169.1	0	0	0	113.9	L1077 V1114	L1077-I1079 VanDerWaalsContact C-N 3.27Å; L1077-I1079 HydrophobicContact CB-CG2 4.03Å; L1077-I1079 PolarHBondContact O-N 3.12Å; I1079-V1114 HydrophobicContact CD1-CG1 4.38Å
1080	N	89.4	Confident	86.2	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-108.9	-17.6	-177.3	-68.8	-26.8	0	0	0	113.6	H1074 L1077 D1078 S1082 K1083 N1084 G1116 Y1119	H1074-N1080 WeakPolarHBondContact O-CB 3.48Å; H1074-N1080 PolarHBondContact O-ND2 3.47Å; L1077-N1080 HydrophobicContact CB-CB 4.4Å; L1077-N1080 CarbonylContact O-C 3.58Å; L1077-N1080 WeakPolarHBondContact O-CA 3.24Å; L1077-N1080 WeakPolarHBondContact O-CB 3.34Å; L1077-N1080 PolarHBondContact O-N 3.36Å; D1078-N1080 PolarHBondContact O-N 2.77Å; N1080-S1082 PolarHBondContact O-N 3Å; N1080-K1083 WeakPolarHBondContact O-CA 3.3Å; N1080-K1083 WeakPolarHBondContact O-CB 3.46Å; N1080-K1083 PolarHBondContact O-N 2.93Å; N1080-K1083 WeakPolarHBondContact OD1-CD 3.32Å; N1080-K1083 WeakPolarHBondContact OD1-CE 3.33Å; N1080-K1083 PolarHBondContact OD1-NZ 3.15Å; N1080-N1084 PolarHBondContact O-ND2 2.82Å; N1080-N1084 PolarHBondContact O-OD1 2.98Å; N1080-G1116 PolarHBondContact OD1-O 2.95Å; N1080-Y1119 HydrophobicContact CB-CD1 3.59Å; N1080-Y1119 HydrophobicContact CB-CE1 3.88Å; N1080-Y1119 HydrophobicContact CB-CG 4.02Å; N1080-Y1119 VanDerWaalsContact CG-CD1 3.45Å; N1080-Y1119 VanDerWaalsContact ND2-CB 3.28Å; N1080-Y1119 WeakPolarHBondContact ND2-CB 3.41Å; N1080-Y1119 WeakPolarHBondContact OD1-CB 3.34Å
1081	K	88.7	Confident	86.9	Confident	98 Å²	98	46.3 Å²	46.3	43%	0.426	26%	0.257	S	S	.	.	H	α-helix	trans	-54.4	-40.3	173.3	-73.1	-173.9	173	97	0	111.8	N1076 L1077 D1078 K1083 N1084	N1076-K1081 WeakPolarHBondContact O-CE 3.37Å; N1076-K1081 PolarHBondContact O-NZ 3.28Å; L1077-K1081 PolarHBondContact O-N 3.46Å; D1078-K1081 PolarHBondContact O-N 3.11Å; D1078-K1081 IonicContact OD1-NZ 2.69Å; D1078-K1081 PolarHBondContact OD1-NZ 2.74Å; D1078-K1081 IonicContact OD2-NZ 2.82Å; K1081-K1083 VanDerWaalsContact C-N 3.26Å; K1081-K1083 PolarHBondContact O-N 2.82Å; K1081-N1084 PolarHBondContact O-N 2.77Å
1082	S	89.1	Confident	87.2	Confident	71 Å²	71	45.4 Å²	45.4	50%	0.497	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-18.2	176.6	61.4	0	0	0	0	114.3	N1080 N1084 L1141 N1143	N1080-S1082 PolarHBondContact O-N 3Å; S1082-N1084 VanDerWaalsContact C-N 3.32Å; S1082-L1141 WeakPolarHBondContact O-CD1 3.47Å; S1082-N1143 PolarHBondContact O-ND2 3.24Å
1083	K	91	Very high	87.4	Confident	14 Å²	14	46.4 Å²	46.4	6%	0.061	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-0.4	175.9	-59.2	174.5	-179.7	179	0	112.6	N1080 K1081 G1116 Y1119 Q1138 T1144	N1080-K1083 WeakPolarHBondContact O-CA 3.3Å; N1080-K1083 WeakPolarHBondContact O-CB 3.46Å; N1080-K1083 PolarHBondContact O-N 2.93Å; N1080-K1083 WeakPolarHBondContact OD1-CD 3.32Å; N1080-K1083 WeakPolarHBondContact OD1-CE 3.33Å; N1080-K1083 PolarHBondContact OD1-NZ 3.15Å; K1081-K1083 VanDerWaalsContact C-N 3.26Å; K1081-K1083 PolarHBondContact O-N 2.82Å; K1083-G1116 PolarHBondContact NZ-O 3.27Å; K1083-Y1119 HydrophobicContact CB-CD1 4.27Å; K1083-Y1119 HydrophobicContact CB-CE1 4.15Å; K1083-Y1119 HydrophobicContact CD-CD1 3.81Å; K1083-Y1119 HydrophobicContact CD-CE1 4.49Å; K1083-Y1119 WeakPolarHBondContact CD-O 3.41Å; K1083-Y1119 PolarHBondContact NZ-O 3.12Å; K1083-Q1138 PolarHBondContact O-NE2 2.92Å; K1083-Q1138 PolarHBondContact O-OE1 2.68Å; K1083-T1144 HydrophobicContact CB-CG2 3.72Å; K1083-T1144 HydrophobicContact CG-CG2 4.09Å
1084	N	92	Very high	87.4	Confident	11 Å²	11	47 Å²	47	6%	0.059	26%	0.257	C	S	.	.			trans	-100.2	116.7	178.3	-55.8	-31.9	0	0	0	109.5	S1075 N1080 K1081 S1082 Y1086 Y1119 N1121	S1075-N1084 PolarHBondContact O-ND2 2.76Å; N1080-N1084 PolarHBondContact O-ND2 2.82Å; N1080-N1084 PolarHBondContact O-OD1 2.98Å; K1081-N1084 PolarHBondContact O-N 2.77Å; S1082-N1084 VanDerWaalsContact C-N 3.32Å; N1084-Y1086 PolarHBondContact O-N 2.69Å; N1084-Y1119 WeakPolarHBondContact OD1-CE1 3.48Å; N1084-Y1119 PolarHBondContact OD1-OH 2.94Å; N1084-N1121 VanDerWaalsContact CG-ND2 3.35Å; N1084-N1121 PolarHBondContact OD1-ND2 3.29Å
1085	R	89.4	Confident	87.6	Confident	4 Å²	4	45.3 Å²	45.3	2%	0.015	25%	0.251	C	S	.	.	S	Bend	trans	-59.2	-35.9	179	-177	174.7	-63.1	-83.5	10.7	112.2	H415 Q1138 A1139 P1140 L1141 M1172 K1173 D1175	H415-R1085 PolarHBondContact CE1-O 3.22Å; H415-R1085 PolarHBondContact NE2-O 2.95Å; R1085-Q1138 HydrophobicContact CB-CB 4.33Å; R1085-A1139 VanDerWaalsContact CZ-O 3.29Å; R1085-A1139 PolarHBondContact NE-O 2.74Å; R1085-A1139 VanDerWaalsContact NH2-C 3.35Å; R1085-A1139 PolarHBondContact NH2-O 2.87Å; R1085-P1140 PolarHBondContact NH2-O 3.32Å; R1085-L1141 HydrophobicContact CB-CD1 4.3Å; R1085-L1141 HydrophobicContact CB-CD2 4.22Å; R1085-L1141 HydrophobicContact CB-CG 3.97Å; R1085-L1141 HydrophobicContact CG-CD2 4.17Å; R1085-L1141 HydrophobicContact CG-CG 4.44Å; R1085-M1172 PolarHBondContact NH1-SD 2.98Å; R1085-K1173 WeakPolarHBondContact CD-O 3.14Å; R1085-K1173 PolarHBondContact NE-O 3.07Å; R1085-D1175 IonicContact CZ-OD2 2.67Å; R1085-D1175 IonicContact NH1-OD2 2.63Å; R1085-D1175 PolarHBondContact NH1-OD2 2.9Å; R1085-D1175 IonicContact NH2-OD2 2.78Å; R1085-D1175 PolarHBondContact NH2-OD2 3.36Å
1086	Y	88	Confident	87.8	Confident	10 Å²	10	46.9 Å²	46.9	4%	0.039	26%	0.257	C	S	.	.	S	Bend	trans	-126.9	123.4	176.7	-64	-72.7	0	0	0	108.7	H415 N1084 N1088 I1089 M1172 S1262	H415-Y1086 AromaticContact CD2-CD1 3.92Å; H415-Y1086 AromaticContact CE1-CD1 3.72Å; H415-Y1086 AromaticContact CE1-CE1 3.75Å; H415-Y1086 AromaticContact ND1-CE1 3.84Å; H415-Y1086 AromaticContact NE2-CD1 3.56Å; N1084-Y1086 PolarHBondContact O-N 2.69Å; Y1086-N1088 PolarHBondContact O-N 3.2Å; Y1086-I1089 HydrophobicContact CD2-CD1 3.93Å; Y1086-I1089 HydrophobicContact CG-CD1 4.19Å; Y1086-I1089 PolarHBondContact O-N 2.73Å; Y1086-M1172 PolarHBondContact OH-O 3.15Å; Y1086-S1262 VanDerWaalsContact CE2-OG 3.27Å; Y1086-S1262 WeakPolarHBondContact CE2-OG 3.3Å; Y1086-S1262 PolarHBondContact OH-OG 2.86Å
1087	P	85.1	Confident	88.1	Confident	101 Å²	101	43.3 Å²	43.3	66%	0.656	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-18.9	-176.4	-28.2	36	0	0	0	115.5
1088	N	85.1	Confident	88.3	Confident	90 Å²	90	43.6 Å²	43.6	48%	0.481	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-11.1	175.3	61.5	-62.6	0	0	0	113.9	Y1086 N1277 Y1278	Y1086-N1088 PolarHBondContact O-N 3.2Å; N1088-N1277 PolarHBondContact O-ND2 2.82Å; N1088-Y1278 WeakPolarHBondContact O-CE2 3.42Å
1089	I	85.7	Confident	88.6	Confident	13 Å²	13	38 Å²	38	7%	0.067	22%	0.215	C	C	.	.			trans	-107.8	108.9	-175	-54.3	-170.6	0	0	0	108.2	Y1086 N1121 T1265 Y1278	Y1086-I1089 HydrophobicContact CD2-CD1 3.93Å; Y1086-I1089 HydrophobicContact CG-CD1 4.19Å; Y1086-I1089 PolarHBondContact O-N 2.73Å; I1089-N1121 PolarHBondContact O-ND2 2.82Å; I1089-T1265 HydrophobicContact CG2-CG2 3.74Å; I1089-Y1278 HydrophobicContact CG1-CD2 4.43Å
1090	L	88.9	Confident	88.2	Confident	24 Å²	24	41 Å²	41	13%	0.126	23%	0.227	C	C	.	.			trans	-130.2	143.5	-162.8	-56.5	178.6	0	0	0	109.8	A1072 Y1092 N1277	A1072-L1090 HydrophobicContact CB-CB 4.14Å; A1072-L1090 HydrophobicContact CB-CD1 4.3Å; L1090-Y1092 PolarHBondContact O-N 2.94Å; L1090-N1277 PolarHBondContact N-ND2 3.5Å; L1090-N1277 PolarHBondContact N-OD1 2.68Å; L1090-N1277 PolarHBondContact O-OD1 3.29Å
1091	A	90.5	Very high	86.6	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.244	C	C	.	.			trans	-83.6	114.5	174.6	0	0	0	0	0	110.5	S1075 D1093 R1096 Y1119 N1123	S1075-A1091 PolarHBondContact OG-N 3.24Å; S1075-A1091 PolarHBondContact OG-O 2.86Å; A1091-D1093 PolarHBondContact O-N 2.91Å; A1091-R1096 HydrophobicContact CB-CB 3.94Å; A1091-Y1119 HydrophobicContact CB-CE2 4.07Å; A1091-N1123 VanDerWaalsContact CA-OD1 3.29Å; A1091-N1123 WeakPolarHBondContact CA-OD1 3.33Å; A1091-N1123 WeakPolarHBondContact CB-OD1 3.46Å
1092	Y	89.3	Confident	84.8	Confident	28 Å²	28	43.7 Å²	43.7	11%	0.11	25%	0.25	C	S	.	.			trans	-57.4	133.6	173.8	-64.4	-35.2	0	0	0	112.2	I1070 S1071 A1072 L1090 C1094 T1095 R1096 N1123 R1273 R1276 N1277	I1070-Y1092 HydrophobicContact CB-CD1 3.91Å; I1070-Y1092 HydrophobicContact CB-CD2 4.38Å; I1070-Y1092 HydrophobicContact CB-CE1 3.98Å; I1070-Y1092 HydrophobicContact CB-CE2 4.44Å; I1070-Y1092 HydrophobicContact CB-CG 4.13Å; I1070-Y1092 HydrophobicContact CD1-CD2 4.04Å; I1070-Y1092 HydrophobicContact CD1-CE2 3.7Å; I1070-Y1092 HydrophobicContact CG2-CD1 3.6Å; I1070-Y1092 HydrophobicContact CG2-CD2 3.82Å; I1070-Y1092 HydrophobicContact CG2-CE1 4.17Å; I1070-Y1092 HydrophobicContact CG2-CE2 4.36Å; I1070-Y1092 HydrophobicContact CG2-CG 3.41Å; I1070-Y1092 VanDerWaalsContact CG2-CG 3.41Å; S1071-Y1092 CarbonylContact O-C 3.13Å; S1071-Y1092 WeakPolarHBondContact O-CA 3.29Å; A1072-Y1092 HydrophobicContact CB-CD1 4.49Å; L1090-Y1092 PolarHBondContact O-N 2.94Å; Y1092-C1094 PolarHBondContact O-N 3.31Å; Y1092-T1095 PolarHBondContact O-N 3.31Å; Y1092-T1095 VanDerWaalsContact O-N 3.14Å; Y1092-T1095 PolarHBondContact O-OG1 3.39Å; Y1092-R1096 WeakPolarHBondContact O-CB 3.41Å; Y1092-R1096 PolarHBondContact O-N 3.41Å; Y1092-N1123 PolarHBondContact N-ND2 2.84Å; Y1092-N1123 PolarHBondContact O-ND2 3.4Å; Y1092-R1273 WeakPolarHBondContact CE2-O 3Å; Y1092-R1276 VanDerWaalsContact CE2-C 3.41Å; Y1092-N1277 HydrophobicContact CE1-CB 4.01Å; Y1092-N1277 HydrophobicContact CE2-CB 4.44Å; Y1092-N1277 WeakPolarHBondContact OH-CB 3.32Å
1093	D	86.8	Confident	82.7	Confident	34 Å²	34	48.6 Å²	48.6	18%	0.182	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-31.7	-173.4	-63.5	-41.6	0	0	0	113.2	S1071 A1072 V1073 H1074 A1091 T1095	S1071-D1093 WeakPolarHBondContact CB-OD2 3.32Å; S1071-D1093 PolarHBondContact O-N 3.05Å; S1071-D1093 PolarHBondContact OG-OD2 2.68Å; A1072-D1093 WeakPolarHBondContact CA-OD2 3.27Å; A1072-D1093 PolarHBondContact N-OD2 3.06Å; V1073-D1093 PolarHBondContact N-OD1 2.81Å; V1073-D1093 PolarHBondContact N-OD2 3.2Å; H1074-D1093 WeakPolarHBondContact CB-OD1 3.2Å; H1074-D1093 IonicContact CE1-OD1 3.61Å; H1074-D1093 IonicContact CG-OD1 3.41Å; H1074-D1093 PolarHBondContact N-OD1 2.78Å; H1074-D1093 IonicContact ND1-OD1 3.31Å; H1074-D1093 PolarHBondContact ND1-OD1 2.88Å; A1091-D1093 PolarHBondContact O-N 2.91Å; D1093-T1095 VanDerWaalsContact C-N 3.27Å; D1093-T1095 PolarHBondContact O-N 2.86Å
1094	C	86.6	Confident	80.1	Confident	93 Å²	93	55.6 Å²	55.6	63%	0.628	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-15.3	-178.4	53.5	0	0	0	0	114.4	I1070 Y1092	I1070-C1094 VanDerWaalsContact CG2-SG 3.59Å; Y1092-C1094 PolarHBondContact O-N 3.31Å
1095	T	90	Very high	77.4	Confident	23 Å²	23	63.2 Å²	63.2	14%	0.141	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-139.2	-2.3	-171.6	47.8	0	0	0	0	113.4	Y1092 D1093 N1123 Y1124 Q1275	Y1092-T1095 PolarHBondContact O-N 3.31Å; Y1092-T1095 VanDerWaalsContact O-N 3.14Å; Y1092-T1095 PolarHBondContact O-OG1 3.39Å; D1093-T1095 VanDerWaalsContact C-N 3.27Å; D1093-T1095 PolarHBondContact O-N 2.86Å; T1095-N1123 CarbonylContact O-C 3.46Å; T1095-N1123 VanDerWaalsContact O-CA 3.32Å; T1095-N1123 WeakPolarHBondContact O-CA 3.37Å; T1095-N1123 PolarHBondContact OG1-ND2 3.07Å; T1095-Y1124 WeakPolarHBondContact O-CD2 3.14Å; T1095-Y1124 PolarHBondContact O-N 2.83Å; T1095-Q1275 WeakPolarHBondContact CB-O 3.2Å; T1095-Q1275 HydrophobicContact CG2-CB 4.1Å; T1095-Q1275 HydrophobicContact CG2-CG 4.12Å; T1095-Q1275 PolarHBondContact OG1-O 2.8Å
1096	R	92	Very high	75	Confident	32 Å²	32	70.8 Å²	70.8	12%	0.121	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	150	176.8	68.9	177.4	-177.2	87.5	-4.3	111.2	H1074 A1091 Y1092 D1118 A1122 N1123	H1074-R1096 PolarHBondContact CD2-NH2 3.05Å; H1074-R1096 VanDerWaalsContact CG-NE 3.27Å; H1074-R1096 PolarHBondContact ND1-NE 2.96Å; H1074-R1096 PolarHBondContact NE2-NH2 2.73Å; A1091-R1096 HydrophobicContact CB-CB 3.94Å; Y1092-R1096 WeakPolarHBondContact O-CB 3.41Å; Y1092-R1096 PolarHBondContact O-N 3.41Å; R1096-D1118 IonicContact CZ-OD2 3.66Å; R1096-D1118 PolarHBondContact NH1-O 3.05Å; R1096-D1118 IonicContact NH1-OD2 3.76Å; R1096-D1118 PolarHBondContact NH1-OD2 3.24Å; R1096-D1118 IonicContact NH2-OD2 2.63Å; R1096-D1118 PolarHBondContact NH2-OD2 2.75Å; R1096-A1122 CarbonylContact C-O 3.15Å; R1096-A1122 VanDerWaalsContact CA-O 3.27Å; R1096-A1122 WeakPolarHBondContact CA-O 3.29Å; R1096-N1123 PolarHBondContact N-ND2 2.95Å
1097	V	93.4	Very high	72.4	Confident	0 Å²	0	75.1 Å²	75.1	0%	0	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	125.1	165.6	-173.4	0	0	0	0	108	I1120 A1122 Y1124 I1135 M1151 Q1155	V1097-I1120 HydrophobicContact CB-CG2 4Å; V1097-I1120 HydrophobicContact CG1-CG2 4.38Å; V1097-A1122 HydrophobicContact CB-CB 4.3Å; V1097-A1122 HydrophobicContact CG2-CB 3.96Å; V1097-A1122 PolarHBondContact N-O 3.25Å; V1097-Y1124 HydrophobicContact CG2-CD1 4.34Å; V1097-Y1124 HydrophobicContact CG2-CD2 4.38Å; V1097-Y1124 HydrophobicContact CG2-CE1 4.17Å; V1097-Y1124 HydrophobicContact CG2-CE2 4.2Å; V1097-Y1124 HydrophobicContact CG2-CG 4.47Å; V1097-I1135 HydrophobicContact CG2-CD1 3.9Å; V1097-I1135 HydrophobicContact CG2-CG1 3.94Å; V1097-I1135 HydrophobicContact CG2-CG2 4.01Å; V1097-M1151 HydrophobicContact CB-SD 4.3Å; V1097-M1151 HydrophobicContact CG1-CB 4.49Å; V1097-M1151 HydrophobicContact CG1-CG 4.04Å; V1097-M1151 HydrophobicContact CG1-SD 4.29Å; V1097-M1151 HydrophobicContact CG2-SD 4.13Å; V1097-Q1155 HydrophobicContact CG1-CG 4.01Å
1098	S	89.7	Confident	69.8	Low	63 Å²	63	78.2 Å²	78.2	44%	0.441	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	122.7	171.1	56.6	0	0	0	0	109.2	D1118	S1098-D1118 WeakPolarHBondContact CA-O 3.24Å
1099	I	87	Confident	67.2	Low	10 Å²	10	79 Å²	79	5%	0.051	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-97.7	157	177.2	54.8	173.1	0	0	0	111.8	S1101 D1118 I1120 H1147 T1150 M1151 E1154	I1099-S1101 PolarHBondContact O-N 3.06Å; I1099-D1118 WeakPolarHBondContact CG1-O 3.25Å; I1099-D1118 PolarHBondContact N-O 2.73Å; I1099-D1118 WeakPolarHBondContact O-CA 3.44Å; I1099-D1118 WeakPolarHBondContact O-CB 3.37Å; I1099-I1120 HydrophobicContact CG2-CG2 4.13Å; I1099-H1147 HydrophobicContact CD1-CB 3.71Å; I1099-H1147 WeakPolarHBondContact CD1-CD2 3.45Å; I1099-T1150 HydrophobicContact CB-CG2 4.04Å; I1099-T1150 HydrophobicContact CG2-CG2 4.18Å; I1099-M1151 HydrophobicContact CG2-CB 4.14Å; I1099-E1154 WeakPolarHBondContact CA-OE2 3.41Å
1100	Q	74.2	Confident	64.8	Low	142 Å²	142	86.5 Å²	86.5	66%	0.664	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-79	124.9	-178.4	-59.7	-169.8	1.8	0	0	112.3	N1102 E1154	Q1100-N1102 PolarHBondContact O-N 2.97Å; Q1100-E1154 VanDerWaalsContact CB-OE1 3.26Å; Q1100-E1154 WeakPolarHBondContact CB-OE1 3.25Å; Q1100-E1154 WeakPolarHBondContact CG-OE1 3.47Å; Q1100-E1154 PolarHBondContact N-OE1 3.17Å; Q1100-E1154 PolarHBondContact N-OE2 2.82Å; Q1100-E1154 VanDerWaalsContact N-OE2 3.14Å
1101	S	56.8	Low	62.2	Low	51 Å²	51	96.2 Å²	96.2	36%	0.357	50%	0.495	S	S	.	.			trans	-72.3	91.9	176.6	176.2	0	0	0	0	111.3	I1099 Y1103 S1117	I1099-S1101 PolarHBondContact O-N 3.06Å; S1101-Y1103 PolarHBondContact O-N 3.13Å; S1101-S1117 WeakPolarHBondContact CB-OG 3.26Å; S1101-S1117 WeakPolarHBondContact OG-CB 3.17Å; S1101-S1117 PolarHBondContact OG-OG 3.18Å
1102	N	51.3	Low	59.5	Low	104 Å²	104	99.5 Å²	99.5	56%	0.556	53%	0.529	S	S	*	.			trans	-63	-1.6	176.6	-71.4	-50.3	0	0	0	114.9	Q1100 Q1104	Q1100-N1102 PolarHBondContact O-N 2.97Å; N1102-Q1104 VanDerWaalsContact C-N 3.26Å; N1102-Q1104 PolarHBondContact O-N 3.36Å
1103	Y	44.4	Very low	57.2	Low	174 Å²	174	105.7 Å²	105.7	68%	0.682	56%	0.563	S	S	*	*			trans	-74.2	71.7	171.1	-75.4	-82.6	0	0	0	112.5	S1101	S1101-Y1103 PolarHBondContact O-N 3.13Å
1104	Q	36	Very low	55.2	Low	161 Å²	161	109.1 Å²	109.1	75%	0.752	59%	0.585	S	S	*	*			trans	-99	94.8	162.2	-76.5	-167.8	-14.4	0	0	110.4	N1102	N1102-Q1104 VanDerWaalsContact C-N 3.26Å; N1102-Q1104 PolarHBondContact O-N 3.36Å
1105	H	36.4	Very low	53.4	Low	170 Å²	170	109 Å²	109	79%	0.787	58%	0.584	S	S	*	*			trans	-130.4	102.5	162.4	-99.9	-69.1	0	0	0	112.3
1106	H	38.7	Very low	51.9	Low	163 Å²	163	107.9 Å²	107.9	76%	0.755	58%	0.578	S	S	*	*			trans	-56.4	145.7	147.6	-49.4	-88.7	0	0	0	108.5
1107	S	33	Very low	50.5	Low	102 Å²	102	107.6 Å²	107.6	71%	0.713	58%	0.581	S	S	*	*			cis	-158.3	132	1.7	48.4	0	0	0	0	112.3
1108	N	30.5	Very low	50.2	Low	166 Å²	166	109.4 Å²	109.4	89%	0.888	59%	0.591	S	S	*	*			trans	-155.1	128.9	134.8	-107.2	-16.5	0	0	0	108.4	Q1110	N1108-Q1110 PolarHBondContact O-N 3.43Å; N1108-Q1110 VanDerWaalsContact O-N 3.12Å
1109	A	30.4	Very low	50.3	Low	107 Å²	107	106.4 Å²	106.4	88%	0.884	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	84.3	-160.1	0	0	0	0	0	113.1
1110	Q	34.9	Very low	50.5	Low	170 Å²	170	106 Å²	106	79%	0.794	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-150.5	-17.9	165.8	-140.6	164.3	-6.2	0	0	118.2	N1108	N1108-Q1110 PolarHBondContact O-N 3.43Å; N1108-Q1110 VanDerWaalsContact O-N 3.12Å
1111	Y	33.6	Very low	51.4	Low	227 Å²	227	99.2 Å²	99.2	89%	0.89	54%	0.536	S	S	*	.			trans	-133.2	136.8	173.3	-73.9	-81.6	0	0	0	111.7
1112	G	35.1	Very low	53.1	Low	70 Å²	70	96.8 Å²	96.8	72%	0.722	52%	0.519	S	S	*	.			trans	-105.9	161.6	-170.7	0	0	0	0	0	114.7
1113	I	39.9	Very low	55.1	Low	157 Å²	157	91.9 Å²	91.9	81%	0.805	49%	0.493	S	S	*	.			trans	28.7	93.5	160.4	-47.2	178.8	0	0	0	115.1	S1115	I1113-S1115 PolarHBondContact O-N 3.08Å; I1113-S1115 PolarHBondContact O-OG 2.83Å
1114	V	44.7	Very low	57.4	Low	107 Å²	107	84.7 Å²	84.7	65%	0.648	46%	0.464	S	S	*	.			trans	-60.7	100.2	171.2	-178.9	0	0	0	0	109.6	I1079 G1116 S1117	I1079-V1114 HydrophobicContact CD1-CG1 4.38Å; V1114-G1116 PolarHBondContact O-N 3.35Å; V1114-S1117 PolarHBondContact O-OG 3Å
1115	S	50.1	Low	60	Low	89 Å²	89	77.1 Å²	77.1	62%	0.622	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	108.5	-171.9	-64.2	0	0	0	0	110.8	I1113	I1113-S1115 PolarHBondContact O-N 3.08Å; I1113-S1115 PolarHBondContact O-OG 2.83Å
1116	G	57.9	Low	62.4	Low	1 Å²	1	71.5 Å²	71.5	1%	0.01	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	134.6	-5.5	178	0	0	0	0	0	115.6	N1080 K1083 V1114 D1118	N1080-G1116 PolarHBondContact OD1-O 2.95Å; K1083-G1116 PolarHBondContact NZ-O 3.27Å; V1114-G1116 PolarHBondContact O-N 3.35Å; G1116-D1118 PolarHBondContact O-N 2.85Å
1117	S	61.8	Low	64.6	Low	26 Å²	26	64.5 Å²	64.5	18%	0.182	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-17.8	171.5	47.6	0	0	0	0	113.7	S1101 V1114	S1101-S1117 WeakPolarHBondContact CB-OG 3.26Å; S1101-S1117 WeakPolarHBondContact OG-CB 3.17Å; S1101-S1117 PolarHBondContact OG-OG 3.18Å; V1114-S1117 PolarHBondContact O-OG 3Å
1118	D	87.4	Confident	66.9	Low	38 Å²	38	67.6 Å²	67.6	20%	0.203	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89	4.2	-176.7	76	-52.5	0	0	0	114.4	R1096 S1098 I1099 G1116	R1096-D1118 IonicContact CZ-OD2 3.66Å; R1096-D1118 PolarHBondContact NH1-O 3.05Å; R1096-D1118 IonicContact NH1-OD2 3.76Å; R1096-D1118 PolarHBondContact NH1-OD2 3.24Å; R1096-D1118 IonicContact NH2-OD2 2.63Å; R1096-D1118 PolarHBondContact NH2-OD2 2.75Å; S1098-D1118 WeakPolarHBondContact CA-O 3.24Å; I1099-D1118 WeakPolarHBondContact CG1-O 3.25Å; I1099-D1118 PolarHBondContact N-O 2.73Å; I1099-D1118 WeakPolarHBondContact O-CA 3.44Å; I1099-D1118 WeakPolarHBondContact O-CB 3.37Å; G1116-D1118 PolarHBondContact O-N 2.85Å
1119	Y	91.5	Very high	69.4	Low	0 Å²	0	67.6 Å²	67.6	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	130	-171.4	177.3	-88.5	0	0	0	114	H1074 S1075 N1080 K1083 N1084 A1091 N1121	H1074-Y1119 HydrophobicContact CB-CD2 3.87Å; H1074-Y1119 HydrophobicContact CB-CE2 4.36Å; S1075-Y1119 VanDerWaalsContact CB-OH 3.28Å; S1075-Y1119 WeakPolarHBondContact CB-OH 3.27Å; S1075-Y1119 VanDerWaalsContact OG-CE2 3.23Å; S1075-Y1119 WeakPolarHBondContact OG-CE2 2.93Å; S1075-Y1119 PolarHBondContact OG-OH 2.76Å; N1080-Y1119 HydrophobicContact CB-CD1 3.59Å; N1080-Y1119 HydrophobicContact CB-CE1 3.88Å; N1080-Y1119 HydrophobicContact CB-CG 4.02Å; N1080-Y1119 VanDerWaalsContact CG-CD1 3.45Å; N1080-Y1119 VanDerWaalsContact ND2-CB 3.28Å; N1080-Y1119 WeakPolarHBondContact ND2-CB 3.41Å; N1080-Y1119 WeakPolarHBondContact OD1-CB 3.34Å; K1083-Y1119 HydrophobicContact CB-CD1 4.27Å; K1083-Y1119 HydrophobicContact CB-CE1 4.15Å; K1083-Y1119 HydrophobicContact CD-CD1 3.81Å; K1083-Y1119 HydrophobicContact CD-CE1 4.49Å; K1083-Y1119 WeakPolarHBondContact CD-O 3.41Å; K1083-Y1119 PolarHBondContact NZ-O 3.12Å; N1084-Y1119 WeakPolarHBondContact OD1-CE1 3.48Å; N1084-Y1119 PolarHBondContact OD1-OH 2.94Å; A1091-Y1119 HydrophobicContact CB-CE2 4.07Å; Y1119-N1121 HydrophobicContact CE1-CB 4.18Å
1120	I	92.5	Very high	71.9	Confident	1 Å²	1	67 Å²	67	1%	0.005	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	148.5	158	177.6	160.2	0	0	0	109.3	V1097 I1099 A1122 H1147 F1148 M1151	V1097-I1120 HydrophobicContact CB-CG2 4Å; V1097-I1120 HydrophobicContact CG1-CG2 4.38Å; I1099-I1120 HydrophobicContact CG2-CG2 4.13Å; I1120-A1122 HydrophobicContact CG1-CB 4.08Å; I1120-A1122 HydrophobicContact CG2-CB 4.07Å; I1120-A1122 PolarHBondContact O-N 3.4Å; I1120-H1147 HydrophobicContact CB-CB 4.28Å; I1120-H1147 HydrophobicContact CD1-CB 4.2Å; I1120-F1148 VanDerWaalsContact CD1-CA 3.47Å; I1120-F1148 HydrophobicContact CD1-CB 3.98Å; I1120-M1151 HydrophobicContact CD1-CB 4.4Å; I1120-M1151 HydrophobicContact CD1-CE 3.88Å; I1120-M1151 HydrophobicContact CD1-SD 3.95Å; I1120-M1151 HydrophobicContact CG2-SD 4.23Å
1121	N	92.8	Very high	74.4	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	69.2	172.6	-168.5	-36.7	0	0	0	111.2	N1084 I1089 Y1119 T1137 Q1138 R1276	N1084-N1121 VanDerWaalsContact CG-ND2 3.35Å; N1084-N1121 PolarHBondContact OD1-ND2 3.29Å; I1089-N1121 PolarHBondContact O-ND2 2.82Å; Y1119-N1121 HydrophobicContact CE1-CB 4.18Å; N1121-T1137 PolarHBondContact O-OG1 3.38Å; N1121-Q1138 HydrophobicContact CB-CG 4.16Å; N1121-Q1138 PolarHBondContact O-N 3.39Å; N1121-R1276 PolarHBondContact OD1-NH1 2.97Å; N1121-R1276 PolarHBondContact OD1-NH2 2.84Å
1122	A	93.2	Very high	77	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	148.4	178.4	0	0	0	0	0	110.1	R1096 V1097 I1120 I1135 A1136 M1151	R1096-A1122 CarbonylContact C-O 3.15Å; R1096-A1122 VanDerWaalsContact CA-O 3.27Å; R1096-A1122 WeakPolarHBondContact CA-O 3.29Å; V1097-A1122 HydrophobicContact CB-CB 4.3Å; V1097-A1122 HydrophobicContact CG2-CB 3.96Å; V1097-A1122 PolarHBondContact N-O 3.25Å; I1120-A1122 HydrophobicContact CG1-CB 4.08Å; I1120-A1122 HydrophobicContact CG2-CB 4.07Å; I1120-A1122 PolarHBondContact O-N 3.4Å; A1122-I1135 HydrophobicContact CB-CG2 3.8Å; A1122-A1136 CarbonylContact C-O 3.48Å; A1122-A1136 WeakPolarHBondContact CA-O 2.8Å; A1122-M1151 HydrophobicContact CB-CE 4.3Å; A1122-M1151 HydrophobicContact CB-SD 3.47Å; A1122-M1151 WeakPolarHBondContact CB-SD 3.23Å
1123	N	92.9	Very high	79.6	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	146.3	175.9	-63	89.8	0	0	0	110.8	A1091 Y1092 T1095 R1096 I1135 A1136 Q1275 R1276	A1091-N1123 VanDerWaalsContact CA-OD1 3.29Å; A1091-N1123 WeakPolarHBondContact CA-OD1 3.33Å; A1091-N1123 WeakPolarHBondContact CB-OD1 3.46Å; Y1092-N1123 PolarHBondContact N-ND2 2.84Å; Y1092-N1123 PolarHBondContact O-ND2 3.4Å; T1095-N1123 CarbonylContact O-C 3.46Å; T1095-N1123 VanDerWaalsContact O-CA 3.32Å; T1095-N1123 WeakPolarHBondContact O-CA 3.37Å; T1095-N1123 PolarHBondContact OG1-ND2 3.07Å; R1096-N1123 PolarHBondContact N-ND2 2.95Å; N1123-I1135 CarbonylContact O-C 3.47Å; N1123-I1135 VanDerWaalsContact O-CA 3.31Å; N1123-I1135 WeakPolarHBondContact O-CA 2.96Å; N1123-A1136 PolarHBondContact N-O 3.13Å; N1123-A1136 PolarHBondContact O-N 2.85Å; N1123-Q1275 VanDerWaalsContact CB-O 3.25Å; N1123-Q1275 WeakPolarHBondContact CB-O 3.44Å; N1123-Q1275 PolarHBondContact ND2-O 3.22Å; N1123-Q1275 VanDerWaalsContact ND2-O 3.13Å; N1123-R1276 HydrophobicContact CB-CB 3.92Å; N1123-R1276 HydrophobicContact CB-CG 4.37Å; N1123-R1276 WeakPolarHBondContact OD1-CD 3.29Å; N1123-R1276 WeakPolarHBondContact OD1-CG 3.14Å; N1123-R1276 PolarHBondContact OD1-NH1 2.8Å
1124	Y	93.1	Very high	82	Confident	23 Å²	23	54.5 Å²	54.5	9%	0.09	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	138.4	163.7	-61.6	-71.3	0	0	0	110.6	T1095 V1097 K1132 I1135 Q1155	T1095-Y1124 WeakPolarHBondContact O-CD2 3.14Å; T1095-Y1124 PolarHBondContact O-N 2.83Å; V1097-Y1124 HydrophobicContact CG2-CD1 4.34Å; V1097-Y1124 HydrophobicContact CG2-CD2 4.38Å; V1097-Y1124 HydrophobicContact CG2-CE1 4.17Å; V1097-Y1124 HydrophobicContact CG2-CE2 4.2Å; V1097-Y1124 HydrophobicContact CG2-CG 4.47Å; Y1124-K1132 HydrophobicContact CD1-CB 3.85Å; Y1124-K1132 HydrophobicContact CD1-CD 3.62Å; Y1124-K1132 HydrophobicContact CD1-CG 3.92Å; Y1124-K1132 HydrophobicContact CD2-CD 4.09Å; Y1124-K1132 HydrophobicContact CE1-CD 3.87Å; Y1124-K1132 HydrophobicContact CE2-CD 4.33Å; Y1124-K1132 HydrophobicContact CG-CB 4.25Å; Y1124-K1132 HydrophobicContact CG-CD 3.71Å; Y1124-K1132 HydrophobicContact CG-CG 3.89Å; Y1124-I1135 HydrophobicContact CD1-CD1 4.23Å; Y1124-I1135 HydrophobicContact CD1-CG1 3.83Å; Y1124-I1135 HydrophobicContact CE1-CD1 4.08Å; Y1124-I1135 HydrophobicContact CE1-CG1 4.2Å; Y1124-Q1155 VanDerWaalsContact CE1-OE1 3.25Å; Y1124-Q1155 VanDerWaalsContact OH-CD 3.23Å; Y1124-Q1155 PolarHBondContact OH-NE2 2.93Å; Y1124-Q1155 PolarHBondContact OH-OE1 2.85Å
1125	I	88.6	Confident	84.3	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.01	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	125.2	-174.9	-71.9	-54.1	0	0	0	107.8	K1132 A1133 Y1134 A1136 L1272 Q1275 R1276 M1279	I1125-K1132 CarbonylContact O-C 3.59Å; I1125-A1133 PolarHBondContact O-N 2.88Å; I1125-Y1134 HydrophobicContact CG2-CD2 4.05Å; I1125-Y1134 HydrophobicContact CG2-CG 4.33Å; I1125-Y1134 PolarHBondContact N-O 2.92Å; I1125-Y1134 PolarHBondContact O-N 2.8Å; I1125-A1136 HydrophobicContact CD1-CB 4.16Å; I1125-A1136 HydrophobicContact CG1-CB 3.47Å; I1125-A1136 VanDerWaalsContact CG1-CB 3.47Å; I1125-L1272 HydrophobicContact CB-CD2 4.41Å; I1125-L1272 HydrophobicContact CD1-CB 4.2Å; I1125-L1272 HydrophobicContact CD1-CD2 4.22Å; I1125-L1272 HydrophobicContact CG2-CD1 3.62Å; I1125-L1272 HydrophobicContact CG2-CD2 3.65Å; I1125-L1272 HydrophobicContact CG2-CG 4.17Å; I1125-Q1275 HydrophobicContact CD1-CB 3.82Å; I1125-R1276 HydrophobicContact CD1-CB 4.2Å; I1125-M1279 HydrophobicContact CD1-CE 4.01Å; I1125-M1279 HydrophobicContact CG1-CE 4.33Å
1126	D	87.3	Confident	86.3	Confident	52 Å²	52	45.4 Å²	45.4	28%	0.278	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	135	-177.5	-75.3	10.7	0	0	0	110.9	Q1131 K1132 Q1275	D1126-Q1131 WeakPolarHBondContact OD1-CA 3.23Å; D1126-K1132 PolarHBondContact OD1-N 2.96Å; D1126-Q1275 VanDerWaalsContact CG-NE2 3.25Å; D1126-Q1275 PolarHBondContact OD1-NE2 2.72Å
1127	G	85.3	Confident	87.9	Confident	16 Å²	16	45.4 Å²	45.4	17%	0.165	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	168.7	168.5	0	0	0	0	0	110.8	R1129 K1130	G1127-R1129 PolarHBondContact O-N 2.88Å; G1127-K1130 PolarHBondContact N-O 2.88Å; G1127-K1130 PolarHBondContact O-N 3.25Å
1128	Y	82	Confident	89.3	Confident	167 Å²	167	44.3 Å²	44.3	66%	0.655	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.5	110.2	175.9	179.1	-111.4	0	0	0	110.9	F938 K1130	F938-Y1128 HydrophobicContact CE2-CD1 4.44Å; F938-Y1128 HydrophobicContact CZ-CD1 4.23Å; Y1128-K1130 PolarHBondContact O-N 3.37Å
1129	R	82.7	Confident	89.5	Confident	167 Å²	167	42.5 Å²	42.5	63%	0.63	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.8	11.8	-175.5	-51.6	-176.5	-177.5	-162.6	0.2	116.2	G1127	G1127-R1129 PolarHBondContact O-N 2.88Å
1130	K	83	Confident	89.5	Confident	95 Å²	95	42.5 Å²	42.5	41%	0.413	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	101.7	174.4	-175.8	176.8	-179.7	177.3	0	109.2	G1127 Y1128 A1133	G1127-K1130 PolarHBondContact N-O 2.88Å; G1127-K1130 PolarHBondContact O-N 3.25Å; Y1128-K1130 PolarHBondContact O-N 3.37Å; K1130-A1133 HydrophobicContact CB-CB 3.91Å; K1130-A1133 HydrophobicContact CD-CB 3.88Å; K1130-A1133 HydrophobicContact CG-CB 3.76Å; K1130-A1133 WeakPolarHBondContact O-CB 3.48Å; K1130-A1133 PolarHBondContact O-N 2.79Å
1131	Q	86.1	Confident	89.5	Confident	163 Å²	163	43.2 Å²	43.2	76%	0.762	19%	0.19	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-60.2	142.8	173.1	-70.6	-176.5	-17.3	0	0	110.1	D1126 A1133	D1126-Q1131 WeakPolarHBondContact OD1-CA 3.23Å; Q1131-A1133 PolarHBondContact O-N 2.85Å; Q1131-A1133 VanDerWaalsContact O-N 3.17Å
1132	K	88.8	Confident	89.4	Confident	100 Å²	100	43.7 Å²	43.7	44%	0.435	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	51.1	35.4	-177.8	-48.7	-170	165	-161.7	0	113.7	Y1124 I1125 D1126 Y1134 P1256	Y1124-K1132 HydrophobicContact CD1-CB 3.85Å; Y1124-K1132 HydrophobicContact CD1-CD 3.62Å; Y1124-K1132 HydrophobicContact CD1-CG 3.92Å; Y1124-K1132 HydrophobicContact CD2-CD 4.09Å; Y1124-K1132 HydrophobicContact CE1-CD 3.87Å; Y1124-K1132 HydrophobicContact CE2-CD 4.33Å; Y1124-K1132 HydrophobicContact CG-CB 4.25Å; Y1124-K1132 HydrophobicContact CG-CD 3.71Å; Y1124-K1132 HydrophobicContact CG-CG 3.89Å; I1125-K1132 CarbonylContact O-C 3.59Å; D1126-K1132 PolarHBondContact OD1-N 2.96Å; K1132-Y1134 PolarHBondContact O-N 3.39Å; K1132-P1256 WeakPolarHBondContact O-CB 3.41Å
1133	A	89.3	Confident	89.1	Confident	8 Å²	8	45.9 Å²	45.9	7%	0.066	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	-25.8	179.7	0	0	0	0	0	113.4	I1125 K1130 Q1131 P1256 I1257	I1125-A1133 PolarHBondContact O-N 2.88Å; K1130-A1133 HydrophobicContact CB-CB 3.91Å; K1130-A1133 HydrophobicContact CD-CB 3.88Å; K1130-A1133 HydrophobicContact CG-CB 3.76Å; K1130-A1133 WeakPolarHBondContact O-CB 3.48Å; K1130-A1133 PolarHBondContact O-N 2.79Å; Q1131-A1133 PolarHBondContact O-N 2.85Å; Q1131-A1133 VanDerWaalsContact O-N 3.17Å; A1133-P1256 WeakPolarHBondContact O-CA 3.22Å; A1133-I1257 PolarHBondContact O-N 3.2Å
1134	Y	91.1	Very high	89	Confident	89 Å²	89	45.9 Å²	45.9	35%	0.349	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	162.6	178.4	-49.2	-91.4	0	0	0	110.1	I1125 K1132 I1257 V1259	I1125-Y1134 HydrophobicContact CG2-CD2 4.05Å; I1125-Y1134 HydrophobicContact CG2-CG 4.33Å; I1125-Y1134 PolarHBondContact N-O 2.92Å; I1125-Y1134 PolarHBondContact O-N 2.8Å; K1132-Y1134 PolarHBondContact O-N 3.39Å; Y1134-I1257 CarbonylContact C-O 3.53Å; Y1134-I1257 WeakPolarHBondContact CA-O 3.18Å; Y1134-I1257 WeakPolarHBondContact CB-O 3.42Å; Y1134-I1257 HydrophobicContact CD1-CB 3.86Å; Y1134-I1257 HydrophobicContact CD1-CG2 4.35Å; Y1134-I1257 HydrophobicContact CE1-CB 4.3Å; Y1134-I1257 HydrophobicContact CE1-CD1 4.12Å; Y1134-V1259 HydrophobicContact CD1-CG2 4Å
1135	I	93.4	Very high	88.9	Confident	0 Å²	0	45 Å²	45	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	120.9	159.1	-75.6	162.2	0	0	0	107.3	V1097 A1122 N1123 Y1124 M1151 Q1155 P1256 I1257 V1258 V1259	V1097-I1135 HydrophobicContact CG2-CD1 3.9Å; V1097-I1135 HydrophobicContact CG2-CG1 3.94Å; V1097-I1135 HydrophobicContact CG2-CG2 4.01Å; A1122-I1135 HydrophobicContact CB-CG2 3.8Å; N1123-I1135 CarbonylContact O-C 3.47Å; N1123-I1135 VanDerWaalsContact O-CA 3.31Å; N1123-I1135 WeakPolarHBondContact O-CA 2.96Å; Y1124-I1135 HydrophobicContact CD1-CD1 4.23Å; Y1124-I1135 HydrophobicContact CD1-CG1 3.83Å; Y1124-I1135 HydrophobicContact CE1-CD1 4.08Å; Y1124-I1135 HydrophobicContact CE1-CG1 4.2Å; I1135-M1151 HydrophobicContact CD1-CG 4.12Å; I1135-M1151 HydrophobicContact CD1-SD 4.33Å; I1135-M1151 HydrophobicContact CG2-CE 4.21Å; I1135-M1151 HydrophobicContact CG2-SD 3.67Å; I1135-Q1155 HydrophobicContact CD1-CB 3.87Å; I1135-Q1155 HydrophobicContact CD1-CG 3.7Å; I1135-P1256 HydrophobicContact CB-CB 4.39Å; I1135-P1256 HydrophobicContact CD1-CB 3.82Å; I1135-P1256 HydrophobicContact CD1-CG 3.42Å; I1135-P1256 VanDerWaalsContact CD1-CG 3.42Å; I1135-P1256 HydrophobicContact CG1-CB 3.71Å; I1135-P1256 HydrophobicContact CG1-CG 3.84Å; I1135-I1257 PolarHBondContact N-O 2.81Å; I1135-V1258 HydrophobicContact CB-CG2 3.9Å; I1135-V1258 HydrophobicContact CD1-CG2 4.22Å; I1135-V1258 HydrophobicContact CG2-CG2 4.29Å; I1135-V1259 PolarHBondContact O-N 3.43Å
1136	A	91.2	Very high	88.9	Confident	5 Å²	5	46.9 Å²	46.9	4%	0.041	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	118.3	167.2	0	0	0	0	0	108.6	A1122 N1123 I1125 M1279	A1122-A1136 CarbonylContact C-O 3.48Å; A1122-A1136 WeakPolarHBondContact CA-O 2.8Å; N1123-A1136 PolarHBondContact N-O 3.13Å; N1123-A1136 PolarHBondContact O-N 2.85Å; I1125-A1136 HydrophobicContact CD1-CB 4.16Å; I1125-A1136 HydrophobicContact CG1-CB 3.47Å; I1125-A1136 VanDerWaalsContact CG1-CB 3.47Å; A1136-M1279 HydrophobicContact CB-CE 3.83Å; A1136-M1279 HydrophobicContact CB-SD 4.16Å
1137	T	92.5	Very high	89.1	Confident	1 Å²	1	46.3 Å²	46.3	1%	0.006	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	149.7	178.8	178.8	0	0	0	0	109.3	N1121 F1148 M1151 V1258 V1259 H1260 G1264	N1121-T1137 PolarHBondContact O-OG1 3.38Å; T1137-F1148 HydrophobicContact CG2-CD2 4.13Å; T1137-F1148 HydrophobicContact CG2-CE2 3.83Å; T1137-M1151 HydrophobicContact CG2-CE 3.95Å; T1137-V1258 HydrophobicContact CG2-CG1 3.65Å; T1137-V1259 PolarHBondContact N-O 2.69Å; T1137-H1260 HydrophobicContact CG2-CB 3.86Å; T1137-H1260 WeakPolarHBondContact O-CA 2.72Å; T1137-H1260 WeakPolarHBondContact O-CB 3.35Å; T1137-G1264 WeakPolarHBondContact O-CA 3.4Å
1138	Q	90.8	Very high	89.5	Confident	3 Å²	3	45.6 Å²	45.6	1%	0.014	20%	0.2	C	C	.	.			trans	-52.9	156.7	160.5	65.2	-178.8	29.5	0	0	110.2	K1083 R1085 N1121 S1262 S1263	K1083-Q1138 PolarHBondContact O-NE2 2.92Å; K1083-Q1138 PolarHBondContact O-OE1 2.68Å; R1085-Q1138 HydrophobicContact CB-CB 4.33Å; N1121-Q1138 HydrophobicContact CB-CG 4.16Å; N1121-Q1138 PolarHBondContact O-N 3.39Å; Q1138-S1262 CarbonylContact C-O 3.44Å; Q1138-S1262 WeakPolarHBondContact CA-O 3.39Å; Q1138-S1263 WeakPolarHBondContact CA-O 3.47Å
1139	A	91.5	Very high	90	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	17%	0.169	C	C	.	.			trans	-49.7	129.2	156.9	0	0	0	0	0	109.1	R1085 L1141 K1173 C1174 C1261 S1262	R1085-A1139 VanDerWaalsContact CZ-O 3.29Å; R1085-A1139 PolarHBondContact NE-O 2.74Å; R1085-A1139 VanDerWaalsContact NH2-C 3.35Å; R1085-A1139 PolarHBondContact NH2-O 2.87Å; A1139-L1141 PolarHBondContact O-N 3.01Å; A1139-K1173 WeakPolarHBondContact CB-O 2.81Å; A1139-C1174 VanDerWaalsContact CB-CA 3.43Å; A1139-C1174 HydrophobicContact CB-CB 3.4Å; A1139-C1174 VanDerWaalsContact CB-CB 3.4Å; A1139-C1174 WeakPolarHBondContact CB-SG 3.27Å; A1139-C1261 VanDerWaalsContact CB-O 3.32Å; A1139-C1261 WeakPolarHBondContact CB-O 3.15Å; A1139-S1262 PolarHBondContact N-O 3.06Å
1140	P	92.5	Very high	90.4	Very high	1 Å²	1	30 Å²	30	1%	0.006	14%	0.141	C	C	.	.			trans	-54.3	113.1	179.7	-28.8	38.8	0	0	0	110.2	R1085 F1145 F1148 Y1177	R1085-P1140 PolarHBondContact NH2-O 3.32Å; P1140-F1145 HydrophobicContact CB-CD1 3.74Å; P1140-F1145 HydrophobicContact CB-CE1 4.21Å; P1140-F1145 WeakPolarHBondContact O-CE1 3.09Å; P1140-F1148 HydrophobicContact CB-CB 4.03Å; P1140-F1148 HydrophobicContact CB-CD2 4.41Å; P1140-F1148 HydrophobicContact CB-CG 4.11Å; P1140-F1148 HydrophobicContact CG-CB 3.81Å; P1140-F1148 HydrophobicContact CG-CD1 3.76Å; P1140-F1148 HydrophobicContact CG-CD2 3.34Å; P1140-F1148 HydrophobicContact CG-CE1 4.1Å; P1140-F1148 HydrophobicContact CG-CE2 3.67Å; P1140-F1148 HydrophobicContact CG-CG 3.35Å; P1140-F1148 HydrophobicContact CG-CZ 4.04Å; P1140-Y1177 HydrophobicContact CB-CD1 4.17Å; P1140-Y1177 HydrophobicContact CB-CG 4.2Å; P1140-Y1177 HydrophobicContact CG-CD1 3.63Å; P1140-Y1177 HydrophobicContact CG-CD2 4.38Å; P1140-Y1177 HydrophobicContact CG-CE1 4.04Å; P1140-Y1177 HydrophobicContact CG-CG 3.81Å
1141	L	91.8	Very high	90.9	Very high	15 Å²	15	25.4 Å²	25.4	8%	0.079	12%	0.121	C	C	.	.			trans	-58.5	155.6	162.1	-82.9	172.5	0	0	0	108.2	S1082 R1085 A1139 N1143 T1144 F1145	S1082-L1141 WeakPolarHBondContact O-CD1 3.47Å; R1085-L1141 HydrophobicContact CB-CD1 4.3Å; R1085-L1141 HydrophobicContact CB-CD2 4.22Å; R1085-L1141 HydrophobicContact CB-CG 3.97Å; R1085-L1141 HydrophobicContact CG-CD2 4.17Å; R1085-L1141 HydrophobicContact CG-CG 4.44Å; A1139-L1141 PolarHBondContact O-N 3.01Å; L1141-N1143 VanDerWaalsContact C-N 3.27Å; L1141-N1143 WeakPolarHBondContact CB-OD1 3.38Å; L1141-N1143 PolarHBondContact O-N 2.97Å; L1141-T1144 WeakPolarHBondContact CA-OG1 3.37Å; L1141-T1144 HydrophobicContact CB-CG2 4.37Å; L1141-T1144 PolarHBondContact N-OG1 2.86Å; L1141-T1144 CarbonylContact O-C 3.55Å; L1141-T1144 WeakPolarHBondContact O-CA 3.2Å; L1141-T1144 PolarHBondContact O-N 2.88Å; L1141-T1144 PolarHBondContact O-OG1 3.06Å; L1141-F1145 WeakPolarHBondContact O-CD1 2.55Å; L1141-F1145 PolarHBondContact O-N 3.14Å; L1141-F1145 VanDerWaalsContact O-N 3.1Å
1142	P	89.6	Confident	91.2	Very high	10 Å²	10	17.7 Å²	17.7	7%	0.065	9%	0.085	C	C	.	.	G	3₁₀ helix	trans	-47.6	-50.2	175.2	-30.4	39.5	0	0	0	112.3	Y771 H775 L777 T1144 F1145 D1175	Y771-P1142 HydrophobicContact CE2-CB 4.39Å; Y771-P1142 HydrophobicContact CE2-CG 4.29Å; H775-P1142 WeakPolarHBondContact CE1-CB 2.91Å; H775-P1142 PolarHBondContact CE1-O 2.76Å; H775-P1142 WeakPolarHBondContact ND1-CB 3.11Å; H775-P1142 PolarHBondContact NE2-O 2.87Å; H775-P1142 VanDerWaalsContact NE2-O 3.1Å; L777-P1142 HydrophobicContact CD2-CB 3.62Å; L777-P1142 HydrophobicContact CD2-CG 3.72Å; L777-P1142 HydrophobicContact CG-CB 3.95Å; L777-P1142 HydrophobicContact CG-CG 4.22Å; P1142-T1144 PolarHBondContact O-N 3.44Å; P1142-F1145 WeakPolarHBondContact O-CG 3.48Å; P1142-F1145 PolarHBondContact O-N 3.25Å; P1142-F1145 VanDerWaalsContact O-N 3.12Å; P1142-D1175 VanDerWaalsContact CG-OD1 3.24Å; P1142-D1175 WeakPolarHBondContact CG-OD1 3.09Å
1143	N	88.2	Confident	91.4	Very high	46 Å²	46	13.8 Å²	13.8	25%	0.246	7%	0.067	C	C	.	.	G	3₁₀ helix	trans	-71.9	7.7	178	70.4	-13.3	0	0	0	115.1	H775 S1082 L1141 H1147	H775-N1143 WeakPolarHBondContact CD2-CA 2.83Å; H775-N1143 WeakPolarHBondContact CD2-CB 3.3Å; H775-N1143 PolarHBondContact CD2-N 2.88Å; H775-N1143 VanDerWaalsContact NE2-CA 3.34Å; H775-N1143 WeakPolarHBondContact NE2-CA 3.19Å; H775-N1143 PolarHBondContact NE2-N 2.99Å; H775-N1143 VanDerWaalsContact NE2-N 3.18Å; S1082-N1143 PolarHBondContact O-ND2 3.24Å; L1141-N1143 VanDerWaalsContact C-N 3.27Å; L1141-N1143 WeakPolarHBondContact CB-OD1 3.38Å; L1141-N1143 PolarHBondContact O-N 2.97Å; N1143-H1147 PolarHBondContact O-CE1 2.84Å; N1143-H1147 PolarHBondContact O-ND1 2.82Å; N1143-H1147 VanDerWaalsContact O-ND1 3.14Å
1144	T	90.8	Very high	91.5	Very high	1 Å²	1	16 Å²	16	1%	0.006	8%	0.076	C	C	.	.	G	3₁₀ helix	trans	-129.2	5.4	174	63.5	0	0	0	0	113.1	K1083 L1141 P1142 D1146 H1147 F1148	K1083-T1144 HydrophobicContact CB-CG2 3.72Å; K1083-T1144 HydrophobicContact CG-CG2 4.09Å; L1141-T1144 WeakPolarHBondContact CA-OG1 3.37Å; L1141-T1144 HydrophobicContact CB-CG2 4.37Å; L1141-T1144 PolarHBondContact N-OG1 2.86Å; L1141-T1144 CarbonylContact O-C 3.55Å; L1141-T1144 WeakPolarHBondContact O-CA 3.2Å; L1141-T1144 PolarHBondContact O-N 2.88Å; L1141-T1144 PolarHBondContact O-OG1 3.06Å; P1142-T1144 PolarHBondContact O-N 3.44Å; T1144-D1146 VanDerWaalsContact C-N 3.26Å; T1144-D1146 PolarHBondContact O-N 2.91Å; T1144-H1147 PolarHBondContact O-N 2.87Å; T1144-F1148 WeakPolarHBondContact O-CB 3.49Å; T1144-F1148 PolarHBondContact O-N 3.03Å
1145	F	91.6	Very high	91.6	Very high	4 Å²	4	13.4 Å²	13.4	2%	0.018	7%	0.067	C	C	.	.	H	α-helix	trans	-54.7	-47.2	172.4	-70.6	-4	0	0	0	111.1	A553 L777 P1140 L1141 P1142 F1148 W1149 D1175 Q1176 F1186	A553-F1145 HydrophobicContact CB-CE2 4.25Å; L777-F1145 HydrophobicContact CD2-CE2 3.62Å; L777-F1145 HydrophobicContact CD2-CZ 3.71Å; P1140-F1145 HydrophobicContact CB-CD1 3.74Å; P1140-F1145 HydrophobicContact CB-CE1 4.21Å; P1140-F1145 WeakPolarHBondContact O-CE1 3.09Å; L1141-F1145 WeakPolarHBondContact O-CD1 2.55Å; L1141-F1145 PolarHBondContact O-N 3.14Å; L1141-F1145 VanDerWaalsContact O-N 3.1Å; P1142-F1145 WeakPolarHBondContact O-CG 3.48Å; P1142-F1145 PolarHBondContact O-N 3.25Å; P1142-F1145 VanDerWaalsContact O-N 3.12Å; F1145-F1148 PolarHBondContact O-N 3.18Å; F1145-W1149 PolarHBondContact O-N 3.12Å; F1145-D1175 HydrophobicContact CE1-CB 3.64Å; F1145-D1175 HydrophobicContact CZ-CB 3.76Å; F1145-Q1176 WeakPolarHBondContact CE2-O 2.76Å; F1145-Q1176 WeakPolarHBondContact CZ-O 3.13Å; F1145-F1186 HydrophobicContact CB-CD1 3.9Å; F1145-F1186 HydrophobicContact CB-CE1 3.46Å; F1145-F1186 VanDerWaalsContact CB-CE1 3.46Å; F1145-F1186 HydrophobicContact CB-CZ 4.18Å; F1145-F1186 AromaticContact CD2-CE1 3.88Å; F1145-F1186 HydrophobicContact CD2-CE1 3.88Å; F1145-F1186 HydrophobicContact CD2-CZ 4.37Å; F1145-F1186 HydrophobicContact CG-CE1 4.12Å
1146	D	88.2	Confident	91.6	Very high	42 Å²	42	16 Å²	16	23%	0.225	8%	0.081	C	C	.	.	H	α-helix	trans	-60.2	-60.2	177	-175.6	27.5	0	0	0	111.2	T1144 F1148 W1149 T1150 S1187	T1144-D1146 VanDerWaalsContact C-N 3.26Å; T1144-D1146 PolarHBondContact O-N 2.91Å; D1146-F1148 PolarHBondContact O-N 2.85Å; D1146-W1149 PolarHBondContact O-N 3.27Å; D1146-T1150 WeakPolarHBondContact O-CB 3.27Å; D1146-T1150 PolarHBondContact O-N 3Å; D1146-T1150 PolarHBondContact O-OG1 3.37Å; D1146-T1150 PolarHBondContact OD1-OG1 2.83Å; D1146-S1187 WeakPolarHBondContact OD1-CA 3.38Å; D1146-S1187 WeakPolarHBondContact OD1-CB 3.47Å; D1146-S1187 PolarHBondContact OD1-N 2.79Å; D1146-S1187 PolarHBondContact OD1-OG 2.83Å
1147	H	90.2	Very high	91.7	Very high	40 Å²	40	15.8 Å²	15.8	19%	0.185	8%	0.079	C	C	.	.	H	α-helix	trans	-49.9	-34.8	176	-55.8	130.2	0	0	0	113.6	I1099 I1120 N1143 T1144 M1151	I1099-H1147 HydrophobicContact CD1-CB 3.71Å; I1099-H1147 WeakPolarHBondContact CD1-CD2 3.45Å; I1120-H1147 HydrophobicContact CB-CB 4.28Å; I1120-H1147 HydrophobicContact CD1-CB 4.2Å; N1143-H1147 PolarHBondContact O-CE1 2.84Å; N1143-H1147 PolarHBondContact O-ND1 2.82Å; N1143-H1147 VanDerWaalsContact O-ND1 3.14Å; T1144-H1147 PolarHBondContact O-N 2.87Å; H1147-M1151 WeakPolarHBondContact O-CB 3.3Å; H1147-M1151 PolarHBondContact O-N 2.8Å
1148	F	93.9	Very high	91.7	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-71.8	-49.4	178.3	170.5	-91.9	0	0	0	111.6	I1120 T1137 P1140 T1144 F1145 D1146 T1150 M1151 I1152 I1160 Y1177 V1258	I1120-F1148 VanDerWaalsContact CD1-CA 3.47Å; I1120-F1148 HydrophobicContact CD1-CB 3.98Å; T1137-F1148 HydrophobicContact CG2-CD2 4.13Å; T1137-F1148 HydrophobicContact CG2-CE2 3.83Å; P1140-F1148 HydrophobicContact CB-CB 4.03Å; P1140-F1148 HydrophobicContact CB-CD2 4.41Å; P1140-F1148 HydrophobicContact CB-CG 4.11Å; P1140-F1148 HydrophobicContact CG-CB 3.81Å; P1140-F1148 HydrophobicContact CG-CD1 3.76Å; P1140-F1148 HydrophobicContact CG-CD2 3.34Å; P1140-F1148 HydrophobicContact CG-CE1 4.1Å; P1140-F1148 HydrophobicContact CG-CE2 3.67Å; P1140-F1148 HydrophobicContact CG-CG 3.35Å; P1140-F1148 HydrophobicContact CG-CZ 4.04Å; T1144-F1148 WeakPolarHBondContact O-CB 3.49Å; T1144-F1148 PolarHBondContact O-N 3.03Å; F1145-F1148 PolarHBondContact O-N 3.18Å; D1146-F1148 PolarHBondContact O-N 2.85Å; F1148-T1150 VanDerWaalsContact C-N 3.31Å; F1148-T1150 PolarHBondContact O-N 2.82Å; F1148-M1151 HydrophobicContact CD2-CE 3.42Å; F1148-M1151 VanDerWaalsContact CD2-CE 3.42Å; F1148-M1151 HydrophobicContact CE2-CE 3.91Å; F1148-M1151 HydrophobicContact CG-CE 4.22Å; F1148-M1151 CarbonylContact O-C 3.59Å; F1148-M1151 WeakPolarHBondContact O-CA 3.1Å; F1148-M1151 VanDerWaalsContact O-CB 3.29Å; F1148-M1151 WeakPolarHBondContact O-CB 3.42Å; F1148-M1151 PolarHBondContact O-N 2.74Å; F1148-M1151 VanDerWaalsContact O-N 3.11Å; F1148-I1152 HydrophobicContact CD1-CD1 4.42Å; F1148-I1152 HydrophobicContact CD1-CG1 4.07Å; F1148-I1152 HydrophobicContact CE1-CD1 3.89Å; F1148-I1152 HydrophobicContact CE1-CG1 3.76Å; F1148-I1152 HydrophobicContact CE2-CD1 4.1Å; F1148-I1152 HydrophobicContact CZ-CD1 3.74Å; F1148-I1152 HydrophobicContact CZ-CG1 4.16Å; F1148-I1152 WeakPolarHBondContact O-CG1 3.45Å; F1148-I1152 PolarHBondContact O-N 2.92Å; F1148-I1160 HydrophobicContact CE1-CD1 4.1Å; F1148-I1160 HydrophobicContact CZ-CD1 4.09Å; F1148-I1160 HydrophobicContact CZ-CG2 4.09Å; F1148-Y1177 AromaticContact CD1-CD2 3.97Å; F1148-Y1177 HydrophobicContact CD1-CD2 3.97Å; F1148-Y1177 HydrophobicContact CD1-CE2 4.22Å; F1148-Y1177 AromaticContact CE1-CD2 3.48Å; F1148-Y1177 HydrophobicContact CE1-CD2 3.48Å; F1148-Y1177 VanDerWaalsContact CE1-CD2 3.48Å; F1148-Y1177 AromaticContact CE1-CE2 3.28Å; F1148-Y1177 HydrophobicContact CE1-CE2 3.28Å; F1148-Y1177 HydrophobicContact CE1-CG 4.33Å; F1148-Y1177 AromaticContact CE1-CZ 3.97Å; F1148-Y1177 HydrophobicContact CZ-CD2 4.18Å; F1148-Y1177 AromaticContact CZ-CE2 3.62Å; F1148-Y1177 HydrophobicContact CZ-CE2 3.62Å; F1148-Y1177 AromaticContact CZ-CZ 3.84Å; F1148-V1258 HydrophobicContact CE2-CG1 3.63Å; F1148-V1258 HydrophobicContact CZ-CG1 4.06Å
1149	W	92.5	Very high	91.9	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-69.5	-31.2	176.2	-69.6	112.5	0	0	0	112	F1145 D1146 M1151 I1152 W1153 I1160 Y1177 W1178 F1186 L1190 V1192 F1208 L1210 I1219	F1145-W1149 PolarHBondContact O-N 3.12Å; D1146-W1149 PolarHBondContact O-N 3.27Å; W1149-M1151 VanDerWaalsContact C-N 3.3Å; W1149-M1151 PolarHBondContact O-N 3.33Å; W1149-I1152 HydrophobicContact CD2-CG1 4.17Å; W1149-I1152 HydrophobicContact CE3-CB 3.81Å; W1149-I1152 HydrophobicContact CE3-CG1 3.51Å; W1149-I1152 HydrophobicContact CE3-CG2 3.97Å; W1149-I1152 HydrophobicContact CZ3-CB 4.33Å; W1149-I1152 HydrophobicContact CZ3-CG1 3.94Å; W1149-I1152 HydrophobicContact CZ3-CG2 4.04Å; W1149-I1152 PolarHBondContact O-N 3.43Å; W1149-I1152 VanDerWaalsContact O-N 3.17Å; W1149-W1153 WeakPolarHBondContact O-CB 3.43Å; W1149-W1153 PolarHBondContact O-N 2.86Å; W1149-I1160 HydrophobicContact CE3-CD1 4.39Å; W1149-I1160 HydrophobicContact CH2-CD1 3.44Å; W1149-I1160 VanDerWaalsContact CH2-CD1 3.44Å; W1149-I1160 HydrophobicContact CZ2-CD1 4.32Å; W1149-I1160 HydrophobicContact CZ3-CD1 3.49Å; W1149-I1160 VanDerWaalsContact CZ3-CD1 3.49Å; W1149-Y1177 AromaticContact CE2-CD2 3.63Å; W1149-Y1177 HydrophobicContact CH2-CD2 4.48Å; W1149-Y1177 HydrophobicContact CH2-CE2 4.25Å; W1149-Y1177 AromaticContact CZ2-CD2 3.41Å; W1149-Y1177 HydrophobicContact CZ2-CD2 3.41Å; W1149-Y1177 VanDerWaalsContact CZ2-CD2 3.41Å; W1149-Y1177 AromaticContact CZ2-CE2 3.56Å; W1149-Y1177 HydrophobicContact CZ2-CE2 3.56Å; W1149-Y1177 AromaticContact NE1-CD2 3.58Å; W1149-Y1177 PolarHBondContact NE1-O 3.34Å; W1149-W1178 HydrophobicContact CZ2-CB 4.44Å; W1149-F1186 HydrophobicContact CB-CB 4.45Å; W1149-F1186 HydrophobicContact CB-CD2 4.13Å; W1149-F1186 HydrophobicContact CB-CG 4.42Å; W1149-F1186 AromaticContact CD1-CD2 3.29Å; W1149-F1186 AromaticContact CD1-CE2 3.21Å; W1149-F1186 AromaticContact CD1-CG 3.86Å; W1149-F1186 AromaticContact CD1-CZ 3.74Å; W1149-F1186 AromaticContact CG-CD2 3.81Å; W1149-F1186 HydrophobicContact CG-CD2 3.81Å; W1149-F1186 HydrophobicContact CG-CE2 4.07Å; W1149-F1186 HydrophobicContact CG-CG 4.42Å; W1149-F1186 AromaticContact NE1-CD2 3.93Å; W1149-F1186 AromaticContact NE1-CE2 3.37Å; W1149-F1186 AromaticContact NE1-CZ 3.83Å; W1149-L1190 HydrophobicContact CB-CD2 3.88Å; W1149-L1190 WeakPolarHBondContact O-CD2 3.16Å; W1149-V1192 HydrophobicContact CD2-CG2 3.34Å; W1149-V1192 HydrophobicContact CE3-CG2 3.68Å; W1149-V1192 HydrophobicContact CG-CG2 3.91Å; W1149-V1192 HydrophobicContact CH2-CB 4.36Å; W1149-V1192 HydrophobicContact CH2-CG1 3.75Å; W1149-V1192 HydrophobicContact CH2-CG2 3.61Å; W1149-V1192 HydrophobicContact CZ2-CB 4.19Å; W1149-V1192 HydrophobicContact CZ2-CG1 3.8Å; W1149-V1192 HydrophobicContact CZ2-CG2 3.26Å; W1149-V1192 HydrophobicContact CZ3-CG1 4.41Å; W1149-V1192 HydrophobicContact CZ3-CG2 3.8Å; W1149-F1208 HydrophobicContact CH2-CD2 4.24Å; W1149-L1210 HydrophobicContact CE3-CD1 3.46Å; W1149-L1210 VanDerWaalsContact CE3-CD1 3.46Å; W1149-L1210 HydrophobicContact CZ3-CD1 3.65Å; W1149-I1219 HydrophobicContact CZ3-CG2 4.33Å
1150	T	90.6	Very high	92	Very high	6 Å²	6	16.7 Å²	16.7	4%	0.037	8%	0.084	C	C	.	.	H	α-helix	trans	-54.2	-47.3	165.2	-50.7	0	0	0	0	111	I1099 D1146 F1148 W1153 E1154 S1187 L1190	I1099-T1150 HydrophobicContact CB-CG2 4.04Å; I1099-T1150 HydrophobicContact CG2-CG2 4.18Å; D1146-T1150 WeakPolarHBondContact O-CB 3.27Å; D1146-T1150 PolarHBondContact O-N 3Å; D1146-T1150 PolarHBondContact O-OG1 3.37Å; D1146-T1150 PolarHBondContact OD1-OG1 2.83Å; F1148-T1150 VanDerWaalsContact C-N 3.31Å; F1148-T1150 PolarHBondContact O-N 2.82Å; T1150-W1153 PolarHBondContact O-N 2.85Å; T1150-E1154 HydrophobicContact CG2-CG 4.2Å; T1150-E1154 WeakPolarHBondContact CG2-OE1 3.25Å; T1150-E1154 WeakPolarHBondContact O-CB 3.4Å; T1150-E1154 VanDerWaalsContact O-CG 3.32Å; T1150-E1154 WeakPolarHBondContact O-CG 3.43Å; T1150-E1154 PolarHBondContact O-N 2.52Å; T1150-S1187 PolarHBondContact OG1-OG 2.93Å; T1150-L1190 HydrophobicContact CG2-CD1 4.44Å
1151	M	93.7	Very high	92	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-63.5	-46.4	172.2	165.1	-176.5	81.7	0	0	112.8	V1097 I1099 I1120 A1122 I1135 T1137 H1147 F1148 W1149 W1153 E1154 Q1155 V1258	V1097-M1151 HydrophobicContact CB-SD 4.3Å; V1097-M1151 HydrophobicContact CG1-CB 4.49Å; V1097-M1151 HydrophobicContact CG1-CG 4.04Å; V1097-M1151 HydrophobicContact CG1-SD 4.29Å; V1097-M1151 HydrophobicContact CG2-SD 4.13Å; I1099-M1151 HydrophobicContact CG2-CB 4.14Å; I1120-M1151 HydrophobicContact CD1-CB 4.4Å; I1120-M1151 HydrophobicContact CD1-CE 3.88Å; I1120-M1151 HydrophobicContact CD1-SD 3.95Å; I1120-M1151 HydrophobicContact CG2-SD 4.23Å; A1122-M1151 HydrophobicContact CB-CE 4.3Å; A1122-M1151 HydrophobicContact CB-SD 3.47Å; A1122-M1151 WeakPolarHBondContact CB-SD 3.23Å; I1135-M1151 HydrophobicContact CD1-CG 4.12Å; I1135-M1151 HydrophobicContact CD1-SD 4.33Å; I1135-M1151 HydrophobicContact CG2-CE 4.21Å; I1135-M1151 HydrophobicContact CG2-SD 3.67Å; T1137-M1151 HydrophobicContact CG2-CE 3.95Å; H1147-M1151 WeakPolarHBondContact O-CB 3.3Å; H1147-M1151 PolarHBondContact O-N 2.8Å; F1148-M1151 HydrophobicContact CD2-CE 3.42Å; F1148-M1151 VanDerWaalsContact CD2-CE 3.42Å; F1148-M1151 HydrophobicContact CE2-CE 3.91Å; F1148-M1151 HydrophobicContact CG-CE 4.22Å; F1148-M1151 CarbonylContact O-C 3.59Å; F1148-M1151 WeakPolarHBondContact O-CA 3.1Å; F1148-M1151 VanDerWaalsContact O-CB 3.29Å; F1148-M1151 WeakPolarHBondContact O-CB 3.42Å; F1148-M1151 PolarHBondContact O-N 2.74Å; F1148-M1151 VanDerWaalsContact O-N 3.11Å; W1149-M1151 VanDerWaalsContact C-N 3.3Å; W1149-M1151 PolarHBondContact O-N 3.33Å; M1151-W1153 PolarHBondContact O-N 3.31Å; M1151-E1154 PolarHBondContact O-N 3.21Å; M1151-Q1155 HydrophobicContact CG-CG 4Å; M1151-Q1155 WeakPolarHBondContact O-CB 3.32Å; M1151-Q1155 WeakPolarHBondContact O-CG 3.4Å; M1151-Q1155 PolarHBondContact O-N 2.75Å; M1151-V1258 HydrophobicContact CE-CG1 4.13Å; M1151-V1258 HydrophobicContact CE-CG2 4.33Å
1152	I	94	Very high	92	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-53.5	-43.4	176.1	-57.3	-45.2	0	0	0	110.4	F1148 W1149 N1156 T1157 I1160 L1210 I1219 V1258	F1148-I1152 HydrophobicContact CD1-CD1 4.42Å; F1148-I1152 HydrophobicContact CD1-CG1 4.07Å; F1148-I1152 HydrophobicContact CE1-CD1 3.89Å; F1148-I1152 HydrophobicContact CE1-CG1 3.76Å; F1148-I1152 HydrophobicContact CE2-CD1 4.1Å; F1148-I1152 HydrophobicContact CZ-CD1 3.74Å; F1148-I1152 HydrophobicContact CZ-CG1 4.16Å; F1148-I1152 WeakPolarHBondContact O-CG1 3.45Å; F1148-I1152 PolarHBondContact O-N 2.92Å; W1149-I1152 HydrophobicContact CD2-CG1 4.17Å; W1149-I1152 HydrophobicContact CE3-CB 3.81Å; W1149-I1152 HydrophobicContact CE3-CG1 3.51Å; W1149-I1152 HydrophobicContact CE3-CG2 3.97Å; W1149-I1152 HydrophobicContact CZ3-CB 4.33Å; W1149-I1152 HydrophobicContact CZ3-CG1 3.94Å; W1149-I1152 HydrophobicContact CZ3-CG2 4.04Å; W1149-I1152 PolarHBondContact O-N 3.43Å; W1149-I1152 VanDerWaalsContact O-N 3.17Å; I1152-N1156 PolarHBondContact O-N 2.83Å; I1152-T1157 HydrophobicContact CD1-CG2 4.22Å; I1152-T1157 HydrophobicContact CG2-CG2 4.31Å; I1152-T1157 PolarHBondContact O-N 3.32Å; I1152-I1160 HydrophobicContact CD1-CD1 3.85Å; I1152-I1160 HydrophobicContact CD1-CG1 3.97Å; I1152-I1160 HydrophobicContact CG1-CD1 3.92Å; I1152-I1160 HydrophobicContact CG2-CD1 4.4Å; I1152-L1210 HydrophobicContact CG2-CD1 4.14Å; I1152-L1210 HydrophobicContact CG2-CD2 4.09Å; I1152-I1219 HydrophobicContact CG2-CD1 4.04Å; I1152-I1219 HydrophobicContact CG2-CG2 4.39Å; I1152-V1258 HydrophobicContact CD1-CB 3.84Å; I1152-V1258 HydrophobicContact CD1-CG1 3.88Å; I1152-V1258 HydrophobicContact CD1-CG2 3.61Å
1153	W	91.6	Very high	91.9	Very high	19 Å²	19	16.3 Å²	16.3	7%	0.072	8%	0.082	C	C	.	.	H	α-helix	trans	-69.3	-58.7	179.6	-177	-85.5	0	0	0	113.5	H631 W1149 T1150 M1151 Q1155 N1156 L1190 L1210 K1212 E1215 R1217	H631-W1153 AromaticContact CE1-CE3 3.28Å; H631-W1153 AromaticContact CE1-CZ3 3.51Å; H631-W1153 AromaticContact NE2-CD2 3.85Å; H631-W1153 AromaticContact NE2-CE3 3.58Å; H631-W1153 AromaticContact NE2-CZ3 3.97Å; W1149-W1153 WeakPolarHBondContact O-CB 3.43Å; W1149-W1153 PolarHBondContact O-N 2.86Å; T1150-W1153 PolarHBondContact O-N 2.85Å; M1151-W1153 PolarHBondContact O-N 3.31Å; W1153-Q1155 PolarHBondContact O-N 3.46Å; W1153-N1156 PolarHBondContact O-N 3.45Å; W1153-L1190 HydrophobicContact CB-CD1 3.85Å; W1153-L1190 HydrophobicContact CB-CD2 3.97Å; W1153-L1190 HydrophobicContact CB-CG 4.18Å; W1153-L1190 HydrophobicContact CG-CD1 4.41Å; W1153-L1210 HydrophobicContact CB-CD2 4.49Å; W1153-L1210 HydrophobicContact CD2-CD2 4.4Å; W1153-L1210 HydrophobicContact CE3-CD2 3.38Å; W1153-L1210 HydrophobicContact CE3-CG 3.97Å; W1153-L1210 HydrophobicContact CZ3-CD2 3.87Å; W1153-L1210 HydrophobicContact CZ3-CG 4.3Å; W1153-L1210 WeakPolarHBondContact CZ3-O 3.21Å; W1153-K1212 HydrophobicContact CD2-CB 4.12Å; W1153-K1212 HydrophobicContact CE3-CB 4.21Å; W1153-K1212 HydrophobicContact CH2-CB 3.54Å; W1153-K1212 HydrophobicContact CH2-CG 3.99Å; W1153-K1212 VanDerWaalsContact CH2-N 3.3Å; W1153-K1212 HydrophobicContact CZ2-CB 3.38Å; W1153-K1212 HydrophobicContact CZ2-CD 3.81Å; W1153-K1212 HydrophobicContact CZ2-CG 3.36Å; W1153-K1212 HydrophobicContact CZ3-CB 3.94Å; W1153-E1215 HydrophobicContact CH2-CB 3.64Å; W1153-E1215 WeakPolarHBondContact CH2-OE2 3.5Å; W1153-E1215 HydrophobicContact CZ2-CB 4.06Å; W1153-E1215 WeakPolarHBondContact CZ2-OE2 2.93Å; W1153-R1217 HydrophobicContact CH2-CG 4.21Å; W1153-R1217 VanDerWaalsContact CH2-NE 3.33Å; W1153-R1217 HydrophobicContact CZ3-CG 4.1Å; W1153-R1217 PolarHBondContact O-NH1 3.27Å
1154	E	91.8	Very high	91.7	Very high	55 Å²	55	14.1 Å²	14.1	26%	0.257	7%	0.07	S	C	.	.	H	α-helix	trans	-64.7	-30.9	-174	-71.7	179.5	-176.7	0	0	112.1	I1099 Q1100 T1150 M1151 N1156	I1099-E1154 WeakPolarHBondContact CA-OE2 3.41Å; Q1100-E1154 VanDerWaalsContact CB-OE1 3.26Å; Q1100-E1154 WeakPolarHBondContact CB-OE1 3.25Å; Q1100-E1154 WeakPolarHBondContact CG-OE1 3.47Å; Q1100-E1154 PolarHBondContact N-OE1 3.17Å; Q1100-E1154 PolarHBondContact N-OE2 2.82Å; Q1100-E1154 VanDerWaalsContact N-OE2 3.14Å; T1150-E1154 HydrophobicContact CG2-CG 4.2Å; T1150-E1154 WeakPolarHBondContact CG2-OE1 3.25Å; T1150-E1154 WeakPolarHBondContact O-CB 3.4Å; T1150-E1154 VanDerWaalsContact O-CG 3.32Å; T1150-E1154 WeakPolarHBondContact O-CG 3.43Å; T1150-E1154 PolarHBondContact O-N 2.52Å; M1151-E1154 PolarHBondContact O-N 3.21Å; E1154-N1156 VanDerWaalsContact C-N 3.33Å
1155	Q	93.3	Very high	91.5	Very high	33 Å²	33	16.6 Å²	16.6	15%	0.154	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	1.3	178.2	-50.3	-55.2	-48.7	0	0	112.8	V1097 Y1124 I1135 M1151 W1153 T1157 G1255 P1256	V1097-Q1155 HydrophobicContact CG1-CG 4.01Å; Y1124-Q1155 VanDerWaalsContact CE1-OE1 3.25Å; Y1124-Q1155 VanDerWaalsContact OH-CD 3.23Å; Y1124-Q1155 PolarHBondContact OH-NE2 2.93Å; Y1124-Q1155 PolarHBondContact OH-OE1 2.85Å; I1135-Q1155 HydrophobicContact CD1-CB 3.87Å; I1135-Q1155 HydrophobicContact CD1-CG 3.7Å; M1151-Q1155 HydrophobicContact CG-CG 4Å; M1151-Q1155 WeakPolarHBondContact O-CB 3.32Å; M1151-Q1155 WeakPolarHBondContact O-CG 3.4Å; M1151-Q1155 PolarHBondContact O-N 2.75Å; W1153-Q1155 PolarHBondContact O-N 3.46Å; Q1155-T1157 VanDerWaalsContact C-N 3.26Å; Q1155-T1157 PolarHBondContact O-N 3.2Å; Q1155-G1255 WeakPolarHBondContact O-CA 3.17Å; Q1155-P1256 HydrophobicContact CB-CG 3.93Å; Q1155-P1256 WeakPolarHBondContact O-CD 3.34Å
1156	N	92.7	Very high	91.3	Very high	56 Å²	56	17.5 Å²	17.5	30%	0.299	9%	0.086	S	C	.	.	T	Hydrogen-bonded Turn	trans	51	40.3	-177.3	-166.7	46.8	0	0	0	114.2	I1152 W1153 E1154 N1158 R1217 G1255	I1152-N1156 PolarHBondContact O-N 2.83Å; W1153-N1156 PolarHBondContact O-N 3.45Å; E1154-N1156 VanDerWaalsContact C-N 3.33Å; N1156-N1158 PolarHBondContact O-N 3.11Å; N1156-R1217 WeakPolarHBondContact OD1-CD 3.16Å; N1156-R1217 PolarHBondContact OD1-NH1 3.21Å; N1156-G1255 WeakPolarHBondContact O-CA 3.49Å; N1156-G1255 PolarHBondContact O-N 3.36Å
1157	T	93	Very high	91	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.087	C	C	.	.			trans	-68.8	129.9	175.8	-65.6	0	0	0	0	110.2	I1152 Q1155 V1159 I1160 I1219 P1256 V1258	I1152-T1157 HydrophobicContact CD1-CG2 4.22Å; I1152-T1157 HydrophobicContact CG2-CG2 4.31Å; I1152-T1157 PolarHBondContact O-N 3.32Å; Q1155-T1157 VanDerWaalsContact C-N 3.26Å; Q1155-T1157 PolarHBondContact O-N 3.2Å; T1157-V1159 WeakPolarHBondContact CG2-O 3.47Å; T1157-I1160 HydrophobicContact CG2-CG1 4.3Å; T1157-I1219 WeakPolarHBondContact O-CD1 3.18Å; T1157-P1256 WeakPolarHBondContact CB-O 3.16Å; T1157-P1256 WeakPolarHBondContact CG2-O 3.28Å; T1157-P1256 PolarHBondContact OG1-O 3.31Å; T1157-V1258 HydrophobicContact CG2-CB 3.95Å; T1157-V1258 HydrophobicContact CG2-CG2 3.73Å; T1157-V1258 WeakPolarHBondContact OG1-CG2 3.22Å
1158	N	93.2	Very high	90.1	Very high	21 Å²	21	16.5 Å²	16.5	11%	0.112	8%	0.081	C	C	.	.			trans	-105.7	-10.9	171.5	-71	108.4	0	0	0	114.3	N1156 K1218 I1219 W1220 P1251 C1254	N1156-N1158 PolarHBondContact O-N 3.11Å; N1158-K1218 PolarHBondContact ND2-O 2.62Å; N1158-I1219 CarbonylContact O-C 3.53Å; N1158-I1219 VanDerWaalsContact O-CA 3.32Å; N1158-I1219 WeakPolarHBondContact O-CA 3.29Å; N1158-W1220 PolarHBondContact O-N 2.98Å; N1158-P1251 HydrophobicContact CB-CG 3.81Å; N1158-C1254 HydrophobicContact CB-CB 3.82Å; N1158-C1254 VanDerWaalsContact OD1-CB 3.27Å; N1158-C1254 WeakPolarHBondContact OD1-CB 3.43Å
1159	V	94.3	Very high	88.9	Confident	1 Å²	1	18.5 Å²	18.5	1%	0.006	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	127.3	-178.1	-175.1	0	0	0	0	109.9	T1157 V1161 W1220 L1222 V1246 L1249 I1257 V1258	T1157-V1159 WeakPolarHBondContact CG2-O 3.47Å; V1159-V1161 HydrophobicContact CG1-CG2 4.04Å; V1159-W1220 CarbonylContact C-O 3.54Å; V1159-W1220 WeakPolarHBondContact CA-O 3.19Å; V1159-W1220 HydrophobicContact CG2-CB 4.4Å; V1159-L1222 HydrophobicContact CG1-CD1 3.64Å; V1159-V1246 HydrophobicContact CG1-CG1 4.22Å; V1159-L1249 WeakPolarHBondContact CG2-O 3.38Å; V1159-I1257 HydrophobicContact CB-CG1 4.49Å; V1159-I1257 HydrophobicContact CB-CG2 4.27Å; V1159-I1257 HydrophobicContact CG1-CG2 4.29Å; V1159-V1258 PolarHBondContact O-N 2.97Å
1160	I	94.2	Very high	87.8	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	127.7	172.9	-55.5	172	0	0	0	107.5	F1148 W1149 I1152 T1157 Y1177 I1219 W1220 H1221 L1222 V1258	F1148-I1160 HydrophobicContact CE1-CD1 4.1Å; F1148-I1160 HydrophobicContact CZ-CD1 4.09Å; F1148-I1160 HydrophobicContact CZ-CG2 4.09Å; W1149-I1160 HydrophobicContact CE3-CD1 4.39Å; W1149-I1160 HydrophobicContact CH2-CD1 3.44Å; W1149-I1160 VanDerWaalsContact CH2-CD1 3.44Å; W1149-I1160 HydrophobicContact CZ2-CD1 4.32Å; W1149-I1160 HydrophobicContact CZ3-CD1 3.49Å; W1149-I1160 VanDerWaalsContact CZ3-CD1 3.49Å; I1152-I1160 HydrophobicContact CD1-CD1 3.85Å; I1152-I1160 HydrophobicContact CD1-CG1 3.97Å; I1152-I1160 HydrophobicContact CG1-CD1 3.92Å; I1152-I1160 HydrophobicContact CG2-CD1 4.4Å; T1157-I1160 HydrophobicContact CG2-CG1 4.3Å; I1160-Y1177 VanDerWaalsContact CG2-OH 3.22Å; I1160-Y1177 WeakPolarHBondContact CG2-OH 3.47Å; I1160-I1219 HydrophobicContact CD1-CG2 3.6Å; I1160-I1219 HydrophobicContact CG1-CG2 3.76Å; I1160-W1220 PolarHBondContact N-O 2.77Å; I1160-H1221 WeakPolarHBondContact O-CA 3.05Å; I1160-L1222 PolarHBondContact O-N 3.22Å; I1160-V1258 CarbonylContact C-O 3.48Å; I1160-V1258 WeakPolarHBondContact CA-O 3.35Å; I1160-V1258 HydrophobicContact CG2-CG1 4.45Å
1161	V	93.1	Very high	87	Confident	7 Å²	7	18.2 Å²	18.2	4%	0.042	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	100.9	-177.9	-171.5	0	0	0	0	108	V1159 L1163 F1242 V1246 I1257 V1258 V1259 H1260	V1159-V1161 HydrophobicContact CG1-CG2 4.04Å; V1161-L1163 HydrophobicContact CG1-CD2 3.71Å; V1161-L1163 HydrophobicContact CG1-CG 3.96Å; V1161-F1242 HydrophobicContact CG1-CE1 3.56Å; V1161-F1242 HydrophobicContact CG1-CZ 3.72Å; V1161-V1246 HydrophobicContact CG1-CG2 4.21Å; V1161-V1246 HydrophobicContact CG2-CG1 3.87Å; V1161-V1246 HydrophobicContact CG2-CG2 3.95Å; V1161-I1257 HydrophobicContact CG2-CG2 3.57Å; V1161-V1258 PolarHBondContact N-O 2.73Å; V1161-V1259 HydrophobicContact CB-CG1 4.41Å; V1161-V1259 HydrophobicContact CB-CG2 4.25Å; V1161-V1259 HydrophobicContact CG2-CG2 4.46Å; V1161-H1260 PolarHBondContact O-N 3.29Å
1162	M	92	Very high	86.4	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	117	174.6	176.6	167.6	-166.3	0	0	109.5	S1164 L1166 C1174 W1178 L1222 Q1223 Y1224 H1260	M1162-S1164 VanDerWaalsContact CE-O 3.31Å; M1162-S1164 WeakPolarHBondContact CE-O 3.27Å; M1162-S1164 WeakPolarHBondContact CG-O 3.47Å; M1162-L1166 HydrophobicContact CE-CD2 4.35Å; M1162-C1174 HydrophobicContact CE-CB 3.58Å; M1162-W1178 HydrophobicContact CE-CH2 3.83Å; M1162-W1178 HydrophobicContact CE-CZ3 4.08Å; M1162-W1178 HydrophobicContact SD-CH2 3.31Å; M1162-W1178 WeakPolarHBondContact SD-CH2 3.38Å; M1162-W1178 HydrophobicContact SD-CZ2 4.44Å; M1162-W1178 HydrophobicContact SD-CZ3 3.43Å; M1162-W1178 WeakPolarHBondContact SD-CZ3 3.32Å; M1162-L1222 PolarHBondContact N-O 2.59Å; M1162-Q1223 HydrophobicContact CB-CB 4.18Å; M1162-Q1223 HydrophobicContact CB-CG 4.26Å; M1162-Q1223 HydrophobicContact CG-CB 4.39Å; M1162-Q1223 HydrophobicContact CG-CG 3.92Å; M1162-Q1223 WeakPolarHBondContact O-CA 3.24Å; M1162-Q1223 HydrophobicContact SD-CB 4.45Å; M1162-Q1223 HydrophobicContact SD-CG 3.88Å; M1162-Q1223 PolarHBondContact SD-NE2 2.59Å; M1162-Y1224 PolarHBondContact O-N 2.61Å; M1162-H1260 WeakPolarHBondContact CB-NE2 3.34Å; M1162-H1260 VanDerWaalsContact CG-CE1 3.4Å; M1162-H1260 WeakPolarHBondContact CG-CE1 3.46Å
1163	L	88	Confident	85.9	Confident	11 Å²	11	20.2 Å²	20.2	6%	0.058	10%	0.098	C	C	.	.			trans	-103.8	9.5	-171.4	-72	-175.3	0	0	0	114.2	V1161 F1239 F1242 V1259 H1260 C1261 R1267	V1161-L1163 HydrophobicContact CG1-CD2 3.71Å; V1161-L1163 HydrophobicContact CG1-CG 3.96Å; L1163-F1239 HydrophobicContact CD2-CE2 4.08Å; L1163-F1242 HydrophobicContact CD2-CE1 3.77Å; L1163-F1242 HydrophobicContact CD2-CZ 4.28Å; L1163-V1259 HydrophobicContact CD1-CG1 3.5Å; L1163-V1259 HydrophobicContact CG-CG1 4.23Å; L1163-H1260 WeakPolarHBondContact CB-O 3.36Å; L1163-H1260 PolarHBondContact N-O 3.42Å; L1163-C1261 HydrophobicContact CB-CB 4.08Å; L1163-R1267 HydrophobicContact CD1-CB 4.47Å; L1163-R1267 PolarHBondContact O-NH1 2.98Å; L1163-R1267 PolarHBondContact O-NH2 3.04Å
1164	S	83.3	Confident	85.7	Confident	1 Å²	1	19.3 Å²	19.3	1%	0.007	10%	0.095	C	C	.	.	S	Bend	trans	-128	157.6	173.6	53.9	0	0	0	0	111	M1162 E1168 Q1223 C1261	M1162-S1164 VanDerWaalsContact CE-O 3.31Å; M1162-S1164 WeakPolarHBondContact CE-O 3.27Å; M1162-S1164 WeakPolarHBondContact CG-O 3.47Å; S1164-E1168 WeakPolarHBondContact CA-OE1 3.35Å; S1164-E1168 WeakPolarHBondContact CB-OE1 3.36Å; S1164-Q1223 PolarHBondContact O-NE2 3.12Å; S1164-C1261 PolarHBondContact OG-O 3.04Å
1165	K	85.9	Confident	85.5	Confident	52 Å²	52	16.7 Å²	16.7	23%	0.226	8%	0.083	C	C	.	.			trans	-69	167.7	164.9	-54.3	171.8	-163.6	134.6	0	109.6	N419 I1167 E1168 T1225 D1229	N419-K1165 PolarHBondContact ND2-O 3.37Å; K1165-I1167 WeakPolarHBondContact CB-O 3.22Å; K1165-I1167 WeakPolarHBondContact CD-O 3.47Å; K1165-I1167 PolarHBondContact O-N 3.24Å; K1165-E1168 HydrophobicContact CB-CG 3.61Å; K1165-E1168 HydrophobicContact CD-CG 3.96Å; K1165-E1168 HydrophobicContact CG-CG 3.94Å; K1165-E1168 PolarHBondContact N-OE1 2.85Å; K1165-T1225 WeakPolarHBondContact CE-O 3.47Å; K1165-T1225 WeakPolarHBondContact CG-O 3.28Å; K1165-D1229 IonicContact NZ-OD1 3.67Å; K1165-D1229 PolarHBondContact NZ-OD1 2.82Å; K1165-D1229 IonicContact NZ-OD2 2.75Å; K1165-D1229 PolarHBondContact NZ-OD2 2.91Å
1166	L	87	Confident	85.5	Confident	23 Å²	23	15.2 Å²	15.2	12%	0.12	8%	0.076	C	C	.	.	S	Bend	trans	-67.6	-16.9	165.6	-89.8	-179.1	0	0	0	112.8	M418 N419 M1162 Q1176 W1178 Q1223	M418-L1166 HydrophobicContact CE-CD2 3.72Å; M418-L1166 WeakPolarHBondContact CE-O 3.44Å; N419-L1166 VanDerWaalsContact CB-C 3.46Å; N419-L1166 WeakPolarHBondContact CB-O 3.45Å; N419-L1166 PolarHBondContact ND2-O 2.95Å; M1162-L1166 HydrophobicContact CE-CD2 4.35Å; L1166-Q1176 HydrophobicContact CD2-CB 3.86Å; L1166-W1178 HydrophobicContact CD1-CH2 4.04Å; L1166-W1178 HydrophobicContact CD1-CZ2 3.62Å; L1166-W1178 HydrophobicContact CD2-CH2 3.37Å; L1166-W1178 HydrophobicContact CD2-CZ2 3.84Å; L1166-W1178 HydrophobicContact CD2-CZ3 4.19Å; L1166-W1178 HydrophobicContact CG-CH2 3.58Å; L1166-W1178 HydrophobicContact CG-CZ2 3.7Å; L1166-Q1223 VanDerWaalsContact N-NE2 3.16Å
1167	I	83.3	Confident	85.4	Confident	50 Å²	50	12.5 Å²	12.5	26%	0.256	6%	0.062	S	C	.	.	S	Bend	trans	-164.8	120.4	-162.7	-71.4	169.7	0	0	0	105.6	N511 K513 K1165	N511-I1167 HydrophobicContact CB-CB 4.08Å; N511-I1167 HydrophobicContact CB-CG2 3.32Å; N511-I1167 WeakPolarHBondContact OD1-CG2 3.14Å; K513-I1167 HydrophobicContact CB-CD1 4.4Å; K513-I1167 HydrophobicContact CD-CD1 4.11Å; K513-I1167 HydrophobicContact CG-CD1 3.86Å; K1165-I1167 WeakPolarHBondContact CB-O 3.22Å; K1165-I1167 WeakPolarHBondContact CD-O 3.47Å; K1165-I1167 PolarHBondContact O-N 3.24Å
1168	E	70.5	Confident	85.4	Confident	11 Å²	11	12.5 Å²	12.5	5%	0.051	6%	0.062	C	C	.	.			trans	-119.8	-85.3	-169.1	-72.3	-171.7	173	0	0	120.8	P510 N511 S1164 K1165 K1173 D1229	P510-E1168 HydrophobicContact CB-CB 3.11Å; P510-E1168 HydrophobicContact CB-CG 4.18Å; P510-E1168 WeakPolarHBondContact CB-OE2 3.44Å; P510-E1168 HydrophobicContact CG-CB 4.42Å; N511-E1168 VanDerWaalsContact N-C 3.25Å; N511-E1168 VanDerWaalsContact N-N 3.15Å; N511-E1168 PolarHBondContact OD1-N 3.35Å; N511-E1168 PolarHBondContact OD1-O 2.8Å; S1164-E1168 WeakPolarHBondContact CA-OE1 3.35Å; S1164-E1168 WeakPolarHBondContact CB-OE1 3.36Å; K1165-E1168 HydrophobicContact CB-CG 3.61Å; K1165-E1168 HydrophobicContact CD-CG 3.96Å; K1165-E1168 HydrophobicContact CG-CG 3.94Å; K1165-E1168 PolarHBondContact N-OE1 2.85Å; E1168-K1173 WeakPolarHBondContact OE2-CE 3.3Å; E1168-K1173 VanDerWaalsContact OE2-CG 3.22Å; E1168-K1173 WeakPolarHBondContact OE2-CG 3.48Å; E1168-D1229 VanDerWaalsContact C-OD2 3.31Å; E1168-D1229 HydrophobicContact CB-CB 4.24Å; E1168-D1229 WeakPolarHBondContact CB-OD1 3.41Å; E1168-D1229 VanDerWaalsContact CG-OD1 3.32Å; E1168-D1229 WeakPolarHBondContact CG-OD1 3.29Å; E1168-D1229 VanDerWaalsContact O-OD2 3.06Å
1169	L	68.9	Low	85	Confident	43 Å²	43	11.6 Å²	11.6	23%	0.225	6%	0.057	C	C	.	.	S	Bend	trans	-137.6	19.3	174.2	-105.7	-158.7	0	0	0	121.4	I462 L464 I509 P510 N511 D1229	I462-L1169 VanDerWaalsContact CD1-C 3.45Å; I462-L1169 HydrophobicContact CD1-CD2 3.8Å; I462-L1169 WeakPolarHBondContact CD1-O 3.17Å; I462-L1169 HydrophobicContact CG1-CD2 4.11Å; I462-L1169 HydrophobicContact CG2-CD2 3.65Å; L464-L1169 HydrophobicContact CD2-CD1 4.08Å; I509-L1169 WeakPolarHBondContact CG2-O 3.17Å; P510-L1169 VanDerWaalsContact CA-N 3.28Å; P510-L1169 HydrophobicContact CB-CB 4.07Å; P510-L1169 VanDerWaalsContact CB-N 3.29Å; P510-L1169 HydrophobicContact CG-CB 4.33Å; P510-L1169 VanDerWaalsContact N-C 3.31Å; N511-L1169 WeakPolarHBondContact ND2-CA 3.42Å; L1169-D1229 HydrophobicContact CB-CB 3.54Å; L1169-D1229 HydrophobicContact CD1-CB 3.86Å; L1169-D1229 HydrophobicContact CG-CB 3.66Å; L1169-D1229 WeakPolarHBondContact CG-OD2 3.09Å
1170	G	69.7	Low	84.5	Confident	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.062	C	C	.	.	S	Bend	trans	163.1	-18.4	-179.4	0	0	0	0	0	126.7	I509 P510 N511 L512	I509-G1170 CarbonylContact O-C 3.59Å; I509-G1170 WeakPolarHBondContact O-CA 3.25Å; I509-G1170 PolarHBondContact O-N 3.35Å; P510-G1170 CarbonylContact O-C 3.58Å; N511-G1170 VanDerWaalsContact C-CA 3.43Å; N511-G1170 VanDerWaalsContact C-N 3.27Å; N511-G1170 VanDerWaalsContact CA-N 3.35Å; N511-G1170 PolarHBondContact ND2-N 3Å; N511-G1170 CarbonylContact O-C 3.53Å; N511-G1170 WeakPolarHBondContact O-CA 3.47Å; N511-G1170 PolarHBondContact O-N 2.91Å; L512-G1170 WeakPolarHBondContact CD2-O 3.05Å
1171	Q	73.9	Confident	83.8	Confident	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.084	C	C	.	.	B	Isolated β-bridge	trans	-170.8	0	-163.2	-55.8	-177.7	-38	0	0	120.4	M418 N419 T420 I421 I423 I509 P510 N511 L512 I520	M418-Q1171 CarbonylContact C-O 3.52Å; M418-Q1171 CarbonylContact O-C 3.56Å; N419-Q1171 CarbonylContact C-O 3.55Å; N419-Q1171 WeakPolarHBondContact CA-O 3.15Å; N419-Q1171 PolarHBondContact N-O 3.37Å; T420-Q1171 VanDerWaalsContact C-CB 3.48Å; T420-Q1171 PolarHBondContact N-O 3.03Å; I421-Q1171 HydrophobicContact CB-CB 3.31Å; I421-Q1171 HydrophobicContact CB-CG 3.59Å; I421-Q1171 HydrophobicContact CD1-CB 3.86Å; I421-Q1171 HydrophobicContact CD1-CG 4.21Å; I421-Q1171 HydrophobicContact CG1-CB 3.5Å; I421-Q1171 VanDerWaalsContact CG1-CB 3.5Å; I421-Q1171 HydrophobicContact CG1-CG 4.13Å; I421-Q1171 HydrophobicContact CG2-CB 4.48Å; I421-Q1171 HydrophobicContact CG2-CG 4.28Å; I421-Q1171 VanDerWaalsContact N-OE1 3.09Å; I421-Q1171 PolarHBondContact O-OE1 3.02Å; I421-Q1171 VanDerWaalsContact O-OE1 3.11Å; I423-Q1171 VanDerWaalsContact CG2-NE2 3.32Å; I509-Q1171 HydrophobicContact CB-CG 3.97Å; I509-Q1171 HydrophobicContact CD1-CG 4.06Å; I509-Q1171 HydrophobicContact CG1-CG 4.18Å; I509-Q1171 WeakPolarHBondContact O-CA 3.19Å; I509-Q1171 WeakPolarHBondContact O-CB 3.34Å; I509-Q1171 VanDerWaalsContact O-CG 3.23Å; I509-Q1171 WeakPolarHBondContact O-CG 3.41Å; I509-Q1171 PolarHBondContact O-N 2.82Å; P510-Q1171 CarbonylContact O-C 3.58Å; P510-Q1171 WeakPolarHBondContact O-CA 3.49Å; P510-Q1171 PolarHBondContact O-N 3.42Å; N511-Q1171 CarbonylContact C-O 3.53Å; N511-Q1171 VanDerWaalsContact C-O 3.3Å; N511-Q1171 WeakPolarHBondContact CA-O 3.4Å; N511-Q1171 PolarHBondContact O-N 3.42Å; N511-Q1171 VanDerWaalsContact O-N 3.12Å; L512-Q1171 VanDerWaalsContact CD2-CA 3.44Å; L512-Q1171 HydrophobicContact CD2-CB 4.27Å; L512-Q1171 HydrophobicContact CD2-CG 4.4Å; L512-Q1171 VanDerWaalsContact N-CA 3.34Å; L512-Q1171 PolarHBondContact N-O 3.18Å; I520-Q1171 HydrophobicContact CD1-CG 4.28Å
1172	M	81.6	Confident	83.3	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	8%	0.084	C	C	.	.				0	122.1	0	164.6	-178.2	-82.9	0	0	138.8	T417 M418 N419 T420 I421 R1085 Y1086 D1175	T417-M1172 WeakPolarHBondContact CB-SD 3.39Å; T417-M1172 HydrophobicContact CG2-CB 4.42Å; T417-M1172 HydrophobicContact CG2-CG 4.08Å; T417-M1172 HydrophobicContact CG2-SD 3.6Å; T417-M1172 VanDerWaalsContact CG2-SD 3.6Å; T417-M1172 PolarHBondContact O-N 2.87Å; M418-M1172 VanDerWaalsContact C-CB 3.5Å; M418-M1172 VanDerWaalsContact CA-CB 3.44Å; M418-M1172 HydrophobicContact CB-CB 4.42Å; M418-M1172 HydrophobicContact CB-CE 3.53Å; M418-M1172 HydrophobicContact CG-CE 3.43Å; M418-M1172 VanDerWaalsContact CG-CE 3.43Å; M418-M1172 PolarHBondContact N-SD 2.86Å; M418-M1172 HydrophobicContact SD-CE 3.46Å; M418-M1172 WeakPolarHBondContact SD-CE 3.33Å; N419-M1172 VanDerWaalsContact C-N 3.26Å; N419-M1172 VanDerWaalsContact N-N 3.19Å; N419-M1172 WeakPolarHBondContact OD1-CB 3.11Å; T420-M1172 CarbonylContact C-O 3.59Å; T420-M1172 WeakPolarHBondContact CA-O 3.28Å; T420-M1172 WeakPolarHBondContact CB-O 3.23Å; T420-M1172 PolarHBondContact N-O 3.21Å; T420-M1172 CarbonylContact O-C 3.45Å; T420-M1172 WeakPolarHBondContact O-CA 3.32Å; T420-M1172 PolarHBondContact O-N 3.15Å; T420-M1172 PolarHBondContact OG1-O 2.69Å; I421-M1172 VanDerWaalsContact N-N 3.11Å; R1085-M1172 PolarHBondContact NH1-SD 2.98Å; Y1086-M1172 PolarHBondContact OH-O 3.15Å; M1172-D1175 HydrophobicContact CE-CB 4.22Å; M1172-D1175 WeakPolarHBondContact CE-OD1 3.24Å; M1172-D1175 WeakPolarHBondContact CE-OD2 3.36Å
1173	K	83	Confident	83.1	Confident	41 Å²	41	16.6 Å²	16.6	18%	0.178	8%	0.084	C	C	.	.	S	Bend	trans	-108.4	-72.1	169.4	-74.7	-68.6	-178	-147.1	0	111.7	N419 T420 R1085 A1139 E1168 S1262	N419-K1173 HydrophobicContact CB-CB 4.4Å; N419-K1173 VanDerWaalsContact CG-N 3.26Å; N419-K1173 WeakPolarHBondContact O-CG 3.02Å; N419-K1173 PolarHBondContact O-N 3.11Å; N419-K1173 WeakPolarHBondContact OD1-CA 3.26Å; N419-K1173 PolarHBondContact OD1-N 2.84Å; T420-K1173 HydrophobicContact CG2-CD 3.55Å; T420-K1173 HydrophobicContact CG2-CG 3.68Å; R1085-K1173 WeakPolarHBondContact CD-O 3.14Å; R1085-K1173 PolarHBondContact NE-O 3.07Å; A1139-K1173 WeakPolarHBondContact CB-O 2.81Å; E1168-K1173 WeakPolarHBondContact OE2-CE 3.3Å; E1168-K1173 VanDerWaalsContact OE2-CG 3.22Å; E1168-K1173 WeakPolarHBondContact OE2-CG 3.48Å; K1173-S1262 VanDerWaalsContact C-OG 3.29Å; K1173-S1262 VanDerWaalsContact CA-CB 3.4Å; K1173-S1262 VanDerWaalsContact CA-OG 3.25Å; K1173-S1262 WeakPolarHBondContact CA-OG 3.37Å; K1173-S1262 VanDerWaalsContact O-CA 3.3Å; K1173-S1262 WeakPolarHBondContact O-CA 3.37Å; K1173-S1262 WeakPolarHBondContact O-CB 3.36Å; K1173-S1262 PolarHBondContact O-OG 3.26Å
1174	C	86.5	Confident	82.9	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.082	C	C	.	.			trans	-140.1	126.1	-169.4	-175.3	0	0	0	0	113.4	M418 N419 A1139 M1162 H1260	M418-C1174 VanDerWaalsContact CE-O 3.24Å; M418-C1174 WeakPolarHBondContact CE-O 3.33Å; N419-C1174 PolarHBondContact ND2-N 3.35Å; N419-C1174 PolarHBondContact ND2-O 2.86Å; N419-C1174 PolarHBondContact OD1-N 2.87Å; N419-C1174 PolarHBondContact OD1-O 3.33Å; A1139-C1174 VanDerWaalsContact CB-CA 3.43Å; A1139-C1174 HydrophobicContact CB-CB 3.4Å; A1139-C1174 VanDerWaalsContact CB-CB 3.4Å; A1139-C1174 WeakPolarHBondContact CB-SG 3.27Å; M1162-C1174 HydrophobicContact CE-CB 3.58Å; C1174-H1260 PolarHBondContact SG-CE1 2.86Å
1175	D	88.2	Confident	82.9	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.081	C	C	.	.			trans	-64.3	156	167.8	-63.1	-99.5	0	0	0	112.3	M418 R1085 P1142 F1145 M1172 Y1177	M418-D1175 HydrophobicContact SD-CB 4.46Å; R1085-D1175 IonicContact CZ-OD2 2.67Å; R1085-D1175 IonicContact NH1-OD2 2.63Å; R1085-D1175 PolarHBondContact NH1-OD2 2.9Å; R1085-D1175 IonicContact NH2-OD2 2.78Å; R1085-D1175 PolarHBondContact NH2-OD2 3.36Å; P1142-D1175 VanDerWaalsContact CG-OD1 3.24Å; P1142-D1175 WeakPolarHBondContact CG-OD1 3.09Å; F1145-D1175 HydrophobicContact CE1-CB 3.64Å; F1145-D1175 HydrophobicContact CZ-CB 3.76Å; M1172-D1175 HydrophobicContact CE-CB 4.22Å; M1172-D1175 WeakPolarHBondContact CE-OD1 3.24Å; M1172-D1175 WeakPolarHBondContact CE-OD2 3.36Å; D1175-Y1177 WeakPolarHBondContact O-CD1 3.26Å; D1175-Y1177 PolarHBondContact O-N 2.93Å
1176	Q	92.5	Very high	82.4	Confident	2 Å²	2	14 Å²	14	1%	0.009	7%	0.073	C	C	.	.			trans	-80.1	107	170.3	178.5	156.1	-10.1	0	0	110.9	A553 E555 F1145 L1166 W1178 N1180	A553-Q1176 WeakPolarHBondContact CB-O 3.31Å; E555-Q1176 PolarHBondContact OE1-OE1 3.05Å; E555-Q1176 VanDerWaalsContact OE1-OE1 3.13Å; F1145-Q1176 WeakPolarHBondContact CE2-O 2.76Å; F1145-Q1176 WeakPolarHBondContact CZ-O 3.13Å; L1166-Q1176 HydrophobicContact CD2-CB 3.86Å; Q1176-W1178 HydrophobicContact CG-CD2 4.14Å; Q1176-W1178 HydrophobicContact CG-CE3 4.5Å; Q1176-W1178 HydrophobicContact CG-CZ2 4.35Å; Q1176-W1178 WeakPolarHBondContact CG-O 3.37Å; Q1176-W1178 PolarHBondContact NE2-O 2.95Å; Q1176-N1180 PolarHBondContact NE2-OD1 3.36Å
1177	Y	91.9	Very high	81.3	Confident	0 Å²	0	13.1 Å²	13.1	0%	0	7%	0.068	C	C	.	.			trans	-103.4	9.7	178.3	62.8	-93.9	0	0	0	113	P1140 F1148 W1149 I1160 D1175 L1184 H1221 H1260	P1140-Y1177 HydrophobicContact CB-CD1 4.17Å; P1140-Y1177 HydrophobicContact CB-CG 4.2Å; P1140-Y1177 HydrophobicContact CG-CD1 3.63Å; P1140-Y1177 HydrophobicContact CG-CD2 4.38Å; P1140-Y1177 HydrophobicContact CG-CE1 4.04Å; P1140-Y1177 HydrophobicContact CG-CG 3.81Å; F1148-Y1177 AromaticContact CD1-CD2 3.97Å; F1148-Y1177 HydrophobicContact CD1-CD2 3.97Å; F1148-Y1177 HydrophobicContact CD1-CE2 4.22Å; F1148-Y1177 AromaticContact CE1-CD2 3.48Å; F1148-Y1177 HydrophobicContact CE1-CD2 3.48Å; F1148-Y1177 VanDerWaalsContact CE1-CD2 3.48Å; F1148-Y1177 AromaticContact CE1-CE2 3.28Å; F1148-Y1177 HydrophobicContact CE1-CE2 3.28Å; F1148-Y1177 HydrophobicContact CE1-CG 4.33Å; F1148-Y1177 AromaticContact CE1-CZ 3.97Å; F1148-Y1177 HydrophobicContact CZ-CD2 4.18Å; F1148-Y1177 AromaticContact CZ-CE2 3.62Å; F1148-Y1177 HydrophobicContact CZ-CE2 3.62Å; F1148-Y1177 AromaticContact CZ-CZ 3.84Å; W1149-Y1177 AromaticContact CE2-CD2 3.63Å; W1149-Y1177 HydrophobicContact CH2-CD2 4.48Å; W1149-Y1177 HydrophobicContact CH2-CE2 4.25Å; W1149-Y1177 AromaticContact CZ2-CD2 3.41Å; W1149-Y1177 HydrophobicContact CZ2-CD2 3.41Å; W1149-Y1177 VanDerWaalsContact CZ2-CD2 3.41Å; W1149-Y1177 AromaticContact CZ2-CE2 3.56Å; W1149-Y1177 HydrophobicContact CZ2-CE2 3.56Å; W1149-Y1177 AromaticContact NE1-CD2 3.58Å; W1149-Y1177 PolarHBondContact NE1-O 3.34Å; I1160-Y1177 VanDerWaalsContact CG2-OH 3.22Å; I1160-Y1177 WeakPolarHBondContact CG2-OH 3.47Å; D1175-Y1177 WeakPolarHBondContact O-CD1 3.26Å; D1175-Y1177 PolarHBondContact O-N 2.93Å; Y1177-L1184 VanDerWaalsContact C-CD1 3.44Å; Y1177-L1184 WeakPolarHBondContact O-CD1 3.49Å; Y1177-H1221 AromaticContact CZ-CD2 3.93Å; Y1177-H1221 AromaticContact CZ-NE2 3.76Å; Y1177-H1221 PolarHBondContact OH-CD2 2.82Å; Y1177-H1221 PolarHBondContact OH-NE2 2.81Å; Y1177-H1221 VanDerWaalsContact OH-NE2 3.12Å; Y1177-H1260 AromaticContact CE1-CE1 3.64Å; Y1177-H1260 AromaticContact CE1-NE2 3.44Å; Y1177-H1260 WeakPolarHBondContact CE1-NE2 3.09Å; Y1177-H1260 AromaticContact CZ-NE2 3.49Å; Y1177-H1260 PolarHBondContact OH-CD2 2.89Å; Y1177-H1260 PolarHBondContact OH-NE2 2.96Å
1178	W	92.5	Very high	80.1	Confident	0 Å²	0	12 Å²	12	0%	0	6%	0.062	C	C	.	.	S	Bend	trans	-132.5	160.4	-178.7	72.1	80.4	0	0	0	111.9	W1149 M1162 L1166 Q1176 L1184 R1206 F1208 H1221	W1149-W1178 HydrophobicContact CZ2-CB 4.44Å; M1162-W1178 HydrophobicContact CE-CH2 3.83Å; M1162-W1178 HydrophobicContact CE-CZ3 4.08Å; M1162-W1178 HydrophobicContact SD-CH2 3.31Å; M1162-W1178 WeakPolarHBondContact SD-CH2 3.38Å; M1162-W1178 HydrophobicContact SD-CZ2 4.44Å; M1162-W1178 HydrophobicContact SD-CZ3 3.43Å; M1162-W1178 WeakPolarHBondContact SD-CZ3 3.32Å; L1166-W1178 HydrophobicContact CD1-CH2 4.04Å; L1166-W1178 HydrophobicContact CD1-CZ2 3.62Å; L1166-W1178 HydrophobicContact CD2-CH2 3.37Å; L1166-W1178 HydrophobicContact CD2-CZ2 3.84Å; L1166-W1178 HydrophobicContact CD2-CZ3 4.19Å; L1166-W1178 HydrophobicContact CG-CH2 3.58Å; L1166-W1178 HydrophobicContact CG-CZ2 3.7Å; Q1176-W1178 HydrophobicContact CG-CD2 4.14Å; Q1176-W1178 HydrophobicContact CG-CE3 4.5Å; Q1176-W1178 HydrophobicContact CG-CZ2 4.35Å; Q1176-W1178 WeakPolarHBondContact CG-O 3.37Å; Q1176-W1178 PolarHBondContact NE2-O 2.95Å; W1178-L1184 VanDerWaalsContact CA-CD1 3.44Å; W1178-R1206 VanDerWaalsContact CZ2-NH1 3.25Å; W1178-F1208 HydrophobicContact CB-CE1 4.1Å; W1178-F1208 HydrophobicContact CB-CE2 3.71Å; W1178-F1208 HydrophobicContact CB-CZ 3.43Å; W1178-F1208 VanDerWaalsContact CB-CZ 3.43Å; W1178-F1208 AromaticContact CD1-CZ 3.51Å; W1178-F1208 HydrophobicContact CG-CE1 4.43Å; W1178-F1208 HydrophobicContact CG-CE2 4.07Å; W1178-F1208 AromaticContact CG-CZ 3.57Å; W1178-F1208 HydrophobicContact CG-CZ 3.57Å; W1178-H1221 AromaticContact CE3-NE2 3.58Å; W1178-H1221 AromaticContact CZ3-NE2 3.67Å
1179	P	85.6	Confident	80.4	Confident	2 Å²	2	15.1 Å²	15.1	1%	0.013	8%	0.076	C	C	.	.			trans	-86.1	135.4	177	26	-19.6	0	0	0	113.1	G1182 L1184 V1192 H1194 F1208	P1179-G1182 VanDerWaalsContact CB-O 3.24Å; P1179-G1182 WeakPolarHBondContact CB-O 3.46Å; P1179-G1182 WeakPolarHBondContact CG-O 3.35Å; P1179-L1184 HydrophobicContact CB-CD2 3.6Å; P1179-L1184 HydrophobicContact CB-CG 3.86Å; P1179-L1184 HydrophobicContact CG-CD2 4.31Å; P1179-L1184 HydrophobicContact CG-CG 4Å; P1179-V1192 HydrophobicContact CG-CG1 4.21Å; P1179-V1192 WeakPolarHBondContact CG-O 3.29Å; P1179-H1194 HydrophobicContact CB-CB 4.39Å; P1179-H1194 HydrophobicContact CG-CB 4.03Å; P1179-F1208 HydrophobicContact CG-CD1 4.43Å; P1179-F1208 HydrophobicContact CG-CE1 4.19Å
1180	N	83	Confident	81.2	Confident	21 Å²	21	13.2 Å²	13.2	11%	0.112	7%	0.066	C	C	.	.	S	Bend	trans	-69	-55.5	169.7	-79.2	5.9	0	0	0	111.4	E555 H556 Q1176 H1194	E555-N1180 WeakPolarHBondContact CG-ND2 3.47Å; E555-N1180 PolarHBondContact OE1-ND2 3.41Å; H556-N1180 VanDerWaalsContact CE1-CB 3.42Å; H556-N1180 WeakPolarHBondContact CE1-CB 3.3Å; H556-N1180 PolarHBondContact NE2-ND2 2.94Å; Q1176-N1180 PolarHBondContact NE2-OD1 3.36Å; N1180-H1194 PolarHBondContact O-CD2 3.03Å; N1180-H1194 PolarHBondContact O-CE1 2.85Å; N1180-H1194 VanDerWaalsContact O-CG 3.23Å; N1180-H1194 PolarHBondContact O-ND1 2.75Å; N1180-H1194 PolarHBondContact O-NE2 2.82Å
1181	N	80.4	Confident	82.1	Confident	88 Å²	88	13.2 Å²	13.2	47%	0.471	7%	0.066	S	C	.	.	S	Bend	trans	-124.8	142.2	164	-61.1	-19.7	0	0	0	105.2	H556	H556-N1181 PolarHBondContact ND1-ND2 2.87Å; H556-N1181 VanDerWaalsContact ND1-ND2 3.1Å
1182	G	82.4	Confident	82.9	Confident	4 Å²	4	13.2 Å²	13.2	4%	0.041	7%	0.066	C	C	.	.	S	Bend	trans	95.8	-152.1	-176	0	0	0	0	0	113.7	P1179 H1194	P1179-G1182 VanDerWaalsContact CB-O 3.24Å; P1179-G1182 WeakPolarHBondContact CB-O 3.46Å; P1179-G1182 WeakPolarHBondContact CG-O 3.35Å; G1182-H1194 WeakPolarHBondContact O-CB 3.43Å; G1182-H1194 PolarHBondContact O-N 3.01Å
1183	T	86.9	Confident	83.3	Confident	0 Å²	0	13.6 Å²	13.6	0%	0	7%	0.068	C	C	.	.			trans	-161.4	78	-147.1	-58.2	0	0	0	0	113.1	D628 P629 S630 T780 S781 Q782 H1185 V1192 T1193	D628-T1183 WeakPolarHBondContact OD1-CG2 2.92Å; P629-T1183 HydrophobicContact CB-CG2 3.56Å; P629-T1183 HydrophobicContact CG-CG2 3.61Å; S630-T1183 WeakPolarHBondContact CB-O 3.44Å; S630-T1183 WeakPolarHBondContact OG-CG2 3.41Å; T780-T1183 WeakPolarHBondContact CB-O 3.38Å; T780-T1183 WeakPolarHBondContact CG2-O 3.32Å; T780-T1183 CarbonylContact O-C 3.53Å; T780-T1183 PolarHBondContact O-N 2.87Å; S781-T1183 WeakPolarHBondContact O-CB 3.01Å; Q782-T1183 WeakPolarHBondContact CA-OG1 3.11Å; T1183-H1185 PolarHBondContact O-CD2 2.9Å; T1183-V1192 CarbonylContact C-O 3.57Å; T1183-V1192 VanDerWaalsContact C-O 3.28Å; T1183-V1192 WeakPolarHBondContact CA-O 3.47Å; T1183-V1192 WeakPolarHBondContact CG2-O 3.4Å; T1183-T1193 WeakPolarHBondContact CB-OG1 3.5Å; T1183-T1193 WeakPolarHBondContact CG2-OG1 3.42Å; T1183-T1193 PolarHBondContact OG1-OG1 2.76Å
1184	L	83.5	Confident	83.7	Confident	1 Å²	1	12.4 Å²	12.4	1%	0.005	6%	0.063	C	C	.	.			trans	-69.4	129.8	-170.6	-30.5	175	0	0	0	114	S630 S779 Y1177 W1178 P1179 F1186 V1192	S630-L1184 WeakPolarHBondContact CB-O 3.22Å; S779-L1184 VanDerWaalsContact CB-CD2 3.47Å; S779-L1184 WeakPolarHBondContact OG-CD2 3.33Å; Y1177-L1184 VanDerWaalsContact C-CD1 3.44Å; Y1177-L1184 WeakPolarHBondContact O-CD1 3.49Å; W1178-L1184 VanDerWaalsContact CA-CD1 3.44Å; P1179-L1184 HydrophobicContact CB-CD2 3.6Å; P1179-L1184 HydrophobicContact CB-CG 3.86Å; P1179-L1184 HydrophobicContact CG-CD2 4.31Å; P1179-L1184 HydrophobicContact CG-CG 4Å; L1184-F1186 HydrophobicContact CB-CE2 3.72Å; L1184-F1186 HydrophobicContact CB-CZ 3.61Å; L1184-F1186 HydrophobicContact CD1-CE2 4.21Å; L1184-F1186 HydrophobicContact CD1-CZ 3.68Å; L1184-F1186 HydrophobicContact CG-CZ 4.3Å; L1184-F1186 WeakPolarHBondContact O-CD2 3.43Å; L1184-F1186 VanDerWaalsContact O-CE2 3.29Å; L1184-F1186 WeakPolarHBondContact O-CE2 3.46Å; L1184-V1192 PolarHBondContact N-O 3.43Å
1185	H	82.8	Confident	83.9	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	8%	0.08	C	C	.	.			trans	-83.9	135.4	-179.3	-71.3	-126.5	0	0	0	114.8	I599 P629 S630 Y632 R766 T780 T1183	I599-H1185 WeakPolarHBondContact CD1-CE1 3.43Å; I599-H1185 WeakPolarHBondContact CD1-ND1 3.49Å; P629-H1185 VanDerWaalsContact C-NE2 3.3Å; P629-H1185 WeakPolarHBondContact CB-NE2 3.23Å; P629-H1185 PolarHBondContact O-CE1 3.39Å; P629-H1185 PolarHBondContact O-ND1 2.82Å; P629-H1185 PolarHBondContact O-NE2 2.81Å; S630-H1185 VanDerWaalsContact CA-CD2 3.43Å; S630-H1185 WeakPolarHBondContact CA-CD2 3.43Å; S630-H1185 WeakPolarHBondContact O-CA 3.3Å; Y632-H1185 AromaticContact CD2-CE1 3.8Å; Y632-H1185 WeakPolarHBondContact O-CB 3.06Å; Y632-H1185 PolarHBondContact O-ND1 3.27Å; R766-H1185 VanDerWaalsContact CZ-O 3.23Å; R766-H1185 PolarHBondContact NH1-O 2.7Å; R766-H1185 PolarHBondContact NH2-O 2.85Å; R766-H1185 VanDerWaalsContact NH2-O 3.15Å; T780-H1185 VanDerWaalsContact CB-CD2 3.49Å; T780-H1185 WeakPolarHBondContact CB-CD2 3.43Å; T780-H1185 WeakPolarHBondContact CG2-CD2 3.16Å; T780-H1185 VanDerWaalsContact CG2-NE2 3.26Å; T780-H1185 WeakPolarHBondContact CG2-NE2 3.35Å; T780-H1185 PolarHBondContact OG1-CD2 3.49Å; T1183-H1185 PolarHBondContact O-CD2 2.9Å
1186	F	76.3	Confident	84	Confident	9 Å²	9	19 Å²	19	4%	0.039	10%	0.096	C	C	.	.	B	Isolated β-bridge	trans	-136.6	178.5	172.1	-48.1	-70.8	0	0	0	110.5	S630 Y632 D633 F1145 W1149 L1184 L1190 V1192	S630-F1186 PolarHBondContact O-N 2.94Å; Y632-F1186 CarbonylContact C-O 3.49Å; D633-F1186 PolarHBondContact N-O 3.2Å; F1145-F1186 HydrophobicContact CB-CD1 3.9Å; F1145-F1186 HydrophobicContact CB-CE1 3.46Å; F1145-F1186 VanDerWaalsContact CB-CE1 3.46Å; F1145-F1186 HydrophobicContact CB-CZ 4.18Å; F1145-F1186 AromaticContact CD2-CE1 3.88Å; F1145-F1186 HydrophobicContact CD2-CE1 3.88Å; F1145-F1186 HydrophobicContact CD2-CZ 4.37Å; F1145-F1186 HydrophobicContact CG-CE1 4.12Å; W1149-F1186 HydrophobicContact CB-CB 4.45Å; W1149-F1186 HydrophobicContact CB-CD2 4.13Å; W1149-F1186 HydrophobicContact CB-CG 4.42Å; W1149-F1186 AromaticContact CD1-CD2 3.29Å; W1149-F1186 AromaticContact CD1-CE2 3.21Å; W1149-F1186 AromaticContact CD1-CG 3.86Å; W1149-F1186 AromaticContact CD1-CZ 3.74Å; W1149-F1186 AromaticContact CG-CD2 3.81Å; W1149-F1186 HydrophobicContact CG-CD2 3.81Å; W1149-F1186 HydrophobicContact CG-CE2 4.07Å; W1149-F1186 HydrophobicContact CG-CG 4.42Å; W1149-F1186 AromaticContact NE1-CD2 3.93Å; W1149-F1186 AromaticContact NE1-CE2 3.37Å; W1149-F1186 AromaticContact NE1-CZ 3.83Å; L1184-F1186 HydrophobicContact CB-CE2 3.72Å; L1184-F1186 HydrophobicContact CB-CZ 3.61Å; L1184-F1186 HydrophobicContact CD1-CE2 4.21Å; L1184-F1186 HydrophobicContact CD1-CZ 3.68Å; L1184-F1186 HydrophobicContact CG-CZ 4.3Å; L1184-F1186 WeakPolarHBondContact O-CD2 3.43Å; L1184-F1186 VanDerWaalsContact O-CE2 3.29Å; L1184-F1186 WeakPolarHBondContact O-CE2 3.46Å; F1186-L1190 CarbonylContact C-O 3.54Å; F1186-L1190 VanDerWaalsContact C-O 3.29Å; F1186-L1190 VanDerWaalsContact CA-O 3.29Å; F1186-L1190 WeakPolarHBondContact CA-O 3.47Å; F1186-L1190 HydrophobicContact CB-CB 4.11Å; F1186-L1190 VanDerWaalsContact CB-O 3.29Å; F1186-L1190 WeakPolarHBondContact CB-O 3.28Å; F1186-L1190 PolarHBondContact N-O 3.5Å; F1186-L1190 CarbonylContact O-C 3.59Å; F1186-L1190 WeakPolarHBondContact O-CA 3.15Å; F1186-L1190 PolarHBondContact O-N 3.37Å; F1186-V1192 HydrophobicContact CD2-CG2 3.95Å; F1186-V1192 HydrophobicContact CE2-CB 4.47Å; F1186-V1192 HydrophobicContact CE2-CG2 3.6Å
1187	S	64.3	Low	83.9	Confident	4 Å²	4	21 Å²	21	3%	0.028	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-7.8	167.6	-156.7	10.5	0	0	0	0	120.3	D633 D1146 T1150 K1189 L1190	D633-S1187 VanDerWaalsContact CB-CA 3.42Å; D633-S1187 WeakPolarHBondContact CB-O 3.08Å; D633-S1187 PolarHBondContact N-O 2.74Å; D1146-S1187 WeakPolarHBondContact OD1-CA 3.38Å; D1146-S1187 WeakPolarHBondContact OD1-CB 3.47Å; D1146-S1187 PolarHBondContact OD1-N 2.79Å; D1146-S1187 PolarHBondContact OD1-OG 2.83Å; T1150-S1187 PolarHBondContact OG1-OG 2.93Å; S1187-K1189 CarbonylContact O-C 3.58Å; S1187-K1189 WeakPolarHBondContact O-CA 3.36Å; S1187-K1189 PolarHBondContact O-N 3.34Å; S1187-L1190 PolarHBondContact O-N 3.13Å; S1187-L1190 WeakPolarHBondContact OG-CB 3.35Å; S1187-L1190 VanDerWaalsContact OG-CD1 3.26Å; S1187-L1190 WeakPolarHBondContact OG-CD1 3.28Å
1188	D	58	Low	83.7	Confident	25 Å²	25	23.2 Å²	23.2	13%	0.134	12%	0.12	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-15.4	-175.4	-87.6	18.3	0	0	0	114.7	K635 S636 Q639	K635-D1188 VanDerWaalsContact CB-OD1 3.27Å; K635-D1188 WeakPolarHBondContact CB-OD1 3.5Å; S636-D1188 WeakPolarHBondContact CB-O 3.27Å; S636-D1188 PolarHBondContact N-OD1 3.45Å; S636-D1188 PolarHBondContact N-OD2 3.4Å; S636-D1188 WeakPolarHBondContact OG-CA 3.34Å; S636-D1188 PolarHBondContact OG-O 2.96Å; Q639-D1188 PolarHBondContact NE2-OD2 2.69Å
1189	K	76.9	Confident	83.4	Confident	78 Å²	78	28.7 Å²	28.7	34%	0.339	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn		-137.9	112.4	129.2	-47.4	80	-176.1	-128.5	0	112.8	H631 S1187 K1212 D1213	H631-K1189 HydrophobicContact CB-CB 4.39Å; H631-K1189 VanDerWaalsContact CD2-CB 3.48Å; H631-K1189 WeakPolarHBondContact CD2-CB 3.34Å; H631-K1189 PolarHBondContact CD2-O 3.09Å; H631-K1189 PolarHBondContact NE2-O 3.19Å; H631-K1189 VanDerWaalsContact NE2-O 3.13Å; H631-K1189 CarbonylContact O-C 3.58Å; H631-K1189 WeakPolarHBondContact O-CA 3.34Å; H631-K1189 WeakPolarHBondContact O-CB 3.44Å; S1187-K1189 CarbonylContact O-C 3.58Å; S1187-K1189 WeakPolarHBondContact O-CA 3.36Å; S1187-K1189 PolarHBondContact O-N 3.34Å; K1189-K1212 PolarHBondContact O-NZ 3.33Å; K1189-D1213 WeakPolarHBondContact CD-OD1 3.47Å; K1189-D1213 WeakPolarHBondContact CD-OD2 3.24Å; K1189-D1213 WeakPolarHBondContact CE-OD1 3.41Å; K1189-D1213 WeakPolarHBondContact CG-OD2 3.42Å; K1189-D1213 IonicContact NZ-OD1 2.94Å; K1189-D1213 PolarHBondContact NZ-OD1 2.88Å; K1189-D1213 IonicContact NZ-OD2 2.73Å
1190	L	86	Confident	83.5	Confident	2 Å²	2	29.1 Å²	29.1	1%	0.01	15%	0.148	C	C	.	.	B	Isolated β-bridge	trans	-160.5	113.9	167.8	-118.5	156.9	0	0	0	125.6	S630 H631 W1149 T1150 W1153 F1186 S1187 L1210	S630-L1190 CarbonylContact O-C 3.41Å; H631-L1190 VanDerWaalsContact CA-N 3.32Å; H631-L1190 WeakPolarHBondContact CD2-CA 3.36Å; H631-L1190 PolarHBondContact CD2-N 3.23Å; H631-L1190 WeakPolarHBondContact NE2-CA 3.49Å; H631-L1190 PolarHBondContact O-N 3.23Å; W1149-L1190 HydrophobicContact CB-CD2 3.88Å; W1149-L1190 WeakPolarHBondContact O-CD2 3.16Å; T1150-L1190 HydrophobicContact CG2-CD1 4.44Å; W1153-L1190 HydrophobicContact CB-CD1 3.85Å; W1153-L1190 HydrophobicContact CB-CD2 3.97Å; W1153-L1190 HydrophobicContact CB-CG 4.18Å; W1153-L1190 HydrophobicContact CG-CD1 4.41Å; F1186-L1190 CarbonylContact C-O 3.54Å; F1186-L1190 VanDerWaalsContact C-O 3.29Å; F1186-L1190 VanDerWaalsContact CA-O 3.29Å; F1186-L1190 WeakPolarHBondContact CA-O 3.47Å; F1186-L1190 HydrophobicContact CB-CB 4.11Å; F1186-L1190 VanDerWaalsContact CB-O 3.29Å; F1186-L1190 WeakPolarHBondContact CB-O 3.28Å; F1186-L1190 PolarHBondContact N-O 3.5Å; F1186-L1190 CarbonylContact O-C 3.59Å; F1186-L1190 WeakPolarHBondContact O-CA 3.15Å; F1186-L1190 PolarHBondContact O-N 3.37Å; S1187-L1190 PolarHBondContact O-N 3.13Å; S1187-L1190 WeakPolarHBondContact OG-CB 3.35Å; S1187-L1190 VanDerWaalsContact OG-CD1 3.26Å; S1187-L1190 WeakPolarHBondContact OG-CD1 3.28Å; L1190-L1210 HydrophobicContact CD2-CD1 4.27Å
1191	I	88.1	Confident	83.6	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.146	C	C	.	.			trans	-81.8	153.3	-171.6	-66.6	-100.2	0	0	0	115.4	I627 D628 S630 H631 T1193 E1209 L1210 R1211	I627-I1191 HydrophobicContact CG2-CD1 4.05Å; D628-I1191 HydrophobicContact CB-CD1 4.03Å; D628-I1191 WeakPolarHBondContact O-CD1 3.38Å; D628-I1191 WeakPolarHBondContact OD1-CD1 3.28Å; D628-I1191 WeakPolarHBondContact OD2-CD1 3.24Å; D628-I1191 WeakPolarHBondContact OD2-CG2 3.32Å; S630-I1191 PolarHBondContact O-N 3.07Å; S630-I1191 WeakPolarHBondContact OG-CA 3.1Å; S630-I1191 VanDerWaalsContact OG-CG2 3.32Å; S630-I1191 WeakPolarHBondContact OG-CG2 3.3Å; H631-I1191 HydrophobicContact CB-CB 4.31Å; H631-I1191 HydrophobicContact CB-CD1 3.81Å; H631-I1191 HydrophobicContact CB-CG1 3.23Å; H631-I1191 PolarHBondContact CE1-N 2.97Å; H631-I1191 VanDerWaalsContact CE1-N 3.34Å; H631-I1191 VanDerWaalsContact CG-N 3.3Å; H631-I1191 WeakPolarHBondContact ND1-CB 3.16Å; H631-I1191 WeakPolarHBondContact ND1-CG1 3.39Å; H631-I1191 PolarHBondContact ND1-N 2.85Å; I1191-T1193 VanDerWaalsContact CG2-N 3.34Å; I1191-E1209 WeakPolarHBondContact CG2-O 3.09Å; I1191-L1210 VanDerWaalsContact CG2-CA 3.42Å; I1191-L1210 WeakPolarHBondContact O-CD1 3.43Å; I1191-R1211 HydrophobicContact CD1-CB 4.19Å; I1191-R1211 HydrophobicContact CD1-CG 4.32Å; I1191-R1211 HydrophobicContact CG1-CB 4.04Å; I1191-R1211 HydrophobicContact CG1-CG 4.33Å; I1191-R1211 VanDerWaalsContact CG1-N 3.33Å; I1191-R1211 HydrophobicContact CG2-CG 4.38Å
1192	V	91.6	Very high	83.8	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.13	C	C	.	.			trans	-142.3	108.1	137.3	-167.9	0	0	0	0	110	S630 W1149 P1179 T1183 L1184 F1186 F1208	S630-V1192 VanDerWaalsContact OG-C 3.23Å; S630-V1192 PolarHBondContact OG-N 3.41Å; S630-V1192 PolarHBondContact OG-O 3.43Å; W1149-V1192 HydrophobicContact CD2-CG2 3.34Å; W1149-V1192 HydrophobicContact CE3-CG2 3.68Å; W1149-V1192 HydrophobicContact CG-CG2 3.91Å; W1149-V1192 HydrophobicContact CH2-CB 4.36Å; W1149-V1192 HydrophobicContact CH2-CG1 3.75Å; W1149-V1192 HydrophobicContact CH2-CG2 3.61Å; W1149-V1192 HydrophobicContact CZ2-CB 4.19Å; W1149-V1192 HydrophobicContact CZ2-CG1 3.8Å; W1149-V1192 HydrophobicContact CZ2-CG2 3.26Å; W1149-V1192 HydrophobicContact CZ3-CG1 4.41Å; W1149-V1192 HydrophobicContact CZ3-CG2 3.8Å; P1179-V1192 HydrophobicContact CG-CG1 4.21Å; P1179-V1192 WeakPolarHBondContact CG-O 3.29Å; T1183-V1192 CarbonylContact C-O 3.57Å; T1183-V1192 VanDerWaalsContact C-O 3.28Å; T1183-V1192 WeakPolarHBondContact CA-O 3.47Å; T1183-V1192 WeakPolarHBondContact CG2-O 3.4Å; L1184-V1192 PolarHBondContact N-O 3.43Å; F1186-V1192 HydrophobicContact CD2-CG2 3.95Å; F1186-V1192 HydrophobicContact CE2-CB 4.47Å; F1186-V1192 HydrophobicContact CE2-CG2 3.6Å; V1192-F1208 HydrophobicContact CG1-CB 3.65Å; V1192-F1208 HydrophobicContact CG1-CD1 3.47Å; V1192-F1208 VanDerWaalsContact CG1-CD1 3.47Å; V1192-F1208 HydrophobicContact CG1-CD2 3.86Å; V1192-F1208 HydrophobicContact CG1-CE1 4.13Å; V1192-F1208 HydrophobicContact CG1-CE2 4.41Å; V1192-F1208 HydrophobicContact CG1-CG 3.36Å
1193	T	89.6	Confident	84.1	Confident	8 Å²	8	25.9 Å²	25.9	5%	0.049	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	127.3	167.1	-101.7	0	0	0	0	110.5	D628 T1183 I1191 L1195 F1208 E1209	D628-T1193 WeakPolarHBondContact OD1-CB 3.29Å; D628-T1193 PolarHBondContact OD1-OG1 2.79Å; D628-T1193 WeakPolarHBondContact OD2-CB 3.26Å; T1183-T1193 WeakPolarHBondContact CB-OG1 3.5Å; T1183-T1193 WeakPolarHBondContact CG2-OG1 3.42Å; T1183-T1193 PolarHBondContact OG1-OG1 2.76Å; I1191-T1193 VanDerWaalsContact CG2-N 3.34Å; T1193-L1195 HydrophobicContact CG2-CD2 3.64Å; T1193-L1195 HydrophobicContact CG2-CG 4.06Å; T1193-L1195 PolarHBondContact O-N 2.93Å; T1193-F1208 CarbonylContact O-C 3.5Å; T1193-F1208 WeakPolarHBondContact O-CA 3.41Å; T1193-F1208 WeakPolarHBondContact O-CB 3.33Å; T1193-E1209 HydrophobicContact CG2-CB 4.22Å; T1193-E1209 PolarHBondContact N-O 2.64Å; T1193-E1209 PolarHBondContact O-N 3.08Å
1194	H	91.6	Very high	84.3	Confident	17 Å²	17	26.3 Å²	26.3	8%	0.079	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	122.3	165.2	179	-100.4	0	0	0	111.2	Q782 P1179 N1180 G1182 E1196 T1197 F1208	Q782-H1194 PolarHBondContact NE2-O 2.79Å; P1179-H1194 HydrophobicContact CB-CB 4.39Å; P1179-H1194 HydrophobicContact CG-CB 4.03Å; N1180-H1194 PolarHBondContact O-CD2 3.03Å; N1180-H1194 PolarHBondContact O-CE1 2.85Å; N1180-H1194 VanDerWaalsContact O-CG 3.23Å; N1180-H1194 PolarHBondContact O-ND1 2.75Å; N1180-H1194 PolarHBondContact O-NE2 2.82Å; G1182-H1194 WeakPolarHBondContact O-CB 3.43Å; G1182-H1194 PolarHBondContact O-N 3.01Å; H1194-E1196 PolarHBondContact NE2-O 2.82Å; H1194-T1197 PolarHBondContact NE2-N 2.85Å; H1194-T1197 PolarHBondContact NE2-OG1 2.95Å; H1194-F1208 HydrophobicContact CB-CD1 4.27Å; H1194-F1208 HydrophobicContact CB-CE1 4.1Å; H1194-F1208 AromaticContact CD2-CE1 3.91Å
1195	L	90.9	Very high	84.7	Confident	66 Å²	66	26.4 Å²	26.4	35%	0.346	13%	0.133	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	-46.7	176.9	-66	176.3	0	0	0	112.4	T1193 C1207 E1209 K1218	T1193-L1195 HydrophobicContact CG2-CD2 3.64Å; T1193-L1195 HydrophobicContact CG2-CG 4.06Å; T1193-L1195 PolarHBondContact O-N 2.93Å; L1195-C1207 HydrophobicContact CB-CB 4.27Å; L1195-C1207 WeakPolarHBondContact CB-O 3.44Å; L1195-C1207 PolarHBondContact N-O 2.78Å; L1195-E1209 HydrophobicContact CD1-CB 3.9Å; L1195-E1209 HydrophobicContact CD1-CG 3.94Å; L1195-E1209 HydrophobicContact CD2-CB 4.32Å; L1195-E1209 HydrophobicContact CG-CB 4.16Å; L1195-K1218 HydrophobicContact CD1-CD 4.46Å; L1195-K1218 HydrophobicContact CD1-CG 4.36Å
1196	E	90.1	Very high	85.2	Confident	71 Å²	71	27 Å²	27	33%	0.332	14%	0.135	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	145.9	-178.4	70.8	-145.5	129.7	0	0	110.5	H1194 R1206 C1207 K1218 W1220	H1194-E1196 PolarHBondContact NE2-O 2.82Å; E1196-R1206 CarbonylContact O-C 3.52Å; E1196-R1206 VanDerWaalsContact O-CA 3.29Å; E1196-R1206 WeakPolarHBondContact O-CA 3.06Å; E1196-C1207 HydrophobicContact CG-CB 3.63Å; E1196-C1207 PolarHBondContact O-N 2.93Å; E1196-C1207 WeakPolarHBondContact OE1-CB 3.5Å; E1196-K1218 IonicContact OE1-NZ 2.68Å; E1196-W1220 WeakPolarHBondContact OE1-CH2 3.43Å
1197	T	90.2	Very high	86	Confident	46 Å²	46	26.5 Å²	26.5	28%	0.282	13%	0.134	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	123.8	167.2	-69.4	0	0	0	0	107.8	H1194 E1199 V1204 I1205 R1206	H1194-T1197 PolarHBondContact NE2-N 2.85Å; H1194-T1197 PolarHBondContact NE2-OG1 2.95Å; T1197-E1199 HydrophobicContact CG2-CG 3.39Å; T1197-V1204 HydrophobicContact CG2-CG1 3.58Å; T1197-I1205 CarbonylContact C-O 3.44Å; T1197-I1205 WeakPolarHBondContact CA-O 3.44Å; T1197-R1206 HydrophobicContact CG2-CG 4.23Å
1198	N	86.8	Confident	87.3	Confident	45 Å²	45	26.3 Å²	26.3	24%	0.241	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	101.3	167.6	-63.3	17.5	0	0	0	107	I1205	N1198-I1205 HydrophobicContact CB-CB 4.45Å; N1198-I1205 PolarHBondContact N-O 3.13Å; N1198-I1205 PolarHBondContact O-N 2.9Å
1199	E	86	Confident	89	Confident	116 Å²	116	26.2 Å²	26.2	54%	0.542	13%	0.131	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	114.6	172.8	-51.6	-148.1	137.4	0	0	108.5	T1197 V1204 R1206 L1466	T1197-E1199 HydrophobicContact CG2-CG 3.39Å; E1199-V1204 HydrophobicContact CB-CG2 4.25Å; E1199-V1204 HydrophobicContact CG-CG1 3.95Å; E1199-V1204 HydrophobicContact CG-CG2 4.15Å; E1199-R1206 IonicContact OE1-NH2 3.81Å; E1199-L1466 WeakPolarHBondContact O-CD2 3.36Å
1200	L	88.2	Confident	89.7	Confident	11 Å²	11	22.5 Å²	22.5	6%	0.058	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	157.5	171.8	-47.6	-176.4	0	0	0	108.3	N1202 Y1203 Y1465 L1466	L1200-N1202 PolarHBondContact O-N 3.11Å; L1200-Y1203 WeakPolarHBondContact CB-O 3.32Å; L1200-Y1203 HydrophobicContact CD1-CD2 4.24Å; L1200-Y1203 HydrophobicContact CD1-CE2 3.54Å; L1200-Y1203 HydrophobicContact CG-CE2 4.46Å; L1200-Y1203 PolarHBondContact N-O 3.01Å; L1200-Y1203 VanDerWaalsContact N-O 3.13Å; L1200-Y1203 PolarHBondContact O-N 3.03Å; L1200-Y1465 HydrophobicContact CD1-CE1 4.41Å; L1200-Y1465 HydrophobicContact CD1-CE2 4.1Å; L1200-Y1465 VanDerWaalsContact CD1-OH 3.3Å; L1200-Y1465 WeakPolarHBondContact CD1-OH 3.34Å; L1200-Y1465 HydrophobicContact CD2-CD1 4.23Å; L1200-Y1465 HydrophobicContact CD2-CE1 3.46Å; L1200-Y1465 VanDerWaalsContact CD2-CE1 3.46Å; L1200-L1466 CarbonylContact C-O 3.5Å; L1200-L1466 HydrophobicContact CD2-CD2 3.82Å
1201	A	84.2	Confident	89.9	Confident	9 Å²	9	23.3 Å²	23.3	7%	0.074	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-33.6	-172	0	0	0	0	0	112.8	G1464 Y1465 L1466 K1468	A1201-G1464 WeakPolarHBondContact CB-O 3.5Å; A1201-Y1465 PolarHBondContact N-O 2.76Å; A1201-L1466 WeakPolarHBondContact CA-O 3.45Å; A1201-L1466 PolarHBondContact N-O 3.08Å; A1201-K1468 HydrophobicContact CB-CG 4.12Å; A1201-K1468 WeakPolarHBondContact O-CE 3.29Å; A1201-K1468 VanDerWaalsContact O-CG 3.28Å; A1201-K1468 WeakPolarHBondContact O-CG 3.32Å
1202	N	85.4	Confident	89.8	Confident	26 Å²	26	25.4 Å²	25.4	14%	0.139	13%	0.127	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.3	-14	-172.9	-72.2	-73.7	0	0	0	117.1	L1200 T1225 S1226 V1238 K1468	L1200-N1202 PolarHBondContact O-N 3.11Å; N1202-T1225 PolarHBondContact O-N 2.82Å; N1202-T1225 PolarHBondContact O-OG1 3.31Å; N1202-S1226 VanDerWaalsContact CA-OG 3.25Å; N1202-S1226 WeakPolarHBondContact CA-OG 3.11Å; N1202-S1226 PolarHBondContact O-N 3.32Å; N1202-S1226 PolarHBondContact O-OG 3.34Å; N1202-S1226 WeakPolarHBondContact OD1-CB 3.44Å; N1202-S1226 PolarHBondContact OD1-OG 3.45Å; N1202-V1238 HydrophobicContact CB-CG1 3.38Å; N1202-K1468 WeakPolarHBondContact OD1-CE 3.16Å; N1202-K1468 PolarHBondContact OD1-NZ 2.84Å
1203	Y	88.9	Confident	89.4	Confident	9 Å²	9	28.5 Å²	28.5	4%	0.035	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.8	151.1	175.9	57.1	-98.4	0	0	0	111	L1200 I1205 Q1223 T1225 F1242 R1245	L1200-Y1203 WeakPolarHBondContact CB-O 3.32Å; L1200-Y1203 HydrophobicContact CD1-CD2 4.24Å; L1200-Y1203 HydrophobicContact CD1-CE2 3.54Å; L1200-Y1203 HydrophobicContact CG-CE2 4.46Å; L1200-Y1203 PolarHBondContact N-O 3.01Å; L1200-Y1203 VanDerWaalsContact N-O 3.13Å; L1200-Y1203 PolarHBondContact O-N 3.03Å; Y1203-I1205 HydrophobicContact CD2-CG1 4.05Å; Y1203-I1205 HydrophobicContact CE2-CD1 4.08Å; Y1203-I1205 HydrophobicContact CE2-CG1 4.01Å; Y1203-Q1223 CarbonylContact C-O 3.6Å; Y1203-Q1223 VanDerWaalsContact CA-O 3.22Å; Y1203-Q1223 WeakPolarHBondContact CA-O 3.35Å; Y1203-Q1223 VanDerWaalsContact CB-O 3.26Å; Y1203-Q1223 WeakPolarHBondContact CB-O 3.03Å; Y1203-T1225 PolarHBondContact N-OG1 3.13Å; Y1203-F1242 HydrophobicContact CD1-CB 4.2Å; Y1203-F1242 HydrophobicContact CD1-CD2 4.09Å; Y1203-F1242 HydrophobicContact CD2-CD2 4.17Å; Y1203-F1242 HydrophobicContact CE1-CB 4.46Å; Y1203-F1242 AromaticContact CG-CD2 3.75Å; Y1203-F1242 HydrophobicContact CG-CD2 3.75Å; Y1203-F1242 HydrophobicContact CG-CE2 4.48Å; Y1203-R1245 HydrophobicContact CE2-CG 4.29Å
1204	V	90.6	Very high	89	Confident	10 Å²	10	35 Å²	35	6%	0.061	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	126.3	177.6	-178	0	0	0	0	109.6	T1197 E1199 R1206 Q1223 T1225	T1197-V1204 HydrophobicContact CG2-CG1 3.58Å; E1199-V1204 HydrophobicContact CB-CG2 4.25Å; E1199-V1204 HydrophobicContact CG-CG1 3.95Å; E1199-V1204 HydrophobicContact CG-CG2 4.15Å; V1204-R1206 HydrophobicContact CG1-CG 4.01Å; V1204-Q1223 HydrophobicContact CB-CB 4.43Å; V1204-Q1223 PolarHBondContact N-O 3.13Å; V1204-Q1223 PolarHBondContact O-N 2.75Å; V1204-T1225 HydrophobicContact CG2-CG2 4.05Å
1205	I	91.8	Very high	88.9	Confident	3 Å²	3	38.3 Å²	38.3	2%	0.015	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	127.7	169.4	-51.1	175.1	0	0	0	107.6	T1197 N1198 Y1203 W1220 R1245 L1249	T1197-I1205 CarbonylContact C-O 3.44Å; T1197-I1205 WeakPolarHBondContact CA-O 3.44Å; N1198-I1205 HydrophobicContact CB-CB 4.45Å; N1198-I1205 PolarHBondContact N-O 3.13Å; N1198-I1205 PolarHBondContact O-N 2.9Å; Y1203-I1205 HydrophobicContact CD2-CG1 4.05Å; Y1203-I1205 HydrophobicContact CE2-CD1 4.08Å; Y1203-I1205 HydrophobicContact CE2-CG1 4.01Å; I1205-W1220 HydrophobicContact CG2-CE3 3.79Å; I1205-W1220 HydrophobicContact CG2-CZ3 4.07Å; I1205-R1245 HydrophobicContact CD1-CG 3.86Å; I1205-R1245 VanDerWaalsContact CD1-NE 3.31Å; I1205-L1249 HydrophobicContact CD1-CD1 4.34Å; I1205-L1249 HydrophobicContact CG2-CD1 3.92Å
1206	R	93.2	Very high	88.8	Confident	11 Å²	11	38 Å²	38	4%	0.042	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	134	166.5	-52.4	-171.8	-177.1	90.2	11.3	108.8	W1178 E1196 T1197 E1199 V1204 F1208 H1221 Q1223	W1178-R1206 VanDerWaalsContact CZ2-NH1 3.25Å; E1196-R1206 CarbonylContact O-C 3.52Å; E1196-R1206 VanDerWaalsContact O-CA 3.29Å; E1196-R1206 WeakPolarHBondContact O-CA 3.06Å; T1197-R1206 HydrophobicContact CG2-CG 4.23Å; E1199-R1206 IonicContact OE1-NH2 3.81Å; V1204-R1206 HydrophobicContact CG1-CG 4.01Å; R1206-F1208 HydrophobicContact CB-CE1 4.21Å; R1206-F1208 HydrophobicContact CB-CE2 3.99Å; R1206-F1208 HydrophobicContact CB-CZ 3.64Å; R1206-F1208 HydrophobicContact CG-CZ 4.35Å; R1206-H1221 HydrophobicContact CB-CB 4.36Å; R1206-H1221 PolarHBondContact N-O 3.18Å; R1206-H1221 PolarHBondContact O-N 2.76Å; R1206-Q1223 VanDerWaalsContact NH2-OE1 3.16Å
1207	C	92.9	Very high	88.8	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	129	163.5	-167.7	0	0	0	0	108.6	L1195 E1196 W1220	L1195-C1207 HydrophobicContact CB-CB 4.27Å; L1195-C1207 WeakPolarHBondContact CB-O 3.44Å; L1195-C1207 PolarHBondContact N-O 2.78Å; E1196-C1207 HydrophobicContact CG-CB 3.63Å; E1196-C1207 PolarHBondContact O-N 2.93Å; E1196-C1207 WeakPolarHBondContact OE1-CB 3.5Å; C1207-W1220 HydrophobicContact CB-CD2 4.49Å; C1207-W1220 HydrophobicContact CB-CE3 3.78Å; C1207-W1220 HydrophobicContact CB-CH2 4.04Å; C1207-W1220 HydrophobicContact CB-CZ3 3.55Å
1208	F	92.8	Very high	88.9	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	146.2	165.2	-55.1	-63.4	0	0	0	111.2	W1149 W1178 P1179 V1192 T1193 H1194 R1206 K1218 I1219 H1221	W1149-F1208 HydrophobicContact CH2-CD2 4.24Å; W1178-F1208 HydrophobicContact CB-CE1 4.1Å; W1178-F1208 HydrophobicContact CB-CE2 3.71Å; W1178-F1208 HydrophobicContact CB-CZ 3.43Å; W1178-F1208 VanDerWaalsContact CB-CZ 3.43Å; W1178-F1208 AromaticContact CD1-CZ 3.51Å; W1178-F1208 HydrophobicContact CG-CE1 4.43Å; W1178-F1208 HydrophobicContact CG-CE2 4.07Å; W1178-F1208 AromaticContact CG-CZ 3.57Å; W1178-F1208 HydrophobicContact CG-CZ 3.57Å; P1179-F1208 HydrophobicContact CG-CD1 4.43Å; P1179-F1208 HydrophobicContact CG-CE1 4.19Å; V1192-F1208 HydrophobicContact CG1-CB 3.65Å; V1192-F1208 HydrophobicContact CG1-CD1 3.47Å; V1192-F1208 VanDerWaalsContact CG1-CD1 3.47Å; V1192-F1208 HydrophobicContact CG1-CD2 3.86Å; V1192-F1208 HydrophobicContact CG1-CE1 4.13Å; V1192-F1208 HydrophobicContact CG1-CE2 4.41Å; V1192-F1208 HydrophobicContact CG1-CG 3.36Å; T1193-F1208 CarbonylContact O-C 3.5Å; T1193-F1208 WeakPolarHBondContact O-CA 3.41Å; T1193-F1208 WeakPolarHBondContact O-CB 3.33Å; H1194-F1208 HydrophobicContact CB-CD1 4.27Å; H1194-F1208 HydrophobicContact CB-CE1 4.1Å; H1194-F1208 AromaticContact CD2-CE1 3.91Å; R1206-F1208 HydrophobicContact CB-CE1 4.21Å; R1206-F1208 HydrophobicContact CB-CE2 3.99Å; R1206-F1208 HydrophobicContact CB-CZ 3.64Å; R1206-F1208 HydrophobicContact CG-CZ 4.35Å; F1208-K1218 CarbonylContact O-C 3.51Å; F1208-K1218 WeakPolarHBondContact O-CA 2.96Å; F1208-I1219 HydrophobicContact CB-CB 4.27Å; F1208-I1219 PolarHBondContact N-O 3.49Å; F1208-I1219 PolarHBondContact O-N 3.15Å; F1208-H1221 HydrophobicContact CD2-CB 3.74Å; F1208-H1221 HydrophobicContact CE2-CB 3.34Å; F1208-H1221 AromaticContact CE2-CG 3.73Å; F1208-H1221 HydrophobicContact CZ-CB 4.41Å
1209	E	93.3	Very high	89.2	Confident	23 Å²	23	36.7 Å²	36.7	11%	0.107	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	155.4	155.7	-125.2	176.9	158	0	0	109.3	I1191 T1193 L1195 R1211 H1216 R1217	I1191-E1209 WeakPolarHBondContact CG2-O 3.09Å; T1193-E1209 HydrophobicContact CG2-CB 4.22Å; T1193-E1209 PolarHBondContact N-O 2.64Å; T1193-E1209 PolarHBondContact O-N 3.08Å; L1195-E1209 HydrophobicContact CD1-CB 3.9Å; L1195-E1209 HydrophobicContact CD1-CG 3.94Å; L1195-E1209 HydrophobicContact CD2-CB 4.32Å; L1195-E1209 HydrophobicContact CG-CB 4.16Å; E1209-R1211 HydrophobicContact CB-CG 4.22Å; E1209-R1211 VanDerWaalsContact CG-CD 3.5Å; E1209-R1211 HydrophobicContact CG-CG 4.1Å; E1209-R1211 WeakPolarHBondContact OE1-CD 3.24Å; E1209-R1211 IonicContact OE1-CZ 2.95Å; E1209-R1211 IonicContact OE1-NE 2.91Å; E1209-R1211 IonicContact OE1-NH1 2.87Å; E1209-R1211 PolarHBondContact OE1-NH1 2.84Å; E1209-R1211 IonicContact OE2-CZ 2.69Å; E1209-R1211 IonicContact OE2-NH1 3.74Å; E1209-R1211 PolarHBondContact OE2-NH1 3.23Å; E1209-H1216 IonicContact OE1-CE1 3.76Å; E1209-H1216 IonicContact OE1-CG 3.45Å; E1209-H1216 IonicContact OE1-ND1 2.83Å; E1209-H1216 PolarHBondContact OE1-ND1 3.32Å; E1209-R1217 CarbonylContact C-O 3.15Å
1210	L	92.1	Very high	89.6	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	102.5	-175.7	-168.1	108.9	0	0	0	109.3	W1149 I1152 W1153 L1190 I1191 H1216 R1217 I1219	W1149-L1210 HydrophobicContact CE3-CD1 3.46Å; W1149-L1210 VanDerWaalsContact CE3-CD1 3.46Å; W1149-L1210 HydrophobicContact CZ3-CD1 3.65Å; I1152-L1210 HydrophobicContact CG2-CD1 4.14Å; I1152-L1210 HydrophobicContact CG2-CD2 4.09Å; W1153-L1210 HydrophobicContact CB-CD2 4.49Å; W1153-L1210 HydrophobicContact CD2-CD2 4.4Å; W1153-L1210 HydrophobicContact CE3-CD2 3.38Å; W1153-L1210 HydrophobicContact CE3-CG 3.97Å; W1153-L1210 HydrophobicContact CZ3-CD2 3.87Å; W1153-L1210 HydrophobicContact CZ3-CG 4.3Å; W1153-L1210 WeakPolarHBondContact CZ3-O 3.21Å; L1190-L1210 HydrophobicContact CD2-CD1 4.27Å; I1191-L1210 VanDerWaalsContact CG2-CA 3.42Å; I1191-L1210 WeakPolarHBondContact O-CD1 3.43Å; L1210-H1216 CarbonylContact O-C 3.58Å; L1210-H1216 WeakPolarHBondContact O-CA 2.92Å; L1210-R1217 HydrophobicContact CB-CB 4.37Å; L1210-R1217 HydrophobicContact CD2-CB 4.42Å; L1210-R1217 PolarHBondContact N-O 3.48Å; L1210-R1217 PolarHBondContact O-N 2.77Å; L1210-I1219 HydrophobicContact CB-CD1 3.83Å; L1210-I1219 HydrophobicContact CB-CG1 3.41Å; L1210-I1219 VanDerWaalsContact CB-CG1 3.41Å; L1210-I1219 HydrophobicContact CD1-CD1 4.36Å; L1210-I1219 HydrophobicContact CD1-CG1 3.93Å; L1210-I1219 HydrophobicContact CD2-CD1 3.69Å; L1210-I1219 HydrophobicContact CD2-CG1 4.1Å; L1210-I1219 HydrophobicContact CG-CD1 4.17Å; L1210-I1219 HydrophobicContact CG-CG1 4.01Å
1211	R	90.2	Very high	89.9	Confident	18 Å²	18	33.1 Å²	33.1	7%	0.068	15%	0.15	C	C	.	.			trans	-131.8	89.2	-157.5	-32	-156.6	-31.9	-161.2	-12.7	119.2	V626 I627 D628 H631 I1191 E1209 E1215 H1216	V626-R1211 PolarHBondContact O-NE 3.12Å; V626-R1211 PolarHBondContact O-NH2 3.17Å; I627-R1211 WeakPolarHBondContact CG2-O 3.48Å; I627-R1211 PolarHBondContact O-NH2 2.65Å; D628-R1211 WeakPolarHBondContact OD2-CD 3.33Å; D628-R1211 WeakPolarHBondContact OD2-CG 3.26Å; D628-R1211 IonicContact OD2-NE 3.74Å; H631-R1211 WeakPolarHBondContact CB-O 3.09Å; H631-R1211 VanDerWaalsContact CE1-C 3.41Å; H631-R1211 VanDerWaalsContact CG-C 3.41Å; H631-R1211 PolarHBondContact ND1-N 2.66Å; H631-R1211 VanDerWaalsContact ND1-N 3.19Å; H631-R1211 PolarHBondContact ND1-O 2.59Å; I1191-R1211 HydrophobicContact CD1-CB 4.19Å; I1191-R1211 HydrophobicContact CD1-CG 4.32Å; I1191-R1211 HydrophobicContact CG1-CB 4.04Å; I1191-R1211 HydrophobicContact CG1-CG 4.33Å; I1191-R1211 VanDerWaalsContact CG1-N 3.33Å; I1191-R1211 HydrophobicContact CG2-CG 4.38Å; E1209-R1211 HydrophobicContact CB-CG 4.22Å; E1209-R1211 VanDerWaalsContact CG-CD 3.5Å; E1209-R1211 HydrophobicContact CG-CG 4.1Å; E1209-R1211 WeakPolarHBondContact OE1-CD 3.24Å; E1209-R1211 IonicContact OE1-CZ 2.95Å; E1209-R1211 IonicContact OE1-NE 2.91Å; E1209-R1211 IonicContact OE1-NH1 2.87Å; E1209-R1211 PolarHBondContact OE1-NH1 2.84Å; E1209-R1211 IonicContact OE2-CZ 2.69Å; E1209-R1211 IonicContact OE2-NH1 3.74Å; E1209-R1211 PolarHBondContact OE2-NH1 3.23Å; R1211-E1215 CarbonylContact C-O 3.56Å; R1211-E1215 WeakPolarHBondContact CA-O 3.4Å; R1211-E1215 WeakPolarHBondContact CB-O 3.37Å; R1211-H1216 HydrophobicContact CB-CB 3.56Å; R1211-H1216 VanDerWaalsContact CD-CB 3.4Å; R1211-H1216 HydrophobicContact CG-CB 3.36Å
1212	K	86.5	Confident	90.4	Very high	44 Å²	44	32.7 Å²	32.7	19%	0.191	15%	0.147	C	C	.	.			trans	-87.7	130.5	-175.6	118.2	161.5	-35.4	76.3	0	118	H631 W1153 K1189 K1214 E1215	H631-K1212 WeakPolarHBondContact CD2-CA 3.34Å; H631-K1212 WeakPolarHBondContact CD2-CB 3.4Å; H631-K1212 PolarHBondContact CE1-N 3.46Å; H631-K1212 VanDerWaalsContact CE1-N 3.31Å; H631-K1212 PolarHBondContact ND1-N 3.22Å; H631-K1212 VanDerWaalsContact NE2-CA 3.31Å; H631-K1212 WeakPolarHBondContact NE2-CA 3.17Å; H631-K1212 WeakPolarHBondContact NE2-CB 3.16Å; H631-K1212 PolarHBondContact NE2-NZ 2.84Å; W1153-K1212 HydrophobicContact CD2-CB 4.12Å; W1153-K1212 HydrophobicContact CE3-CB 4.21Å; W1153-K1212 HydrophobicContact CH2-CB 3.54Å; W1153-K1212 HydrophobicContact CH2-CG 3.99Å; W1153-K1212 VanDerWaalsContact CH2-N 3.3Å; W1153-K1212 HydrophobicContact CZ2-CB 3.38Å; W1153-K1212 HydrophobicContact CZ2-CD 3.81Å; W1153-K1212 HydrophobicContact CZ2-CG 3.36Å; W1153-K1212 HydrophobicContact CZ3-CB 3.94Å; K1189-K1212 PolarHBondContact O-NZ 3.33Å; K1212-K1214 CarbonylContact O-C 3.47Å; K1212-K1214 PolarHBondContact O-N 3.45Å; K1212-E1215 PolarHBondContact N-O 3.31Å; K1212-E1215 WeakPolarHBondContact O-CB 3.17Å; K1212-E1215 PolarHBondContact O-N 3.22Å
1213	D	81.8	Confident	90.7	Very high	66 Å²	66	31.7 Å²	31.7	35%	0.353	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.7	-64	171.5	-66.4	-95.7	0	0	0	113.2	I627 K1189	I627-D1213 WeakPolarHBondContact CD1-O 3.41Å; I627-D1213 WeakPolarHBondContact CG1-O 3.16Å; K1189-D1213 WeakPolarHBondContact CD-OD1 3.47Å; K1189-D1213 WeakPolarHBondContact CD-OD2 3.24Å; K1189-D1213 WeakPolarHBondContact CE-OD1 3.41Å; K1189-D1213 WeakPolarHBondContact CG-OD2 3.42Å; K1189-D1213 IonicContact NZ-OD1 2.94Å; K1189-D1213 PolarHBondContact NZ-OD1 2.88Å; K1189-D1213 IonicContact NZ-OD2 2.73Å
1214	K	81	Confident	90.7	Very high	144 Å²	144	31.3 Å²	31.3	63%	0.626	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	-146.8	23.3	165.8	-56.3	-175.1	-174	179.2	0	114.1	L604 L625 K1212	L604-K1214 HydrophobicContact CD1-CD 4.16Å; L604-K1214 VanDerWaalsContact CD1-CE 3.46Å; L625-K1214 WeakPolarHBondContact CB-O 2.93Å; L625-K1214 CarbonylContact O-C 3.6Å; L625-K1214 WeakPolarHBondContact O-CA 3.25Å; K1212-K1214 CarbonylContact O-C 3.47Å; K1212-K1214 PolarHBondContact O-N 3.45Å
1215	E	89.2	Confident	90.5	Very high	87 Å²	87	32.3 Å²	32.3	41%	0.407	15%	0.146	S	C	.	.			trans	-108	156.4	176.3	-76.8	-171.8	-149.5	0	0	111	W1153 R1211 K1212 R1217	W1153-E1215 HydrophobicContact CH2-CB 3.64Å; W1153-E1215 WeakPolarHBondContact CH2-OE2 3.5Å; W1153-E1215 HydrophobicContact CZ2-CB 4.06Å; W1153-E1215 WeakPolarHBondContact CZ2-OE2 2.93Å; R1211-E1215 CarbonylContact C-O 3.56Å; R1211-E1215 WeakPolarHBondContact CA-O 3.4Å; R1211-E1215 WeakPolarHBondContact CB-O 3.37Å; K1212-E1215 PolarHBondContact N-O 3.31Å; K1212-E1215 WeakPolarHBondContact O-CB 3.17Å; K1212-E1215 PolarHBondContact O-N 3.22Å; E1215-R1217 IonicContact OE2-CZ 2.7Å; E1215-R1217 IonicContact OE2-NE 2.99Å; E1215-R1217 PolarHBondContact OE2-NE 2.92Å; E1215-R1217 IonicContact OE2-NH2 3.15Å; E1215-R1217 PolarHBondContact OE2-NH2 2.9Å
1216	H	88.9	Confident	90	Very high	58 Å²	58	33 Å²	33	27%	0.269	15%	0.15	S	C	.	.			trans	-143.7	156.3	161	73.2	-152.2	0	0	0	114.8	K623 L625 E1209 L1210 R1211	K623-H1216 PolarHBondContact O-CE1 3.33Å; L625-H1216 HydrophobicContact CB-CB 4.47Å; L625-H1216 HydrophobicContact CG-CB 4.17Å; E1209-H1216 IonicContact OE1-CE1 3.76Å; E1209-H1216 IonicContact OE1-CG 3.45Å; E1209-H1216 IonicContact OE1-ND1 2.83Å; E1209-H1216 PolarHBondContact OE1-ND1 3.32Å; L1210-H1216 CarbonylContact O-C 3.58Å; L1210-H1216 WeakPolarHBondContact O-CA 2.92Å; R1211-H1216 HydrophobicContact CB-CB 3.56Å; R1211-H1216 VanDerWaalsContact CD-CB 3.4Å; R1211-H1216 HydrophobicContact CG-CB 3.36Å
1217	R	91.4	Very high	89.3	Confident	40 Å²	40	33.2 Å²	33.2	15%	0.151	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	140.2	-175.2	-50.4	-176.7	-175.1	176.3	4.9	107.3	W1153 N1156 E1209 L1210 E1215 I1219	W1153-R1217 HydrophobicContact CH2-CG 4.21Å; W1153-R1217 VanDerWaalsContact CH2-NE 3.33Å; W1153-R1217 HydrophobicContact CZ3-CG 4.1Å; W1153-R1217 PolarHBondContact O-NH1 3.27Å; N1156-R1217 WeakPolarHBondContact OD1-CD 3.16Å; N1156-R1217 PolarHBondContact OD1-NH1 3.21Å; E1209-R1217 CarbonylContact C-O 3.15Å; L1210-R1217 HydrophobicContact CB-CB 4.37Å; L1210-R1217 HydrophobicContact CD2-CB 4.42Å; L1210-R1217 PolarHBondContact N-O 3.48Å; L1210-R1217 PolarHBondContact O-N 2.77Å; E1215-R1217 IonicContact OE2-CZ 2.7Å; E1215-R1217 IonicContact OE2-NE 2.99Å; E1215-R1217 PolarHBondContact OE2-NE 2.92Å; E1215-R1217 IonicContact OE2-NH2 3.15Å; E1215-R1217 PolarHBondContact OE2-NH2 2.9Å; R1217-I1219 HydrophobicContact CB-CD1 4.3Å
1218	K	92	Very high	88.2	Confident	95 Å²	95	34.8 Å²	34.8	41%	0.413	16%	0.162	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	139.7	167	-84.8	-169.2	161.8	-137	0	109.4	N1158 L1195 E1196 F1208	N1158-K1218 PolarHBondContact ND2-O 2.62Å; L1195-K1218 HydrophobicContact CD1-CD 4.46Å; L1195-K1218 HydrophobicContact CD1-CG 4.36Å; E1196-K1218 IonicContact OE1-NZ 2.68Å; F1208-K1218 CarbonylContact O-C 3.51Å; F1208-K1218 WeakPolarHBondContact O-CA 2.96Å
1219	I	93.6	Very high	86.4	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	111.9	-177.9	-43.4	-64	0	0	0	108.3	W1149 I1152 T1157 N1158 I1160 F1208 L1210 R1217	W1149-I1219 HydrophobicContact CZ3-CG2 4.33Å; I1152-I1219 HydrophobicContact CG2-CD1 4.04Å; I1152-I1219 HydrophobicContact CG2-CG2 4.39Å; T1157-I1219 WeakPolarHBondContact O-CD1 3.18Å; N1158-I1219 CarbonylContact O-C 3.53Å; N1158-I1219 VanDerWaalsContact O-CA 3.32Å; N1158-I1219 WeakPolarHBondContact O-CA 3.29Å; I1160-I1219 HydrophobicContact CD1-CG2 3.6Å; I1160-I1219 HydrophobicContact CG1-CG2 3.76Å; F1208-I1219 HydrophobicContact CB-CB 4.27Å; F1208-I1219 PolarHBondContact N-O 3.49Å; F1208-I1219 PolarHBondContact O-N 3.15Å; L1210-I1219 HydrophobicContact CB-CD1 3.83Å; L1210-I1219 HydrophobicContact CB-CG1 3.41Å; L1210-I1219 VanDerWaalsContact CB-CG1 3.41Å; L1210-I1219 HydrophobicContact CD1-CD1 4.36Å; L1210-I1219 HydrophobicContact CD1-CG1 3.93Å; L1210-I1219 HydrophobicContact CD2-CD1 3.69Å; L1210-I1219 HydrophobicContact CD2-CG1 4.1Å; L1210-I1219 HydrophobicContact CG-CD1 4.17Å; L1210-I1219 HydrophobicContact CG-CG1 4.01Å; R1217-I1219 HydrophobicContact CB-CD1 4.3Å
1220	W	94	Very high	84.4	Confident	53 Å²	53	37.8 Å²	37.8	20%	0.201	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	117.8	173.3	-64.4	105.1	0	0	0	109.4	N1158 V1159 I1160 E1196 I1205 C1207 L1222 L1249	N1158-W1220 PolarHBondContact O-N 2.98Å; V1159-W1220 CarbonylContact C-O 3.54Å; V1159-W1220 WeakPolarHBondContact CA-O 3.19Å; V1159-W1220 HydrophobicContact CG2-CB 4.4Å; I1160-W1220 PolarHBondContact N-O 2.77Å; E1196-W1220 WeakPolarHBondContact OE1-CH2 3.43Å; I1205-W1220 HydrophobicContact CG2-CE3 3.79Å; I1205-W1220 HydrophobicContact CG2-CZ3 4.07Å; C1207-W1220 HydrophobicContact CB-CD2 4.49Å; C1207-W1220 HydrophobicContact CB-CE3 3.78Å; C1207-W1220 HydrophobicContact CB-CH2 4.04Å; C1207-W1220 HydrophobicContact CB-CZ3 3.55Å; W1220-L1222 HydrophobicContact CB-CD1 3.9Å; W1220-L1249 HydrophobicContact CB-CB 4.16Å; W1220-L1249 HydrophobicContact CB-CD1 4.27Å; W1220-L1249 HydrophobicContact CD2-CB 4.28Å; W1220-L1249 HydrophobicContact CD2-CD1 3.88Å; W1220-L1249 HydrophobicContact CD2-CD2 4.14Å; W1220-L1249 HydrophobicContact CD2-CG 4.34Å; W1220-L1249 HydrophobicContact CE3-CD1 3.83Å; W1220-L1249 HydrophobicContact CE3-CD2 4.48Å; W1220-L1249 HydrophobicContact CG-CB 3.85Å; W1220-L1249 HydrophobicContact CG-CD1 4.09Å; W1220-L1249 HydrophobicContact CG-CG 4.4Å; W1220-L1249 HydrophobicContact CH2-CD2 4.48Å; W1220-L1249 HydrophobicContact CZ2-CD2 4.15Å; W1220-L1249 HydrophobicContact CZ3-CD1 4.43Å
1221	H	94.2	Very high	83	Confident	0 Å²	0	44 Å²	44	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	102.5	174.1	173	-78.8	0	0	0	109	I1160 Y1177 W1178 R1206 F1208	I1160-H1221 WeakPolarHBondContact O-CA 3.05Å; Y1177-H1221 AromaticContact CZ-CD2 3.93Å; Y1177-H1221 AromaticContact CZ-NE2 3.76Å; Y1177-H1221 PolarHBondContact OH-CD2 2.82Å; Y1177-H1221 PolarHBondContact OH-NE2 2.81Å; Y1177-H1221 VanDerWaalsContact OH-NE2 3.12Å; W1178-H1221 AromaticContact CE3-NE2 3.58Å; W1178-H1221 AromaticContact CZ3-NE2 3.67Å; R1206-H1221 HydrophobicContact CB-CB 4.36Å; R1206-H1221 PolarHBondContact N-O 3.18Å; R1206-H1221 PolarHBondContact O-N 2.76Å; F1208-H1221 HydrophobicContact CD2-CB 3.74Å; F1208-H1221 HydrophobicContact CE2-CB 3.34Å; F1208-H1221 AromaticContact CE2-CG 3.73Å; F1208-H1221 HydrophobicContact CZ-CB 4.41Å
1222	L	94	Very high	81.9	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	115.8	178.3	-61.6	91.5	0	0	0	109	V1159 I1160 M1162 W1220 F1242 R1245 V1246 L1249	V1159-L1222 HydrophobicContact CG1-CD1 3.64Å; I1160-L1222 PolarHBondContact O-N 3.22Å; M1162-L1222 PolarHBondContact N-O 2.59Å; W1220-L1222 HydrophobicContact CB-CD1 3.9Å; L1222-F1242 HydrophobicContact CB-CE2 3.58Å; L1222-F1242 HydrophobicContact CB-CZ 3.8Å; L1222-F1242 HydrophobicContact CD2-CE2 4.48Å; L1222-R1245 HydrophobicContact CD2-CB 4.1Å; L1222-R1245 HydrophobicContact CD2-CG 3.85Å; L1222-V1246 HydrophobicContact CB-CG2 4.37Å; L1222-V1246 HydrophobicContact CD1-CG2 4.33Å; L1222-V1246 HydrophobicContact CD2-CB 4.5Å; L1222-V1246 HydrophobicContact CD2-CG2 3.82Å; L1222-V1246 HydrophobicContact CG-CG2 4.42Å; L1222-L1249 HydrophobicContact CD1-CD1 4.26Å; L1222-L1249 HydrophobicContact CD2-CD1 4.1Å; L1222-L1249 HydrophobicContact CG-CD1 4.34Å
1223	Q	93	Very high	81.1	Confident	5 Å²	5	43.4 Å²	43.4	2%	0.023	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	113.2	177.9	-178.5	171.2	22	0	0	111.1	M1162 S1164 L1166 Y1203 V1204 R1206 T1225	M1162-Q1223 HydrophobicContact CB-CB 4.18Å; M1162-Q1223 HydrophobicContact CB-CG 4.26Å; M1162-Q1223 HydrophobicContact CG-CB 4.39Å; M1162-Q1223 HydrophobicContact CG-CG 3.92Å; M1162-Q1223 WeakPolarHBondContact O-CA 3.24Å; M1162-Q1223 HydrophobicContact SD-CB 4.45Å; M1162-Q1223 HydrophobicContact SD-CG 3.88Å; M1162-Q1223 PolarHBondContact SD-NE2 2.59Å; S1164-Q1223 PolarHBondContact O-NE2 3.12Å; L1166-Q1223 VanDerWaalsContact N-NE2 3.16Å; Y1203-Q1223 CarbonylContact C-O 3.6Å; Y1203-Q1223 VanDerWaalsContact CA-O 3.22Å; Y1203-Q1223 WeakPolarHBondContact CA-O 3.35Å; Y1203-Q1223 VanDerWaalsContact CB-O 3.26Å; Y1203-Q1223 WeakPolarHBondContact CB-O 3.03Å; V1204-Q1223 HydrophobicContact CB-CB 4.43Å; V1204-Q1223 PolarHBondContact N-O 3.13Å; V1204-Q1223 PolarHBondContact O-N 2.75Å; R1206-Q1223 VanDerWaalsContact NH2-OE1 3.16Å; Q1223-T1225 HydrophobicContact CG-CG2 4.03Å; Q1223-T1225 PolarHBondContact O-N 3.22Å
1224	Y	89.3	Confident	80.4	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	105.5	174.5	-167.9	-101.1	0	0	0	110.5	M1162 S1226 W1227 V1238 F1239 F1242	M1162-Y1224 PolarHBondContact O-N 2.61Å; Y1224-S1226 WeakPolarHBondContact CE1-O 3.47Å; Y1224-W1227 HydrophobicContact CD1-CB 3.92Å; Y1224-W1227 HydrophobicContact CD1-CE3 4.02Å; Y1224-W1227 HydrophobicContact CE1-CB 3.95Å; Y1224-W1227 HydrophobicContact CE1-CD2 4.48Å; Y1224-W1227 AromaticContact CE1-CE3 3.75Å; Y1224-W1227 HydrophobicContact CE1-CE3 3.75Å; Y1224-V1238 HydrophobicContact CE2-CB 4.48Å; Y1224-V1238 HydrophobicContact CE2-CG1 3.88Å; Y1224-V1238 WeakPolarHBondContact OH-CB 3.3Å; Y1224-F1239 HydrophobicContact CD2-CD2 4.38Å; Y1224-F1239 HydrophobicContact CE1-CD2 4.49Å; Y1224-F1239 HydrophobicContact CE2-CB 4.16Å; Y1224-F1239 HydrophobicContact CE2-CD2 4.21Å; Y1224-F1239 PolarHBondContact OH-N 3.17Å; Y1224-F1242 HydrophobicContact CD2-CB 3.72Å; Y1224-F1242 AromaticContact CD2-CD1 3.95Å; Y1224-F1242 HydrophobicContact CD2-CD1 3.95Å; Y1224-F1242 AromaticContact CD2-CD2 3.72Å; Y1224-F1242 HydrophobicContact CD2-CD2 3.72Å; Y1224-F1242 HydrophobicContact CD2-CE1 4.47Å; Y1224-F1242 HydrophobicContact CD2-CE2 4.24Å; Y1224-F1242 AromaticContact CD2-CG 3.54Å; Y1224-F1242 HydrophobicContact CD2-CG 3.54Å; Y1224-F1242 HydrophobicContact CE2-CB 3.94Å; Y1224-F1242 HydrophobicContact CE2-CG 4.27Å; Y1224-F1242 HydrophobicContact CG-CD1 4.49Å; Y1224-F1242 HydrophobicContact CG-CD2 4.45Å; Y1224-F1242 HydrophobicContact CG-CG 4.4Å
1225	T	86.2	Confident	80.1	Confident	32 Å²	32	40 Å²	40	20%	0.196	20%	0.197	C	C	.	.			trans	-92.1	-5.7	-174.5	55	0	0	0	0	113.8	K1165 N1202 Y1203 V1204 Q1223	K1165-T1225 WeakPolarHBondContact CE-O 3.47Å; K1165-T1225 WeakPolarHBondContact CG-O 3.28Å; N1202-T1225 PolarHBondContact O-N 2.82Å; N1202-T1225 PolarHBondContact O-OG1 3.31Å; Y1203-T1225 PolarHBondContact N-OG1 3.13Å; V1204-T1225 HydrophobicContact CG2-CG2 4.05Å; Q1223-T1225 HydrophobicContact CG-CG2 4.03Å; Q1223-T1225 PolarHBondContact O-N 3.22Å
1226	S	81	Confident	79.8	Confident	16 Å²	16	36 Å²	36	11%	0.112	18%	0.178	C	C	.	.			trans	-114	31.9	-173.9	-63.5	0	0	0	0	114.5	N1202 Y1224 K1468	N1202-S1226 VanDerWaalsContact CA-OG 3.25Å; N1202-S1226 WeakPolarHBondContact CA-OG 3.11Å; N1202-S1226 PolarHBondContact O-N 3.32Å; N1202-S1226 PolarHBondContact O-OG 3.34Å; N1202-S1226 WeakPolarHBondContact OD1-CB 3.44Å; N1202-S1226 PolarHBondContact OD1-OG 3.45Å; Y1224-S1226 WeakPolarHBondContact CE1-O 3.47Å; S1226-K1468 WeakPolarHBondContact OG-CE 3.36Å; S1226-K1468 PolarHBondContact OG-NZ 2.87Å
1227	W	77.2	Confident	79.6	Confident	16 Å²	16	33.2 Å²	33.2	6%	0.061	17%	0.165	C	C	.	.	P	Polyproline II helix	trans	-79.2	127.8	161.3	-155.2	-87.3	0	0	0	107.3	Y1224 E1231 V1232 F1239 R1267 F1288	Y1224-W1227 HydrophobicContact CD1-CB 3.92Å; Y1224-W1227 HydrophobicContact CD1-CE3 4.02Å; Y1224-W1227 HydrophobicContact CE1-CB 3.95Å; Y1224-W1227 HydrophobicContact CE1-CD2 4.48Å; Y1224-W1227 AromaticContact CE1-CE3 3.75Å; Y1224-W1227 HydrophobicContact CE1-CE3 3.75Å; W1227-E1231 PolarHBondContact NE1-O 2.96Å; W1227-V1232 HydrophobicContact CZ2-CB 4.2Å; W1227-V1232 HydrophobicContact CZ2-CG1 4Å; W1227-F1239 HydrophobicContact CE3-CD2 4.4Å; W1227-F1239 AromaticContact CZ3-CD2 3.92Å; W1227-F1239 HydrophobicContact CZ3-CD2 3.92Å; W1227-F1239 HydrophobicContact CZ3-CE2 4.02Å; W1227-F1239 HydrophobicContact CZ3-CG 4.24Å; W1227-F1239 HydrophobicContact CZ3-CZ 4.4Å; W1227-R1267 VanDerWaalsContact CD1-NH2 3.31Å; W1227-R1267 VanDerWaalsContact CD2-NH2 3.35Å; W1227-R1267 VanDerWaalsContact CE3-CZ 3.48Å; W1227-F1288 AromaticContact CH2-CD1 3.55Å; W1227-F1288 HydrophobicContact CH2-CD1 3.55Å; W1227-F1288 AromaticContact CH2-CE1 3.42Å; W1227-F1288 HydrophobicContact CH2-CE1 3.42Å; W1227-F1288 VanDerWaalsContact CH2-CE1 3.42Å; W1227-F1288 HydrophobicContact CH2-CG 4.29Å; W1227-F1288 HydrophobicContact CH2-CZ 4.09Å; W1227-F1288 HydrophobicContact CZ2-CD1 4.35Å; W1227-F1288 HydrophobicContact CZ2-CE1 4.49Å; W1227-F1288 HydrophobicContact CZ3-CD1 4.24Å; W1227-F1288 AromaticContact CZ3-CE1 3.62Å; W1227-F1288 HydrophobicContact CZ3-CE1 3.62Å; W1227-F1288 HydrophobicContact CZ3-CZ 4.03Å
1228	P	69.9	Low	79.3	Confident	34 Å²	34	32.2 Å²	32.2	22%	0.221	16%	0.164	C	C	.	.	P	Polyproline II helix	trans	-70.6	143	173.9	31.8	-34.5	0	0	0	108.7	E1231 V1232	P1228-E1231 HydrophobicContact CB-CB 4.23Å; P1228-E1231 HydrophobicContact CG-CB 3.98Å; P1228-E1231 PolarHBondContact O-N 2.83Å; P1228-V1232 VanDerWaalsContact CG-O 3.23Å; P1228-V1232 WeakPolarHBondContact CG-O 3.4Å
1229	D	55.4	Low	79	Confident	20 Å²	20	28.8 Å²	28.8	11%	0.107	15%	0.149	C	C	.	.	S	Bend	trans	-87.2	137.9	-165.4	-45.9	-59	0	0	0	109.6	P510 K1165 E1168 L1169 E1231	P510-D1229 HydrophobicContact CB-CB 3.9Å; P510-D1229 HydrophobicContact CG-CB 3.82Å; K1165-D1229 IonicContact NZ-OD1 3.67Å; K1165-D1229 PolarHBondContact NZ-OD1 2.82Å; K1165-D1229 IonicContact NZ-OD2 2.75Å; K1165-D1229 PolarHBondContact NZ-OD2 2.91Å; E1168-D1229 VanDerWaalsContact C-OD2 3.31Å; E1168-D1229 HydrophobicContact CB-CB 4.24Å; E1168-D1229 WeakPolarHBondContact CB-OD1 3.41Å; E1168-D1229 VanDerWaalsContact CG-OD1 3.32Å; E1168-D1229 WeakPolarHBondContact CG-OD1 3.29Å; E1168-D1229 VanDerWaalsContact O-OD2 3.06Å; L1169-D1229 HydrophobicContact CB-CB 3.54Å; L1169-D1229 HydrophobicContact CD1-CB 3.86Å; L1169-D1229 HydrophobicContact CG-CB 3.66Å; L1169-D1229 WeakPolarHBondContact CG-OD2 3.09Å; D1229-E1231 PolarHBondContact O-N 3.34Å; D1229-E1231 VanDerWaalsContact O-N 3.12Å
1230	Q	51.6	Low	78.6	Confident	65 Å²	65	29.5 Å²	29.5	30%	0.304	15%	0.153	S	C	.	.	S	Bend	trans	66.7	-23.5	-161.8	-56.5	-174.6	-12.5	0	0	116.3	M507 Q508 P510	M507-Q1230 PolarHBondContact SD-NE2 3Å; M507-Q1230 VanDerWaalsContact SD-NE2 3.36Å; Q508-Q1230 WeakPolarHBondContact O-CG 3.37Å; Q508-Q1230 PolarHBondContact O-NE2 3.35Å; P510-Q1230 HydrophobicContact CG-CG 4.2Å
1231	E	62.5	Low	78.2	Confident	130 Å²	130	27.8 Å²	27.8	61%	0.607	15%	0.147	S	C	*	.	S	Bend	trans	-103.6	-167.9	-175.1	-62.7	-174.9	171.8	0	0	113.7	W1227 P1228 D1229	W1227-E1231 PolarHBondContact NE1-O 2.96Å; P1228-E1231 HydrophobicContact CB-CB 4.23Å; P1228-E1231 HydrophobicContact CG-CB 3.98Å; P1228-E1231 PolarHBondContact O-N 2.83Å; D1229-E1231 PolarHBondContact O-N 3.34Å; D1229-E1231 VanDerWaalsContact O-N 3.12Å
1232	V	66.7	Low	77.9	Confident	31 Å²	31	27.8 Å²	27.8	19%	0.188	15%	0.147	C	C	.	.			trans	-114.4	152.1	164.8	-62	0	0	0	0	109.8	W1227 P1228 T1234 E1284 Q1285 F1288	W1227-V1232 HydrophobicContact CZ2-CB 4.2Å; W1227-V1232 HydrophobicContact CZ2-CG1 4Å; P1228-V1232 VanDerWaalsContact CG-O 3.23Å; P1228-V1232 WeakPolarHBondContact CG-O 3.4Å; V1232-T1234 PolarHBondContact O-N 2.87Å; V1232-E1284 HydrophobicContact CG1-CB 3.98Å; V1232-E1284 HydrophobicContact CG2-CB 4.13Å; V1232-Q1285 HydrophobicContact CG1-CG 3.93Å; V1232-F1288 HydrophobicContact CB-CB 4.01Å; V1232-F1288 HydrophobicContact CB-CD2 4.09Å; V1232-F1288 HydrophobicContact CB-CG 4.15Å; V1232-F1288 HydrophobicContact CG1-CB 4.17Å; V1232-F1288 HydrophobicContact CG2-CB 4.18Å; V1232-F1288 HydrophobicContact CG2-CD2 4.35Å
1233	S	69.6	Low	77.6	Confident	19 Å²	19	31.5 Å²	31.5	13%	0.133	17%	0.167	C	C	.	.			trans	-61.4	127.3	-177.5	-161.9	0	0	0	0	111	Y1235 F1288	S1233-Y1235 PolarHBondContact O-N 2.81Å; S1233-Y1235 PolarHBondContact OG-O 2.63Å; S1233-F1288 WeakPolarHBondContact O-CD2 3.1Å; S1233-F1288 WeakPolarHBondContact O-CE2 3.45Å
1234	T	67.7	Low	77.3	Confident	88 Å²	88	33.3 Å²	33.3	54%	0.54	17%	0.173	S	C	.	.	S	Bend	trans	-61.8	-21.6	-173.1	-22.7	0	0	0	0	113	V1232 L1414	V1232-T1234 PolarHBondContact O-N 2.87Å; T1234-L1414 HydrophobicContact CG2-CD1 4.05Å; T1234-L1414 HydrophobicContact CG2-CD2 3.67Å; T1234-L1414 HydrophobicContact CG2-CG 4.42Å
1235	Y	75.2	Confident	77.1	Confident	50 Å²	50	35 Å²	35	20%	0.196	18%	0.179	C	C	.	.			trans	-133.8	133.4	170.6	-54.4	-77.8	0	0	0	109.7	S1233 T1237 L1414 Q1638	S1233-Y1235 PolarHBondContact O-N 2.81Å; S1233-Y1235 PolarHBondContact OG-O 2.63Å; Y1235-T1237 WeakPolarHBondContact CB-OG1 3.13Å; Y1235-T1237 PolarHBondContact O-N 2.88Å; Y1235-L1414 HydrophobicContact CD1-CD2 4.29Å; Y1235-L1414 HydrophobicContact CE1-CD2 3.5Å; Y1235-L1414 HydrophobicContact CE2-CD2 4.07Å; Y1235-L1414 WeakPolarHBondContact OH-CD2 3.36Å; Y1235-Q1638 HydrophobicContact CD1-CG 3.9Å; Y1235-Q1638 HydrophobicContact CD2-CB 3.9Å; Y1235-Q1638 HydrophobicContact CD2-CG 3.91Å; Y1235-Q1638 HydrophobicContact CE1-CB 4.44Å; Y1235-Q1638 HydrophobicContact CE1-CG 3.73Å; Y1235-Q1638 HydrophobicContact CE2-CB 3.57Å; Y1235-Q1638 HydrophobicContact CE2-CG 3.76Å; Y1235-Q1638 HydrophobicContact CG-CB 4.45Å; Y1235-Q1638 VanDerWaalsContact CG-CD 3.41Å; Y1235-Q1638 HydrophobicContact CG-CG 3.95Å
1236	P	83.2	Confident	77.2	Confident	3 Å²	3	34 Å²	34	2%	0.019	17%	0.173	C	C	.	.	S	Bend	trans	-77.3	-6.9	179.3	33.6	-35.4	0	0	0	113	V1238 F1239 L1240 F1288 T1291 A1292 E1295	P1236-V1238 VanDerWaalsContact C-N 3.34Å; P1236-V1238 PolarHBondContact O-N 2.75Å; P1236-F1239 CarbonylContact O-C 3.56Å; P1236-F1239 WeakPolarHBondContact O-CA 3.48Å; P1236-F1239 WeakPolarHBondContact O-CB 3.43Å; P1236-F1239 PolarHBondContact O-N 3.18Å; P1236-L1240 HydrophobicContact CB-CD1 4.34Å; P1236-L1240 HydrophobicContact CB-CG 4.4Å; P1236-L1240 HydrophobicContact CG-CD1 4.44Å; P1236-L1240 WeakPolarHBondContact O-CG 3.39Å; P1236-L1240 PolarHBondContact O-N 3.37Å; P1236-F1288 HydrophobicContact CB-CE2 3.83Å; P1236-F1288 HydrophobicContact CB-CZ 3.87Å; P1236-T1291 HydrophobicContact CG-CG2 3.85Å; P1236-A1292 HydrophobicContact CB-CB 3.65Å; P1236-A1292 HydrophobicContact CG-CB 4.37Å; P1236-E1295 HydrophobicContact CG-CB 3.93Å; P1236-E1295 VanDerWaalsContact CG-CD 3.49Å; P1236-E1295 HydrophobicContact CG-CG 4.25Å
1237	T	83.6	Confident	77.5	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-40.5	-56.6	-177.7	-28.5	0	0	0	0	113.1	Y1235 F1239 L1240 M1241 E1295 K1634 L1635 Q1638	Y1235-T1237 WeakPolarHBondContact CB-OG1 3.13Å; Y1235-T1237 PolarHBondContact O-N 2.88Å; T1237-F1239 PolarHBondContact O-N 3.32Å; T1237-L1240 PolarHBondContact O-N 2.62Å; T1237-M1241 WeakPolarHBondContact O-CG 3.37Å; T1237-M1241 PolarHBondContact O-N 2.9Å; T1237-E1295 WeakPolarHBondContact CA-OE1 3.19Å; T1237-E1295 PolarHBondContact N-OE1 3.4Å; T1237-E1295 VanDerWaalsContact N-OE1 3.08Å; T1237-K1634 HydrophobicContact CG2-CD 3.93Å; T1237-K1634 HydrophobicContact CG2-CG 4.34Å; T1237-L1635 HydrophobicContact CG2-CD2 3.69Å; T1237-L1635 HydrophobicContact CG2-CG 3.98Å; T1237-Q1638 VanDerWaalsContact OG1-CD 3.27Å; T1237-Q1638 PolarHBondContact OG1-NE2 2.89Å; T1237-Q1638 PolarHBondContact OG1-OE1 3.43Å
1238	V	85	Confident	77.8	Confident	19 Å²	19	37.7 Å²	37.7	12%	0.115	21%	0.206	C	C	.	.	H	α-helix	trans	-68.5	-36.8	-175.7	-175.5	0	0	0	0	111.1	N1202 Y1224 P1236 F1242 L1635	N1202-V1238 HydrophobicContact CB-CG1 3.38Å; Y1224-V1238 HydrophobicContact CE2-CB 4.48Å; Y1224-V1238 HydrophobicContact CE2-CG1 3.88Å; Y1224-V1238 WeakPolarHBondContact OH-CB 3.3Å; P1236-V1238 VanDerWaalsContact C-N 3.34Å; P1236-V1238 PolarHBondContact O-N 2.75Å; V1238-F1242 WeakPolarHBondContact O-CB 3.42Å; V1238-F1242 PolarHBondContact O-N 3.12Å; V1238-L1635 HydrophobicContact CG2-CD2 3.42Å; V1238-L1635 VanDerWaalsContact CG2-CD2 3.42Å
1239	F	85.5	Confident	78.5	Confident	24 Å²	24	37.1 Å²	37.1	11%	0.105	20%	0.201	C	C	.	.	H	α-helix	trans	-72.5	-34	177.1	-177.5	-110.4	0	0	0	112.2	L1163 Y1224 W1227 P1236 T1237 F1242 L1243 F1288	L1163-F1239 HydrophobicContact CD2-CE2 4.08Å; Y1224-F1239 HydrophobicContact CD2-CD2 4.38Å; Y1224-F1239 HydrophobicContact CE1-CD2 4.49Å; Y1224-F1239 HydrophobicContact CE2-CB 4.16Å; Y1224-F1239 HydrophobicContact CE2-CD2 4.21Å; Y1224-F1239 PolarHBondContact OH-N 3.17Å; W1227-F1239 HydrophobicContact CE3-CD2 4.4Å; W1227-F1239 AromaticContact CZ3-CD2 3.92Å; W1227-F1239 HydrophobicContact CZ3-CD2 3.92Å; W1227-F1239 HydrophobicContact CZ3-CE2 4.02Å; W1227-F1239 HydrophobicContact CZ3-CG 4.24Å; W1227-F1239 HydrophobicContact CZ3-CZ 4.4Å; P1236-F1239 CarbonylContact O-C 3.56Å; P1236-F1239 WeakPolarHBondContact O-CA 3.48Å; P1236-F1239 WeakPolarHBondContact O-CB 3.43Å; P1236-F1239 PolarHBondContact O-N 3.18Å; T1237-F1239 PolarHBondContact O-N 3.32Å; F1239-F1242 HydrophobicContact CD2-CD1 4.28Å; F1239-F1242 HydrophobicContact CE2-CD1 4.31Å; F1239-F1242 PolarHBondContact O-N 3.13Å; F1239-L1243 HydrophobicContact CD1-CD1 3.92Å; F1239-L1243 HydrophobicContact CD1-CG 4.32Å; F1239-L1243 HydrophobicContact CE1-CD1 3.47Å; F1239-L1243 VanDerWaalsContact CE1-CD1 3.47Å; F1239-L1243 HydrophobicContact CE1-CG 3.99Å; F1239-L1243 HydrophobicContact CE2-CG 4.38Å; F1239-L1243 HydrophobicContact CZ-CD1 3.91Å; F1239-L1243 HydrophobicContact CZ-CD2 4.12Å; F1239-L1243 HydrophobicContact CZ-CG 4.01Å; F1239-L1243 WeakPolarHBondContact O-CB 3.1Å; F1239-L1243 WeakPolarHBondContact O-CG 3.08Å; F1239-L1243 PolarHBondContact O-N 2.66Å; F1239-F1288 HydrophobicContact CB-CE1 4.4Å; F1239-F1288 HydrophobicContact CB-CZ 3.92Å; F1239-F1288 AromaticContact CD1-CE1 3.48Å; F1239-F1288 HydrophobicContact CD1-CE1 3.48Å; F1239-F1288 VanDerWaalsContact CD1-CE1 3.48Å; F1239-F1288 AromaticContact CD1-CZ 3.84Å; F1239-F1288 HydrophobicContact CD1-CZ 3.84Å; F1239-F1288 AromaticContact CE1-CE1 3.87Å; F1239-F1288 HydrophobicContact CE1-CE1 3.87Å; F1239-F1288 HydrophobicContact CG-CE1 4Å; F1239-F1288 HydrophobicContact CG-CZ 4.04Å
1240	L	85.8	Confident	80	Confident	15 Å²	15	37.8 Å²	37.8	8%	0.079	21%	0.206	C	C	.	.	H	α-helix	trans	-68.8	-40	173	-70.8	173.8	0	0	0	111.6	P1236 T1237 L1243 R1244 A1292 E1295	P1236-L1240 HydrophobicContact CB-CD1 4.34Å; P1236-L1240 HydrophobicContact CB-CG 4.4Å; P1236-L1240 HydrophobicContact CG-CD1 4.44Å; P1236-L1240 WeakPolarHBondContact O-CG 3.39Å; P1236-L1240 PolarHBondContact O-N 3.37Å; T1237-L1240 PolarHBondContact O-N 2.62Å; L1240-L1243 PolarHBondContact O-N 3.02Å; L1240-R1244 WeakPolarHBondContact O-CG 3.18Å; L1240-R1244 PolarHBondContact O-N 3.06Å; L1240-A1292 HydrophobicContact CD2-CB 4.24Å; L1240-E1295 HydrophobicContact CD1-CB 3.93Å; L1240-E1295 HydrophobicContact CD1-CG 3.67Å
1241	M	86	Confident	81.4	Confident	16 Å²	16	37.3 Å²	37.3	8%	0.079	21%	0.208	C	C	.	.	H	α-helix	trans	-60.9	-44.6	170.4	-69.6	175.1	69.2	0	0	111.4	T1237 L1243 R1244 R1245 Q1631 L1635	T1237-M1241 WeakPolarHBondContact O-CG 3.37Å; T1237-M1241 PolarHBondContact O-N 2.9Å; M1241-L1243 PolarHBondContact O-N 3.1Å; M1241-R1244 WeakPolarHBondContact O-CB 3.32Å; M1241-R1244 PolarHBondContact O-N 2.94Å; M1241-R1245 PolarHBondContact O-N 3.28Å; M1241-Q1631 HydrophobicContact CG-CB 4.37Å; M1241-Q1631 HydrophobicContact CG-CG 4.5Å; M1241-Q1631 HydrophobicContact SD-CB 3.82Å; M1241-L1635 HydrophobicContact CE-CD1 4.48Å; M1241-L1635 HydrophobicContact SD-CD1 3.77Å
1242	F	87.7	Confident	82.1	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-60.4	-43.7	174	175.5	-95.6	0	0	0	112.6	V1161 L1163 Y1203 L1222 Y1224 V1238 F1239 R1245 V1246	V1161-F1242 HydrophobicContact CG1-CE1 3.56Å; V1161-F1242 HydrophobicContact CG1-CZ 3.72Å; L1163-F1242 HydrophobicContact CD2-CE1 3.77Å; L1163-F1242 HydrophobicContact CD2-CZ 4.28Å; Y1203-F1242 HydrophobicContact CD1-CB 4.2Å; Y1203-F1242 HydrophobicContact CD1-CD2 4.09Å; Y1203-F1242 HydrophobicContact CD2-CD2 4.17Å; Y1203-F1242 HydrophobicContact CE1-CB 4.46Å; Y1203-F1242 AromaticContact CG-CD2 3.75Å; Y1203-F1242 HydrophobicContact CG-CD2 3.75Å; Y1203-F1242 HydrophobicContact CG-CE2 4.48Å; L1222-F1242 HydrophobicContact CB-CE2 3.58Å; L1222-F1242 HydrophobicContact CB-CZ 3.8Å; L1222-F1242 HydrophobicContact CD2-CE2 4.48Å; Y1224-F1242 HydrophobicContact CD2-CB 3.72Å; Y1224-F1242 AromaticContact CD2-CD1 3.95Å; Y1224-F1242 HydrophobicContact CD2-CD1 3.95Å; Y1224-F1242 AromaticContact CD2-CD2 3.72Å; Y1224-F1242 HydrophobicContact CD2-CD2 3.72Å; Y1224-F1242 HydrophobicContact CD2-CE1 4.47Å; Y1224-F1242 HydrophobicContact CD2-CE2 4.24Å; Y1224-F1242 AromaticContact CD2-CG 3.54Å; Y1224-F1242 HydrophobicContact CD2-CG 3.54Å; Y1224-F1242 HydrophobicContact CE2-CB 3.94Å; Y1224-F1242 HydrophobicContact CE2-CG 4.27Å; Y1224-F1242 HydrophobicContact CG-CD1 4.49Å; Y1224-F1242 HydrophobicContact CG-CD2 4.45Å; Y1224-F1242 HydrophobicContact CG-CG 4.4Å; V1238-F1242 WeakPolarHBondContact O-CB 3.42Å; V1238-F1242 PolarHBondContact O-N 3.12Å; F1239-F1242 HydrophobicContact CD2-CD1 4.28Å; F1239-F1242 HydrophobicContact CE2-CD1 4.31Å; F1239-F1242 PolarHBondContact O-N 3.13Å; F1242-R1245 WeakPolarHBondContact O-CB 3.38Å; F1242-R1245 PolarHBondContact O-N 3.38Å; F1242-R1245 VanDerWaalsContact O-N 3.14Å; F1242-V1246 HydrophobicContact CD1-CG2 4.21Å; F1242-V1246 HydrophobicContact CE1-CG2 3.9Å; F1242-V1246 HydrophobicContact CZ-CG2 4.21Å; F1242-V1246 WeakPolarHBondContact O-CG2 3.26Å; F1242-V1246 PolarHBondContact O-N 3.28Å
1243	L	87.5	Confident	82.7	Confident	79 Å²	79	42.4 Å²	42.4	41%	0.414	24%	0.239	S	C	.	.	H	α-helix	trans	-65.5	-37.5	175.8	-75.9	179.6	0	0	0	112.7	F1239 L1240 M1241 R1245 V1246 G1247	F1239-L1243 HydrophobicContact CD1-CD1 3.92Å; F1239-L1243 HydrophobicContact CD1-CG 4.32Å; F1239-L1243 HydrophobicContact CE1-CD1 3.47Å; F1239-L1243 VanDerWaalsContact CE1-CD1 3.47Å; F1239-L1243 HydrophobicContact CE1-CG 3.99Å; F1239-L1243 HydrophobicContact CE2-CG 4.38Å; F1239-L1243 HydrophobicContact CZ-CD1 3.91Å; F1239-L1243 HydrophobicContact CZ-CD2 4.12Å; F1239-L1243 HydrophobicContact CZ-CG 4.01Å; F1239-L1243 WeakPolarHBondContact O-CB 3.1Å; F1239-L1243 WeakPolarHBondContact O-CG 3.08Å; F1239-L1243 PolarHBondContact O-N 2.66Å; L1240-L1243 PolarHBondContact O-N 3.02Å; M1241-L1243 PolarHBondContact O-N 3.1Å; L1243-R1245 VanDerWaalsContact C-N 3.31Å; L1243-V1246 PolarHBondContact O-N 2.96Å; L1243-G1247 PolarHBondContact O-N 3.32Å
1244	R	86.1	Confident	83.2	Confident	42 Å²	42	42 Å²	42	16%	0.158	24%	0.236	C	C	.	.	H	α-helix	trans	-58.6	-46.1	169.2	-70.9	171.5	-165.9	-173.5	0.9	110	L1240 M1241 G1247 T1248 G1300 N1301 T1302 D1628	L1240-R1244 WeakPolarHBondContact O-CG 3.18Å; L1240-R1244 PolarHBondContact O-N 3.06Å; M1241-R1244 WeakPolarHBondContact O-CB 3.32Å; M1241-R1244 PolarHBondContact O-N 2.94Å; R1244-G1247 CarbonylContact O-C 3.4Å; R1244-G1247 WeakPolarHBondContact O-CA 3.49Å; R1244-G1247 PolarHBondContact O-N 3.01Å; R1244-G1247 VanDerWaalsContact O-N 3.1Å; R1244-T1248 WeakPolarHBondContact O-CG2 3.47Å; R1244-T1248 PolarHBondContact O-N 2.84Å; R1244-G1300 PolarHBondContact NH2-O 3.37Å; R1244-N1301 PolarHBondContact NH1-OD1 3.47Å; R1244-T1302 PolarHBondContact NH1-OG1 2.82Å; R1244-D1628 IonicContact NH1-OD2 3.62Å; R1244-D1628 PolarHBondContact NH1-OD2 3.24Å; R1244-D1628 VanDerWaalsContact NH1-OD2 3.08Å
1245	R	86.5	Confident	84.2	Confident	35 Å²	35	38.6 Å²	38.6	13%	0.132	22%	0.218	C	C	.	.	H	α-helix	trans	-62.5	-44.8	178.9	-164.2	65.4	177.3	171.9	-3.1	112.5	Y1203 I1205 L1222 M1241 F1242 L1243 G1247 T1248 L1249 E1624	Y1203-R1245 HydrophobicContact CE2-CG 4.29Å; I1205-R1245 HydrophobicContact CD1-CG 3.86Å; I1205-R1245 VanDerWaalsContact CD1-NE 3.31Å; L1222-R1245 HydrophobicContact CD2-CB 4.1Å; L1222-R1245 HydrophobicContact CD2-CG 3.85Å; M1241-R1245 PolarHBondContact O-N 3.28Å; F1242-R1245 WeakPolarHBondContact O-CB 3.38Å; F1242-R1245 PolarHBondContact O-N 3.38Å; F1242-R1245 VanDerWaalsContact O-N 3.14Å; L1243-R1245 VanDerWaalsContact C-N 3.31Å; R1245-G1247 VanDerWaalsContact C-N 3.29Å; R1245-G1247 PolarHBondContact O-N 2.8Å; R1245-T1248 WeakPolarHBondContact CA-OG1 3.39Å; R1245-T1248 PolarHBondContact O-N 3.43Å; R1245-T1248 PolarHBondContact O-OG1 2.83Å; R1245-L1249 HydrophobicContact CG-CD1 4.32Å; R1245-L1249 WeakPolarHBondContact O-CG 3.36Å; R1245-L1249 PolarHBondContact O-N 3.29Å; R1245-E1624 WeakPolarHBondContact CD-OE1 3.5Å; R1245-E1624 IonicContact CZ-OE1 3.11Å; R1245-E1624 IonicContact NE-OE1 3.24Å; R1245-E1624 PolarHBondContact NE-OE1 3.05Å; R1245-E1624 IonicContact NH1-OE1 3.12Å; R1245-E1624 IonicContact NH2-OE1 3Å
1246	V	88.3	Confident	85	Confident	11 Å²	11	36.9 Å²	36.9	7%	0.067	21%	0.213	C	C	.	.	H	α-helix	trans	-52.4	-49.2	170	170.9	0	0	0	0	110	V1159 V1161 L1222 F1242 L1243 L1249 T1250 I1257	V1159-V1246 HydrophobicContact CG1-CG1 4.22Å; V1161-V1246 HydrophobicContact CG1-CG2 4.21Å; V1161-V1246 HydrophobicContact CG2-CG1 3.87Å; V1161-V1246 HydrophobicContact CG2-CG2 3.95Å; L1222-V1246 HydrophobicContact CB-CG2 4.37Å; L1222-V1246 HydrophobicContact CD1-CG2 4.33Å; L1222-V1246 HydrophobicContact CD2-CB 4.5Å; L1222-V1246 HydrophobicContact CD2-CG2 3.82Å; L1222-V1246 HydrophobicContact CG-CG2 4.42Å; F1242-V1246 HydrophobicContact CD1-CG2 4.21Å; F1242-V1246 HydrophobicContact CE1-CG2 3.9Å; F1242-V1246 HydrophobicContact CZ-CG2 4.21Å; F1242-V1246 WeakPolarHBondContact O-CG2 3.26Å; F1242-V1246 PolarHBondContact O-N 3.28Å; L1243-V1246 PolarHBondContact O-N 2.96Å; V1246-L1249 PolarHBondContact O-N 2.7Å; V1246-T1250 WeakPolarHBondContact O-CB 3.38Å; V1246-T1250 PolarHBondContact O-N 3.39Å; V1246-T1250 VanDerWaalsContact O-N 3.09Å; V1246-T1250 PolarHBondContact O-OG1 3.41Å; V1246-I1257 HydrophobicContact CG1-CD1 4.5Å
1247	G	86.2	Confident	85.5	Confident	45 Å²	45	37.7 Å²	37.7	46%	0.464	22%	0.217	S	C	.	.	H	α-helix	trans	-57.2	-50.2	176.3	0	0	0	0	0	113.2	L1243 R1244 R1245 L1249 T1250	L1243-G1247 PolarHBondContact O-N 3.32Å; R1244-G1247 CarbonylContact O-C 3.4Å; R1244-G1247 WeakPolarHBondContact O-CA 3.49Å; R1244-G1247 PolarHBondContact O-N 3.01Å; R1244-G1247 VanDerWaalsContact O-N 3.1Å; R1245-G1247 VanDerWaalsContact C-N 3.29Å; R1245-G1247 PolarHBondContact O-N 2.8Å; G1247-L1249 PolarHBondContact O-N 2.68Å; G1247-T1250 PolarHBondContact O-N 2.8Å; G1247-T1250 VanDerWaalsContact O-N 3.15Å
1248	T	84.4	Confident	86	Confident	65 Å²	65	37.7 Å²	37.7	40%	0.399	22%	0.217	S	C	.	.	H	α-helix	trans	-65.1	-24.1	-179.8	58.9	0	0	0	0	114.5	R1244 R1245	R1244-T1248 WeakPolarHBondContact O-CG2 3.47Å; R1244-T1248 PolarHBondContact O-N 2.84Å; R1245-T1248 WeakPolarHBondContact CA-OG1 3.39Å; R1245-T1248 PolarHBondContact O-N 3.43Å; R1245-T1248 PolarHBondContact O-OG1 2.83Å
1249	L	84.5	Confident	86.3	Confident	22 Å²	22	38.2 Å²	38.2	12%	0.115	22%	0.22	C	C	.	.	H	α-helix	trans	-96.8	-1.5	177.7	-63.5	-175.9	0	0	0	113.2	V1159 I1205 W1220 L1222 R1245 V1246 G1247 P1251	V1159-L1249 WeakPolarHBondContact CG2-O 3.38Å; I1205-L1249 HydrophobicContact CD1-CD1 4.34Å; I1205-L1249 HydrophobicContact CG2-CD1 3.92Å; W1220-L1249 HydrophobicContact CB-CB 4.16Å; W1220-L1249 HydrophobicContact CB-CD1 4.27Å; W1220-L1249 HydrophobicContact CD2-CB 4.28Å; W1220-L1249 HydrophobicContact CD2-CD1 3.88Å; W1220-L1249 HydrophobicContact CD2-CD2 4.14Å; W1220-L1249 HydrophobicContact CD2-CG 4.34Å; W1220-L1249 HydrophobicContact CE3-CD1 3.83Å; W1220-L1249 HydrophobicContact CE3-CD2 4.48Å; W1220-L1249 HydrophobicContact CG-CB 3.85Å; W1220-L1249 HydrophobicContact CG-CD1 4.09Å; W1220-L1249 HydrophobicContact CG-CG 4.4Å; W1220-L1249 HydrophobicContact CH2-CD2 4.48Å; W1220-L1249 HydrophobicContact CZ2-CD2 4.15Å; W1220-L1249 HydrophobicContact CZ3-CD1 4.43Å; L1222-L1249 HydrophobicContact CD1-CD1 4.26Å; L1222-L1249 HydrophobicContact CD2-CD1 4.1Å; L1222-L1249 HydrophobicContact CG-CD1 4.34Å; R1245-L1249 HydrophobicContact CG-CD1 4.32Å; R1245-L1249 WeakPolarHBondContact O-CG 3.36Å; R1245-L1249 PolarHBondContact O-N 3.29Å; V1246-L1249 PolarHBondContact O-N 2.7Å; G1247-L1249 PolarHBondContact O-N 2.68Å; L1249-P1251 WeakPolarHBondContact O-CD 3.34Å
1250	T	86.3	Confident	86.4	Confident	34 Å²	34	37.1 Å²	37.1	21%	0.209	22%	0.215	C	C	.	.			trans	-87	114.6	177	-61.5	0	0	0	0	110.5	V1246 G1247 C1254 I1257	V1246-T1250 WeakPolarHBondContact O-CB 3.38Å; V1246-T1250 PolarHBondContact O-N 3.39Å; V1246-T1250 VanDerWaalsContact O-N 3.09Å; V1246-T1250 PolarHBondContact O-OG1 3.41Å; G1247-T1250 PolarHBondContact O-N 2.8Å; G1247-T1250 VanDerWaalsContact O-N 3.15Å; T1250-C1254 WeakPolarHBondContact CG2-SG 3.28Å; T1250-I1257 HydrophobicContact CG2-CD1 3.93Å; T1250-I1257 HydrophobicContact CG2-CG1 4.25Å
1251	P	81.1	Confident	86.3	Confident	55 Å²	55	37.1 Å²	37.1	36%	0.357	22%	0.216	S	C	.	.			trans	-66.6	144.5	172	-17.3	31.9	0	0	0	111.2	N1158 L1249 D1253 C1254	N1158-P1251 HydrophobicContact CB-CG 3.81Å; L1249-P1251 WeakPolarHBondContact O-CD 3.34Å; P1251-D1253 VanDerWaalsContact C-N 3.25Å; P1251-D1253 PolarHBondContact O-N 2.82Å; P1251-C1254 HydrophobicContact CB-CB 4.42Å; P1251-C1254 WeakPolarHBondContact O-CB 3.34Å; P1251-C1254 PolarHBondContact O-N 3.18Å; P1251-C1254 PolarHBondContact O-SG 3.31Å
1252	N	77.4	Confident	86.2	Confident	119 Å²	119	36.5 Å²	36.5	64%	0.636	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-41.6	177.8	-64.3	-23.7	0	0	0	112.2	C1254	N1252-C1254 VanDerWaalsContact C-N 3.28Å; N1252-C1254 PolarHBondContact O-N 3.39Å
1253	D	78.2	Confident	85.5	Confident	150 Å²	150	36.8 Å²	36.8	80%	0.802	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.8	19.8	-176.4	-54.5	-51.4	0	0	0	113.7	P1251	P1251-D1253 VanDerWaalsContact C-N 3.25Å; P1251-D1253 PolarHBondContact O-N 2.82Å
1254	C	80.8	Confident	84.6	Confident	11 Å²	11	33.3 Å²	33.3	7%	0.074	20%	0.199	C	C	.	.			trans	-76.5	150.1	174.7	73.6	0	0	0	0	112.7	N1158 T1250 P1251 N1252	N1158-C1254 HydrophobicContact CB-CB 3.82Å; N1158-C1254 VanDerWaalsContact OD1-CB 3.27Å; N1158-C1254 WeakPolarHBondContact OD1-CB 3.43Å; T1250-C1254 WeakPolarHBondContact CG2-SG 3.28Å; P1251-C1254 HydrophobicContact CB-CB 4.42Å; P1251-C1254 WeakPolarHBondContact O-CB 3.34Å; P1251-C1254 PolarHBondContact O-N 3.18Å; P1251-C1254 PolarHBondContact O-SG 3.31Å; N1252-C1254 VanDerWaalsContact C-N 3.28Å; N1252-C1254 PolarHBondContact O-N 3.39Å
1255	G	88.8	Confident	83.8	Confident	15 Å²	15	31.4 Å²	31.4	16%	0.155	19%	0.192	C	C	.	.			trans	-68.5	-173	162	0	0	0	0	0	112.7	Q1155 N1156 I1257	Q1155-G1255 WeakPolarHBondContact O-CA 3.17Å; N1156-G1255 WeakPolarHBondContact O-CA 3.49Å; N1156-G1255 PolarHBondContact O-N 3.36Å; G1255-I1257 PolarHBondContact O-N 3.04Å
1256	P	93.1	Very high	82.6	Confident	15 Å²	15	29.8 Å²	29.8	10%	0.097	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-46.2	132.6	177.8	13.2	-29.8	0	0	0	113.5	K1132 A1133 I1135 Q1155 T1157 V1258	K1132-P1256 WeakPolarHBondContact O-CB 3.41Å; A1133-P1256 WeakPolarHBondContact O-CA 3.22Å; I1135-P1256 HydrophobicContact CB-CB 4.39Å; I1135-P1256 HydrophobicContact CD1-CB 3.82Å; I1135-P1256 HydrophobicContact CD1-CG 3.42Å; I1135-P1256 VanDerWaalsContact CD1-CG 3.42Å; I1135-P1256 HydrophobicContact CG1-CB 3.71Å; I1135-P1256 HydrophobicContact CG1-CG 3.84Å; Q1155-P1256 HydrophobicContact CB-CG 3.93Å; Q1155-P1256 WeakPolarHBondContact O-CD 3.34Å; T1157-P1256 WeakPolarHBondContact CB-O 3.16Å; T1157-P1256 WeakPolarHBondContact CG2-O 3.28Å; T1157-P1256 PolarHBondContact OG1-O 3.31Å; P1256-V1258 PolarHBondContact O-N 2.83Å
1257	I	92.5	Very high	81	Confident	20 Å²	20	31.4 Å²	31.4	10%	0.103	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	122.3	166.4	-60.6	174.1	0	0	0	107.5	A1133 Y1134 I1135 V1159 V1161 V1246 T1250 G1255 V1259	A1133-I1257 PolarHBondContact O-N 3.2Å; Y1134-I1257 CarbonylContact C-O 3.53Å; Y1134-I1257 WeakPolarHBondContact CA-O 3.18Å; Y1134-I1257 WeakPolarHBondContact CB-O 3.42Å; Y1134-I1257 HydrophobicContact CD1-CB 3.86Å; Y1134-I1257 HydrophobicContact CD1-CG2 4.35Å; Y1134-I1257 HydrophobicContact CE1-CB 4.3Å; Y1134-I1257 HydrophobicContact CE1-CD1 4.12Å; I1135-I1257 PolarHBondContact N-O 2.81Å; V1159-I1257 HydrophobicContact CB-CG1 4.49Å; V1159-I1257 HydrophobicContact CB-CG2 4.27Å; V1159-I1257 HydrophobicContact CG1-CG2 4.29Å; V1161-I1257 HydrophobicContact CG2-CG2 3.57Å; V1246-I1257 HydrophobicContact CG1-CD1 4.5Å; T1250-I1257 HydrophobicContact CG2-CD1 3.93Å; T1250-I1257 HydrophobicContact CG2-CG1 4.25Å; G1255-I1257 PolarHBondContact O-N 3.04Å; I1257-V1259 HydrophobicContact CG2-CG2 4.1Å
1258	V	93.6	Very high	78.9	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	120.1	179.4	167.8	0	0	0	0	108.8	I1135 T1137 F1148 M1151 I1152 T1157 V1159 I1160 V1161 P1256	I1135-V1258 HydrophobicContact CB-CG2 3.9Å; I1135-V1258 HydrophobicContact CD1-CG2 4.22Å; I1135-V1258 HydrophobicContact CG2-CG2 4.29Å; T1137-V1258 HydrophobicContact CG2-CG1 3.65Å; F1148-V1258 HydrophobicContact CE2-CG1 3.63Å; F1148-V1258 HydrophobicContact CZ-CG1 4.06Å; M1151-V1258 HydrophobicContact CE-CG1 4.13Å; M1151-V1258 HydrophobicContact CE-CG2 4.33Å; I1152-V1258 HydrophobicContact CD1-CB 3.84Å; I1152-V1258 HydrophobicContact CD1-CG1 3.88Å; I1152-V1258 HydrophobicContact CD1-CG2 3.61Å; T1157-V1258 HydrophobicContact CG2-CB 3.95Å; T1157-V1258 HydrophobicContact CG2-CG2 3.73Å; T1157-V1258 WeakPolarHBondContact OG1-CG2 3.22Å; V1159-V1258 PolarHBondContact O-N 2.97Å; I1160-V1258 CarbonylContact C-O 3.48Å; I1160-V1258 WeakPolarHBondContact CA-O 3.35Å; I1160-V1258 HydrophobicContact CG2-CG1 4.45Å; V1161-V1258 PolarHBondContact N-O 2.73Å; P1256-V1258 PolarHBondContact O-N 2.83Å
1259	V	91.3	Very high	77.2	Confident	29 Å²	29	31 Å²	31	18%	0.176	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	126	-177.7	-173.4	0	0	0	0	108.4	Y1134 I1135 T1137 V1161 L1163 I1257	Y1134-V1259 HydrophobicContact CD1-CG2 4Å; I1135-V1259 PolarHBondContact O-N 3.43Å; T1137-V1259 PolarHBondContact N-O 2.69Å; V1161-V1259 HydrophobicContact CB-CG1 4.41Å; V1161-V1259 HydrophobicContact CB-CG2 4.25Å; V1161-V1259 HydrophobicContact CG2-CG2 4.46Å; L1163-V1259 HydrophobicContact CD1-CG1 3.5Å; L1163-V1259 HydrophobicContact CG-CG1 4.23Å; I1257-V1259 HydrophobicContact CG2-CG2 4.1Å
1260	H	89	Confident	75.1	Confident	2 Å²	2	33.2 Å²	33.2	1%	0.009	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139	151	172.6	79.1	90.4	0	0	0	111.2	T1137 V1161 M1162 L1163 C1174 Y1177	T1137-H1260 HydrophobicContact CG2-CB 3.86Å; T1137-H1260 WeakPolarHBondContact O-CA 2.72Å; T1137-H1260 WeakPolarHBondContact O-CB 3.35Å; V1161-H1260 PolarHBondContact O-N 3.29Å; M1162-H1260 WeakPolarHBondContact CB-NE2 3.34Å; M1162-H1260 VanDerWaalsContact CG-CE1 3.4Å; M1162-H1260 WeakPolarHBondContact CG-CE1 3.46Å; L1163-H1260 WeakPolarHBondContact CB-O 3.36Å; L1163-H1260 PolarHBondContact N-O 3.42Å; C1174-H1260 PolarHBondContact SG-CE1 2.86Å; Y1177-H1260 AromaticContact CE1-CE1 3.64Å; Y1177-H1260 AromaticContact CE1-NE2 3.44Å; Y1177-H1260 WeakPolarHBondContact CE1-NE2 3.09Å; Y1177-H1260 AromaticContact CZ-NE2 3.49Å; Y1177-H1260 PolarHBondContact OH-CD2 2.89Å; Y1177-H1260 PolarHBondContact OH-NE2 2.96Å
1261	C	83.7	Confident	73.7	Confident	14 Å²	14	38.7 Å²	38.7	10%	0.095	22%	0.215	C	C	.	.	S	Bend	trans	-115.7	-103.5	162.1	51.8	0	0	0	0	106.4	A1139 L1163 S1164 G1264	A1139-C1261 VanDerWaalsContact CB-O 3.32Å; A1139-C1261 WeakPolarHBondContact CB-O 3.15Å; L1163-C1261 HydrophobicContact CB-CB 4.08Å; S1164-C1261 PolarHBondContact OG-O 3.04Å; C1261-G1264 PolarHBondContact SG-N 2.92Å; C1261-G1264 VanDerWaalsContact SG-N 3.42Å
1262	S	82.3	Confident	73.1	Confident	3 Å²	3	36.6 Å²	36.6	2%	0.021	20%	0.201	C	C	.	.	S	Bend	trans	-109.7	-58.9	166.9	177.9	0	0	0	0	112.4	Y1086 Q1138 A1139 K1173	Y1086-S1262 VanDerWaalsContact CE2-OG 3.27Å; Y1086-S1262 WeakPolarHBondContact CE2-OG 3.3Å; Y1086-S1262 PolarHBondContact OH-OG 2.86Å; Q1138-S1262 CarbonylContact C-O 3.44Å; Q1138-S1262 WeakPolarHBondContact CA-O 3.39Å; A1139-S1262 PolarHBondContact N-O 3.06Å; K1173-S1262 VanDerWaalsContact C-OG 3.29Å; K1173-S1262 VanDerWaalsContact CA-CB 3.4Å; K1173-S1262 VanDerWaalsContact CA-OG 3.25Å; K1173-S1262 WeakPolarHBondContact CA-OG 3.37Å; K1173-S1262 VanDerWaalsContact O-CA 3.3Å; K1173-S1262 WeakPolarHBondContact O-CA 3.37Å; K1173-S1262 WeakPolarHBondContact O-CB 3.36Å; K1173-S1262 PolarHBondContact O-OG 3.26Å
1263	S	74.7	Confident	72.9	Confident	7 Å²	7	31.3 Å²	31.3	5%	0.049	17%	0.172	C	C	.	.	S	Bend	trans	-71.6	-32.1	175	50.1	0	0	0	0	112.9	Q1138 T1265 R1276 E1281	Q1138-S1263 WeakPolarHBondContact CA-O 3.47Å; S1263-T1265 WeakPolarHBondContact CB-OG1 3.48Å; S1263-T1265 PolarHBondContact OG-N 2.89Å; S1263-T1265 PolarHBondContact OG-OG1 2.83Å; S1263-T1265 VanDerWaalsContact OG-OG1 3.12Å; S1263-R1276 PolarHBondContact O-NH2 2.04Å; S1263-E1281 WeakPolarHBondContact CB-OE1 3.26Å; S1263-E1281 PolarHBondContact OG-OE1 2.97Å
1264	G	67.7	Low	72.5	Confident	6 Å²	6	27 Å²	27	6%	0.062	15%	0.149	C	C	.	.	S	Bend	trans	73	28.9	-169	0	0	0	0	0	112.9	T1137 C1261 R1276	T1137-G1264 WeakPolarHBondContact O-CA 3.4Å; C1261-G1264 PolarHBondContact SG-N 2.92Å; C1261-G1264 VanDerWaalsContact SG-N 3.42Å; G1264-R1276 PolarHBondContact O-NE 2.89Å
1265	T	69.8	Low	72.4	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.006	15%	0.151	C	C	.	.			trans	-129.1	-44.9	-174.3	46.8	0	0	0	0	114.1	I1089 S1263 R1267 R1276 N1277 Y1278 M1279 I1280 E1281	I1089-T1265 HydrophobicContact CG2-CG2 3.74Å; S1263-T1265 WeakPolarHBondContact CB-OG1 3.48Å; S1263-T1265 PolarHBondContact OG-N 2.89Å; S1263-T1265 PolarHBondContact OG-OG1 2.83Å; S1263-T1265 VanDerWaalsContact OG-OG1 3.12Å; T1265-R1267 VanDerWaalsContact C-N 3.27Å; T1265-R1267 PolarHBondContact O-N 2.81Å; T1265-R1276 HydrophobicContact CG2-CG 4.08Å; T1265-N1277 WeakPolarHBondContact CG2-O 3.39Å; T1265-Y1278 WeakPolarHBondContact CB-O 3.29Å; T1265-M1279 HydrophobicContact CG2-SD 4.12Å; T1265-M1279 VanDerWaalsContact O-CA 3.31Å; T1265-M1279 WeakPolarHBondContact O-CA 3.26Å; T1265-I1280 PolarHBondContact O-N 3.35Å; T1265-E1281 PolarHBondContact OG1-OE1 3.21Å
1266	G	61.2	Low	72.1	Confident	2 Å²	2	27 Å²	27	2%	0.021	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	4.7	-166.6	0	0	0	0	0	120.6	E1281 Q1285	G1266-E1281 VanDerWaalsContact CA-OE1 3.32Å; G1266-E1281 WeakPolarHBondContact CA-OE1 3.43Å; G1266-E1281 PolarHBondContact N-OE1 2.75Å; G1266-Q1285 PolarHBondContact O-OE1 3.44Å
1267	R	54.3	Low	71.2	Confident	45 Å²	45	27 Å²	27	17%	0.17	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-134.9	32.3	-172.8	-59.4	-169.4	-168.1	158.2	18.8	116.2	L1163 W1227 T1265	L1163-R1267 HydrophobicContact CD1-CB 4.47Å; L1163-R1267 PolarHBondContact O-NH1 2.98Å; L1163-R1267 PolarHBondContact O-NH2 3.04Å; W1227-R1267 VanDerWaalsContact CD1-NH2 3.31Å; W1227-R1267 VanDerWaalsContact CD2-NH2 3.35Å; W1227-R1267 VanDerWaalsContact CE3-CZ 3.48Å; T1265-R1267 VanDerWaalsContact C-N 3.27Å; T1265-R1267 PolarHBondContact O-N 2.81Å
1268	T	43	Very low	70.3	Confident	46 Å²	46	31.2 Å²	31.2	28%	0.282	16%	0.158	S	C	.	.	S	Bend	trans	-155.5	143.8	176.2	-9.5	0	0	0	0	115.8	L1272 M1279 I1280	T1268-L1272 HydrophobicContact CG2-CD1 3.27Å; T1268-M1279 CarbonylContact O-C 3.57Å; T1268-M1279 WeakPolarHBondContact O-CB 3.47Å; T1268-M1279 VanDerWaalsContact OG1-CE 3.27Å; T1268-M1279 WeakPolarHBondContact OG1-CE 3.47Å; T1268-I1280 WeakPolarHBondContact O-CG1 3.49Å; T1268-I1280 PolarHBondContact O-N 2.78Å
1269	V	47.7	Very low	69.2	Low	55 Å²	55	31.2 Å²	31.2	33%	0.333	16%	0.158	S	C	.	.			trans	-87	141.3	-153	-176.9	0	0	0	0	117.8	Q1271 L1272 I1280 Y1286 I1289	V1269-Q1271 PolarHBondContact O-N 2.98Å; V1269-L1272 WeakPolarHBondContact O-CB 3.34Å; V1269-L1272 VanDerWaalsContact O-CG 3.29Å; V1269-L1272 WeakPolarHBondContact O-CG 3.33Å; V1269-L1272 PolarHBondContact O-N 2.98Å; V1269-L1272 VanDerWaalsContact O-N 3.09Å; V1269-I1280 HydrophobicContact CB-CD1 4.21Å; V1269-I1280 HydrophobicContact CG2-CD1 3.71Å; V1269-Y1286 HydrophobicContact CG1-CE2 4.27Å; V1269-I1289 HydrophobicContact CG2-CD1 3.89Å; V1269-I1289 HydrophobicContact CG2-CG2 4.23Å
1270	N	39.7	Very low	68.4	Low	68 Å²	68	30 Å²	30	36%	0.364	15%	0.15	S	C	.	.	G	3₁₀ helix	trans	38.6	-81.7	157	-167.3	-1.1	0	0	0	118.5	I1061 L1272 R1273	I1061-N1270 HydrophobicContact CD1-CB 3.89Å; I1061-N1270 HydrophobicContact CG1-CB 4.21Å; I1061-N1270 HydrophobicContact CG2-CB 4.22Å; N1270-L1272 PolarHBondContact O-N 3.47Å; N1270-R1273 WeakPolarHBondContact O-CB 3.32Å; N1270-R1273 PolarHBondContact O-N 2.94Å
1271	Q	56.8	Low	67.7	Low	149 Å²	149	32.1 Å²	32.1	70%	0.696	16%	0.16	S	C	*	.	G	3₁₀ helix	trans	-51.5	-30.8	178.9	-73.7	-174.7	-28.1	0	0	111.6	V1269 R1273 L1274	V1269-Q1271 PolarHBondContact O-N 2.98Å; Q1271-R1273 VanDerWaalsContact C-N 3.3Å; Q1271-R1273 PolarHBondContact O-N 2.85Å; Q1271-L1274 WeakPolarHBondContact O-CB 3.37Å; Q1271-L1274 PolarHBondContact O-N 3.09Å; Q1271-L1274 VanDerWaalsContact O-N 3.11Å
1272	L	70.2	Confident	67.4	Low	12 Å²	12	32.1 Å²	32.1	6%	0.063	16%	0.16	C	C	.	.	G	3₁₀ helix	trans	-71.6	-20.5	-179.9	-54.7	-176.5	0	0	0	113	I1125 T1268 V1269 N1270 L1274 Q1275 R1276 M1279	I1125-L1272 HydrophobicContact CB-CD2 4.41Å; I1125-L1272 HydrophobicContact CD1-CB 4.2Å; I1125-L1272 HydrophobicContact CD1-CD2 4.22Å; I1125-L1272 HydrophobicContact CG2-CD1 3.62Å; I1125-L1272 HydrophobicContact CG2-CD2 3.65Å; I1125-L1272 HydrophobicContact CG2-CG 4.17Å; T1268-L1272 HydrophobicContact CG2-CD1 3.27Å; V1269-L1272 WeakPolarHBondContact O-CB 3.34Å; V1269-L1272 VanDerWaalsContact O-CG 3.29Å; V1269-L1272 WeakPolarHBondContact O-CG 3.33Å; V1269-L1272 PolarHBondContact O-N 2.98Å; V1269-L1272 VanDerWaalsContact O-N 3.09Å; N1270-L1272 PolarHBondContact O-N 3.47Å; L1272-L1274 PolarHBondContact O-N 3.04Å; L1272-Q1275 CarbonylContact O-C 3.58Å; L1272-Q1275 WeakPolarHBondContact O-CA 3.22Å; L1272-Q1275 PolarHBondContact O-N 2.55Å; L1272-R1276 PolarHBondContact O-N 2.95Å; L1272-M1279 HydrophobicContact CB-CB 3.98Å; L1272-M1279 HydrophobicContact CB-CE 4.25Å; L1272-M1279 HydrophobicContact CB-CG 4.07Å; L1272-M1279 WeakPolarHBondContact O-CG 3.41Å
1273	R	71.6	Confident	67.3	Low	7 Å²	7	32 Å²	32	3%	0.026	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-69.2	-12.8	168.7	-73.9	-156.9	178.1	-166.4	5.6	114	E1062 Y1092 N1270 Q1271 R1276 M1279 I1280	E1062-R1273 IonicContact OE1-CZ 2.95Å; E1062-R1273 VanDerWaalsContact OE1-CZ 3.23Å; E1062-R1273 IonicContact OE1-NH1 2.72Å; E1062-R1273 PolarHBondContact OE1-NH1 2.9Å; E1062-R1273 IonicContact OE1-NH2 3.19Å; E1062-R1273 PolarHBondContact OE1-NH2 3.46Å; Y1092-R1273 WeakPolarHBondContact CE2-O 3Å; N1270-R1273 WeakPolarHBondContact O-CB 3.32Å; N1270-R1273 PolarHBondContact O-N 2.94Å; Q1271-R1273 VanDerWaalsContact C-N 3.3Å; Q1271-R1273 PolarHBondContact O-N 2.85Å; R1273-R1276 CarbonylContact C-O 3.49Å; R1273-R1276 VanDerWaalsContact CA-O 3.32Å; R1273-R1276 WeakPolarHBondContact CA-O 3.46Å; R1273-M1279 HydrophobicContact CG-CB 3.86Å; R1273-M1279 VanDerWaalsContact CG-O 3.26Å; R1273-M1279 WeakPolarHBondContact CG-O 3.34Å; R1273-M1279 PolarHBondContact NE-O 2.93Å; R1273-I1280 PolarHBondContact NH2-O 3.24Å
1274	L	70.9	Confident	67.6	Low	61 Å²	61	34 Å²	34	32%	0.319	17%	0.167	S	C	.	.	G	3₁₀ helix	trans	-85.9	-13.1	165.6	-59.7	177.7	0	0	0	112.5	I1070 Q1271 L1272	I1070-L1274 HydrophobicContact CD1-CD2 4.35Å; Q1271-L1274 WeakPolarHBondContact O-CB 3.37Å; Q1271-L1274 PolarHBondContact O-N 3.09Å; Q1271-L1274 VanDerWaalsContact O-N 3.11Å; L1272-L1274 PolarHBondContact O-N 3.04Å
1275	Q	79.2	Confident	68.1	Low	25 Å²	25	34.9 Å²	34.9	12%	0.117	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	-25.2	-176.8	-60.1	-169.6	-66.5	0	0	113.5	T1095 N1123 I1125 D1126 L1272	T1095-Q1275 WeakPolarHBondContact CB-O 3.2Å; T1095-Q1275 HydrophobicContact CG2-CB 4.1Å; T1095-Q1275 HydrophobicContact CG2-CG 4.12Å; T1095-Q1275 PolarHBondContact OG1-O 2.8Å; N1123-Q1275 VanDerWaalsContact CB-O 3.25Å; N1123-Q1275 WeakPolarHBondContact CB-O 3.44Å; N1123-Q1275 PolarHBondContact ND2-O 3.22Å; N1123-Q1275 VanDerWaalsContact ND2-O 3.13Å; I1125-Q1275 HydrophobicContact CD1-CB 3.82Å; D1126-Q1275 VanDerWaalsContact CG-NE2 3.25Å; D1126-Q1275 PolarHBondContact OD1-NE2 2.72Å; L1272-Q1275 CarbonylContact O-C 3.58Å; L1272-Q1275 WeakPolarHBondContact O-CA 3.22Å; L1272-Q1275 PolarHBondContact O-N 2.55Å
1276	R	81	Confident	68.7	Low	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.172	C	C	.	.	S	Bend	trans	-151.2	151.2	171.5	-177.4	168	176.8	76.4	0.3	109	Y1092 N1121 N1123 I1125 S1263 G1264 T1265 L1272 R1273 M1279	Y1092-R1276 VanDerWaalsContact CE2-C 3.41Å; N1121-R1276 PolarHBondContact OD1-NH1 2.97Å; N1121-R1276 PolarHBondContact OD1-NH2 2.84Å; N1123-R1276 HydrophobicContact CB-CB 3.92Å; N1123-R1276 HydrophobicContact CB-CG 4.37Å; N1123-R1276 WeakPolarHBondContact OD1-CD 3.29Å; N1123-R1276 WeakPolarHBondContact OD1-CG 3.14Å; N1123-R1276 PolarHBondContact OD1-NH1 2.8Å; I1125-R1276 HydrophobicContact CD1-CB 4.2Å; S1263-R1276 PolarHBondContact O-NH2 2.04Å; G1264-R1276 PolarHBondContact O-NE 2.89Å; T1265-R1276 HydrophobicContact CG2-CG 4.08Å; L1272-R1276 PolarHBondContact O-N 2.95Å; R1273-R1276 CarbonylContact C-O 3.49Å; R1273-R1276 VanDerWaalsContact CA-O 3.32Å; R1273-R1276 WeakPolarHBondContact CA-O 3.46Å; R1276-M1279 HydrophobicContact CB-CG 3.77Å; R1276-M1279 HydrophobicContact CB-SD 3.78Å; R1276-M1279 HydrophobicContact CG-CG 4.35Å; R1276-M1279 HydrophobicContact CG-SD 3.91Å; R1276-M1279 WeakPolarHBondContact O-CG 2.95Å
1277	N	75.9	Confident	69.7	Low	14 Å²	14	35.8 Å²	35.8	8%	0.075	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	156.9	178.8	69.3	-3.6	0	0	0	112	N1088 L1090 Y1092 T1265 M1279	N1088-N1277 PolarHBondContact O-ND2 2.82Å; L1090-N1277 PolarHBondContact N-ND2 3.5Å; L1090-N1277 PolarHBondContact N-OD1 2.68Å; L1090-N1277 PolarHBondContact O-OD1 3.29Å; Y1092-N1277 HydrophobicContact CE1-CB 4.01Å; Y1092-N1277 HydrophobicContact CE2-CB 4.44Å; Y1092-N1277 WeakPolarHBondContact OH-CB 3.32Å; T1265-N1277 WeakPolarHBondContact CG2-O 3.39Å; N1277-M1279 PolarHBondContact O-N 2.95Å
1278	Y	73.1	Confident	71.1	Confident	109 Å²	109	34.1 Å²	34.1	43%	0.427	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.9	23	175.2	-49.9	-70.5	0	0	0	117.8	N1088 I1089 T1265 I1280	N1088-Y1278 WeakPolarHBondContact O-CE2 3.42Å; I1089-Y1278 HydrophobicContact CG1-CD2 4.43Å; T1265-Y1278 WeakPolarHBondContact CB-O 3.29Å; Y1278-I1280 CarbonylContact O-C 3.5Å; Y1278-I1280 PolarHBondContact O-N 2.98Å; Y1278-I1280 VanDerWaalsContact O-N 3.15Å; Y1278-I1280 VanDerWaalsContact O-O 3.09Å
1279	M	69.8	Low	73.1	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.005	16%	0.163	C	C	.	.	S	Bend	trans	-60.4	118.9	176.2	-63.1	-63.4	-67.1	0	0	110.7	I1125 A1136 T1265 T1268 L1272 R1273 R1276 N1277	I1125-M1279 HydrophobicContact CD1-CE 4.01Å; I1125-M1279 HydrophobicContact CG1-CE 4.33Å; A1136-M1279 HydrophobicContact CB-CE 3.83Å; A1136-M1279 HydrophobicContact CB-SD 4.16Å; T1265-M1279 HydrophobicContact CG2-SD 4.12Å; T1265-M1279 VanDerWaalsContact O-CA 3.31Å; T1265-M1279 WeakPolarHBondContact O-CA 3.26Å; T1268-M1279 CarbonylContact O-C 3.57Å; T1268-M1279 WeakPolarHBondContact O-CB 3.47Å; T1268-M1279 VanDerWaalsContact OG1-CE 3.27Å; T1268-M1279 WeakPolarHBondContact OG1-CE 3.47Å; L1272-M1279 HydrophobicContact CB-CB 3.98Å; L1272-M1279 HydrophobicContact CB-CE 4.25Å; L1272-M1279 HydrophobicContact CB-CG 4.07Å; L1272-M1279 WeakPolarHBondContact O-CG 3.41Å; R1273-M1279 HydrophobicContact CG-CB 3.86Å; R1273-M1279 VanDerWaalsContact CG-O 3.26Å; R1273-M1279 WeakPolarHBondContact CG-O 3.34Å; R1273-M1279 PolarHBondContact NE-O 2.93Å; R1276-M1279 HydrophobicContact CB-CG 3.77Å; R1276-M1279 HydrophobicContact CB-SD 3.78Å; R1276-M1279 HydrophobicContact CG-CG 4.35Å; R1276-M1279 HydrophobicContact CG-SD 3.91Å; R1276-M1279 WeakPolarHBondContact O-CG 2.95Å; N1277-M1279 PolarHBondContact O-N 2.95Å
1280	I	74.6	Confident	74.9	Confident	2 Å²	2	32 Å²	32	1%	0.01	15%	0.151	C	C	.	.	S	Bend	trans	57.5	116.9	-149.8	-65.6	167.2	0	0	0	111.6	F1058 T1265 T1268 V1269 R1273 Y1278 T1282 Q1285 Y1286 I1289	F1058-I1280 HydrophobicContact CE2-CB 4.35Å; F1058-I1280 HydrophobicContact CE2-CG2 3.64Å; F1058-I1280 HydrophobicContact CZ-CG2 4.22Å; T1265-I1280 PolarHBondContact O-N 3.35Å; T1268-I1280 WeakPolarHBondContact O-CG1 3.49Å; T1268-I1280 PolarHBondContact O-N 2.78Å; V1269-I1280 HydrophobicContact CB-CD1 4.21Å; V1269-I1280 HydrophobicContact CG2-CD1 3.71Å; R1273-I1280 PolarHBondContact NH2-O 3.24Å; Y1278-I1280 CarbonylContact O-C 3.5Å; Y1278-I1280 PolarHBondContact O-N 2.98Å; Y1278-I1280 VanDerWaalsContact O-N 3.15Å; Y1278-I1280 VanDerWaalsContact O-O 3.09Å; I1280-T1282 WeakPolarHBondContact CG2-O 3.26Å; I1280-Q1285 HydrophobicContact CG2-CB 3.97Å; I1280-Y1286 HydrophobicContact CD1-CD2 3.9Å; I1280-I1289 HydrophobicContact CD1-CD1 3.48Å; I1280-I1289 VanDerWaalsContact CD1-CD1 3.48Å; I1280-I1289 HydrophobicContact CG1-CD1 4.14Å
1281	E	73.5	Confident	77	Confident	47 Å²	47	29.8 Å²	29.8	22%	0.22	14%	0.14	C	C	.	.			trans	-90.3	-43.9	-176.5	-74.5	159.5	-145.6	0	0	110.8	M479 S1263 T1265 G1266	M479-E1281 VanDerWaalsContact SD-O 3.37Å; S1263-E1281 WeakPolarHBondContact CB-OE1 3.26Å; S1263-E1281 PolarHBondContact OG-OE1 2.97Å; T1265-E1281 PolarHBondContact OG1-OE1 3.21Å; G1266-E1281 VanDerWaalsContact CA-OE1 3.32Å; G1266-E1281 WeakPolarHBondContact CA-OE1 3.43Å; G1266-E1281 PolarHBondContact N-OE1 2.75Å
1282	T	77.8	Confident	78.3	Confident	14 Å²	14	23.1 Å²	23.1	9%	0.086	11%	0.11	C	C	.	.	S	Bend	trans	-118.6	160.8	-172.2	92.7	0	0	0	0	112.3	E478 M479 I1280 E1284 Q1285 Y1286	E478-T1282 WeakPolarHBondContact O-CA 3.31Å; M479-T1282 HydrophobicContact CB-CG2 3.78Å; M479-T1282 HydrophobicContact CE-CG2 3.95Å; M479-T1282 HydrophobicContact CG-CG2 4.27Å; M479-T1282 HydrophobicContact SD-CG2 3.87Å; I1280-T1282 WeakPolarHBondContact CG2-O 3.26Å; T1282-E1284 WeakPolarHBondContact CB-OE2 3.19Å; T1282-E1284 PolarHBondContact OG1-N 3.45Å; T1282-E1284 PolarHBondContact OG1-OE2 3.14Å; T1282-Q1285 HydrophobicContact CG2-CG 4.48Å; T1282-Q1285 WeakPolarHBondContact O-CB 3.33Å; T1282-Q1285 PolarHBondContact O-N 3.02Å; T1282-Q1285 WeakPolarHBondContact OG1-CG 3.43Å; T1282-Q1285 PolarHBondContact OG1-N 2.9Å; T1282-Y1286 PolarHBondContact O-N 2.96Å
1283	Q	80.8	Confident	79.2	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-73.3	-32.7	177.4	-156.3	174	-58.8	0	0	112.5	E476 P477 E478 F1058 Q1285 Y1286 Q1287	E476-Q1283 PolarHBondContact OE1-NE2 2.92Å; E476-Q1283 VanDerWaalsContact OE2-O 3.14Å; P477-Q1283 VanDerWaalsContact CD-CD 3.44Å; P477-Q1283 WeakPolarHBondContact O-CB 3.31Å; E478-Q1283 PolarHBondContact O-N 3.4Å; F1058-Q1283 HydrophobicContact CB-CG 4.27Å; F1058-Q1283 HydrophobicContact CD1-CB 4.22Å; F1058-Q1283 HydrophobicContact CD1-CG 4.26Å; F1058-Q1283 HydrophobicContact CG-CG 4.3Å; Q1283-Q1285 PolarHBondContact O-N 2.92Å; Q1283-Y1286 CarbonylContact O-C 3.59Å; Q1283-Y1286 WeakPolarHBondContact O-CA 3.26Å; Q1283-Y1286 VanDerWaalsContact O-CB 3.23Å; Q1283-Y1286 WeakPolarHBondContact O-CB 3.33Å; Q1283-Y1286 PolarHBondContact O-N 3.19Å; Q1283-Q1287 PolarHBondContact O-N 2.72Å
1284	E	80.5	Confident	79.9	Confident	49 Å²	49	26.6 Å²	26.6	23%	0.229	13%	0.128	C	C	.	.	H	α-helix	trans	-59	-33.8	176.4	-51.8	83.6	174.5	0	0	110.7	E476 M479 V1232 T1282 F1288	E476-E1284 WeakPolarHBondContact OE2-CA 3.1Å; E476-E1284 PolarHBondContact OE2-N 2.87Å; M479-E1284 PolarHBondContact N-OE1 2.84Å; M479-E1284 PolarHBondContact N-OE2 3.1Å; V1232-E1284 HydrophobicContact CG1-CB 3.98Å; V1232-E1284 HydrophobicContact CG2-CB 4.13Å; T1282-E1284 WeakPolarHBondContact CB-OE2 3.19Å; T1282-E1284 PolarHBondContact OG1-N 3.45Å; T1282-E1284 PolarHBondContact OG1-OE2 3.14Å; E1284-F1288 VanDerWaalsContact O-CB 3.25Å; E1284-F1288 WeakPolarHBondContact O-CB 3.47Å; E1284-F1288 PolarHBondContact O-N 2.97Å
1285	Q	78.3	Confident	80.5	Confident	25 Å²	25	24 Å²	24	12%	0.117	12%	0.115	C	C	.	.	H	α-helix	trans	-69.6	-38.9	172	-67.1	163.3	-5.2	0	0	112.6	V1232 G1266 I1280 T1282 Q1283 Q1287 I1289	V1232-Q1285 HydrophobicContact CG1-CG 3.93Å; G1266-Q1285 PolarHBondContact O-OE1 3.44Å; I1280-Q1285 HydrophobicContact CG2-CB 3.97Å; T1282-Q1285 HydrophobicContact CG2-CG 4.48Å; T1282-Q1285 WeakPolarHBondContact O-CB 3.33Å; T1282-Q1285 PolarHBondContact O-N 3.02Å; T1282-Q1285 WeakPolarHBondContact OG1-CG 3.43Å; T1282-Q1285 PolarHBondContact OG1-N 2.9Å; Q1283-Q1285 PolarHBondContact O-N 2.92Å; Q1285-Q1287 VanDerWaalsContact C-N 3.32Å; Q1285-I1289 WeakPolarHBondContact O-CD1 3.45Å; Q1285-I1289 WeakPolarHBondContact O-CG1 3.29Å; Q1285-I1289 PolarHBondContact O-N 2.82Å
1286	Y	83	Confident	80.8	Confident	12 Å²	12	25.3 Å²	25.3	5%	0.047	13%	0.126	C	C	.	.	H	α-helix	trans	-61.9	-40.8	173.8	-169.7	-119	0	0	0	111.3	F1054 E1057 F1058 I1061 V1269 I1280 T1282 Q1283 I1289 Y1290	F1054-Y1286 HydrophobicContact CB-CD1 4.47Å; F1054-Y1286 HydrophobicContact CB-CE1 4.47Å; F1054-Y1286 HydrophobicContact CD1-CE1 4.38Å; E1057-Y1286 HydrophobicContact CG-CE1 4.21Å; E1057-Y1286 VanDerWaalsContact CG-OH 3.31Å; E1057-Y1286 WeakPolarHBondContact CG-OH 3.15Å; E1057-Y1286 PolarHBondContact OE2-OH 2.73Å; F1058-Y1286 HydrophobicContact CB-CD1 4.4Å; F1058-Y1286 HydrophobicContact CD2-CG 4.22Å; I1061-Y1286 HydrophobicContact CD1-CE2 4.22Å; V1269-Y1286 HydrophobicContact CG1-CE2 4.27Å; I1280-Y1286 HydrophobicContact CD1-CD2 3.9Å; T1282-Y1286 PolarHBondContact O-N 2.96Å; Q1283-Y1286 CarbonylContact O-C 3.59Å; Q1283-Y1286 WeakPolarHBondContact O-CA 3.26Å; Q1283-Y1286 VanDerWaalsContact O-CB 3.23Å; Q1283-Y1286 WeakPolarHBondContact O-CB 3.33Å; Q1283-Y1286 PolarHBondContact O-N 3.19Å; Y1286-I1289 WeakPolarHBondContact O-CB 2.92Å; Y1286-I1289 PolarHBondContact O-N 2.79Å; Y1286-Y1290 HydrophobicContact CD1-CE2 4.25Å; Y1286-Y1290 HydrophobicContact CE1-CD2 4.31Å; Y1286-Y1290 AromaticContact CE1-CE2 3.62Å; Y1286-Y1290 HydrophobicContact CE1-CE2 3.62Å; Y1286-Y1290 HydrophobicContact CE2-CE2 4.29Å; Y1286-Y1290 AromaticContact CZ-CE2 3.62Å; Y1286-Y1290 PolarHBondContact O-N 2.79Å
1287	Q	82.9	Confident	81	Confident	10 Å²	10	29 Å²	29	5%	0.047	15%	0.145	C	C	.	.	H	α-helix	trans	-77.9	-34.4	178.2	-79.2	-140.7	34.8	0	0	115.7	E476 Y1051 F1054 Q1283 Q1285 I1289 Y1290 T1291	E476-Q1287 PolarHBondContact OE1-NE2 3.42Å; E476-Q1287 WeakPolarHBondContact OE2-CB 3.32Å; E476-Q1287 VanDerWaalsContact OE2-CD 3.29Å; E476-Q1287 WeakPolarHBondContact OE2-CG 2.89Å; E476-Q1287 PolarHBondContact OE2-NE2 2.84Å; Y1051-Q1287 PolarHBondContact OH-OE1 2.84Å; Y1051-Q1287 VanDerWaalsContact OH-OE1 3.09Å; F1054-Q1287 HydrophobicContact CD2-CG 4Å; Q1283-Q1287 PolarHBondContact O-N 2.72Å; Q1285-Q1287 VanDerWaalsContact C-N 3.32Å; Q1287-I1289 PolarHBondContact O-N 2.67Å; Q1287-Y1290 PolarHBondContact O-N 3.4Å; Q1287-Y1290 VanDerWaalsContact O-N 3.15Å; Q1287-T1291 WeakPolarHBondContact O-CB 3.49Å; Q1287-T1291 PolarHBondContact O-N 3.22Å; Q1287-T1291 PolarHBondContact O-OG1 2.74Å
1288	F	82.8	Confident	81.4	Confident	10 Å²	10	31.1 Å²	31.1	4%	0.044	16%	0.159	C	C	.	.	H	α-helix	trans	-57.2	-33.6	170.5	179.9	-97	0	0	0	110.4	W1227 V1232 S1233 P1236 F1239 E1284 T1291 A1292	W1227-F1288 AromaticContact CH2-CD1 3.55Å; W1227-F1288 HydrophobicContact CH2-CD1 3.55Å; W1227-F1288 AromaticContact CH2-CE1 3.42Å; W1227-F1288 HydrophobicContact CH2-CE1 3.42Å; W1227-F1288 VanDerWaalsContact CH2-CE1 3.42Å; W1227-F1288 HydrophobicContact CH2-CG 4.29Å; W1227-F1288 HydrophobicContact CH2-CZ 4.09Å; W1227-F1288 HydrophobicContact CZ2-CD1 4.35Å; W1227-F1288 HydrophobicContact CZ2-CE1 4.49Å; W1227-F1288 HydrophobicContact CZ3-CD1 4.24Å; W1227-F1288 AromaticContact CZ3-CE1 3.62Å; W1227-F1288 HydrophobicContact CZ3-CE1 3.62Å; W1227-F1288 HydrophobicContact CZ3-CZ 4.03Å; V1232-F1288 HydrophobicContact CB-CB 4.01Å; V1232-F1288 HydrophobicContact CB-CD2 4.09Å; V1232-F1288 HydrophobicContact CB-CG 4.15Å; V1232-F1288 HydrophobicContact CG1-CB 4.17Å; V1232-F1288 HydrophobicContact CG2-CB 4.18Å; V1232-F1288 HydrophobicContact CG2-CD2 4.35Å; S1233-F1288 WeakPolarHBondContact O-CD2 3.1Å; S1233-F1288 WeakPolarHBondContact O-CE2 3.45Å; P1236-F1288 HydrophobicContact CB-CE2 3.83Å; P1236-F1288 HydrophobicContact CB-CZ 3.87Å; F1239-F1288 HydrophobicContact CB-CE1 4.4Å; F1239-F1288 HydrophobicContact CB-CZ 3.92Å; F1239-F1288 AromaticContact CD1-CE1 3.48Å; F1239-F1288 HydrophobicContact CD1-CE1 3.48Å; F1239-F1288 VanDerWaalsContact CD1-CE1 3.48Å; F1239-F1288 AromaticContact CD1-CZ 3.84Å; F1239-F1288 HydrophobicContact CD1-CZ 3.84Å; F1239-F1288 AromaticContact CE1-CE1 3.87Å; F1239-F1288 HydrophobicContact CE1-CE1 3.87Å; F1239-F1288 HydrophobicContact CG-CE1 4Å; F1239-F1288 HydrophobicContact CG-CZ 4.04Å; E1284-F1288 VanDerWaalsContact O-CB 3.25Å; E1284-F1288 WeakPolarHBondContact O-CB 3.47Å; E1284-F1288 PolarHBondContact O-N 2.97Å; F1288-T1291 PolarHBondContact O-N 2.77Å; F1288-A1292 WeakPolarHBondContact O-CB 3.43Å; F1288-A1292 PolarHBondContact O-N 2.87Å
1289	I	85	Confident	81.9	Confident	39 Å²	39	26.3 Å²	26.3	20%	0.2	14%	0.141	C	C	.	.	H	α-helix	trans	-68.6	-46.4	173.4	-68.8	162.8	0	0	0	112	V1269 I1280 Q1285 Y1286 Q1287 T1291 A1292 L1293	V1269-I1289 HydrophobicContact CG2-CD1 3.89Å; V1269-I1289 HydrophobicContact CG2-CG2 4.23Å; I1280-I1289 HydrophobicContact CD1-CD1 3.48Å; I1280-I1289 VanDerWaalsContact CD1-CD1 3.48Å; I1280-I1289 HydrophobicContact CG1-CD1 4.14Å; Q1285-I1289 WeakPolarHBondContact O-CD1 3.45Å; Q1285-I1289 WeakPolarHBondContact O-CG1 3.29Å; Q1285-I1289 PolarHBondContact O-N 2.82Å; Y1286-I1289 WeakPolarHBondContact O-CB 2.92Å; Y1286-I1289 PolarHBondContact O-N 2.79Å; Q1287-I1289 PolarHBondContact O-N 2.67Å; I1289-T1291 VanDerWaalsContact C-N 3.29Å; I1289-T1291 PolarHBondContact O-N 2.82Å; I1289-A1292 PolarHBondContact O-N 3.11Å; I1289-L1293 HydrophobicContact CG2-CD1 3.89Å; I1289-L1293 HydrophobicContact CG2-CG 4.39Å; I1289-L1293 WeakPolarHBondContact O-CB 3.41Å; I1289-L1293 VanDerWaalsContact O-CG 3.25Å; I1289-L1293 WeakPolarHBondContact O-CG 3.08Å; I1289-L1293 PolarHBondContact O-N 3.17Å
1290	Y	86.3	Confident	82.5	Confident	18 Å²	18	27.6 Å²	27.6	7%	0.071	16%	0.155	C	C	.	.	H	α-helix	trans	-59.3	-40.7	173.1	-87.5	-84.2	0	0	0	112.2	I1034 F1039 I1043 F1054 E1057 Y1286 Q1287 L1294	I1034-Y1290 HydrophobicContact CD1-CE1 4.22Å; F1039-Y1290 HydrophobicContact CE1-CD1 4.16Å; F1039-Y1290 WeakPolarHBondContact CE1-O 2.94Å; F1039-Y1290 AromaticContact CE2-CD1 3.69Å; F1039-Y1290 HydrophobicContact CE2-CD1 3.69Å; F1039-Y1290 AromaticContact CE2-CE1 3.71Å; F1039-Y1290 HydrophobicContact CE2-CE1 3.71Å; F1039-Y1290 AromaticContact CZ-CD1 3.38Å; F1039-Y1290 HydrophobicContact CZ-CD1 3.38Å; F1039-Y1290 AromaticContact CZ-CE1 3.91Å; F1039-Y1290 HydrophobicContact CZ-CE1 3.91Å; F1039-Y1290 HydrophobicContact CZ-CG 4.27Å; I1043-Y1290 HydrophobicContact CD1-CD1 4.01Å; I1043-Y1290 HydrophobicContact CD1-CG 4.49Å; I1043-Y1290 WeakPolarHBondContact CD1-O 3.2Å; I1043-Y1290 HydrophobicContact CG1-CD1 3.82Å; I1043-Y1290 HydrophobicContact CG1-CG 4.34Å; F1054-Y1290 HydrophobicContact CD1-CD2 4.39Å; F1054-Y1290 AromaticContact CD1-CE2 3.95Å; F1054-Y1290 HydrophobicContact CD1-CE2 3.95Å; F1054-Y1290 HydrophobicContact CE1-CD1 4.03Å; F1054-Y1290 AromaticContact CE1-CD2 3.95Å; F1054-Y1290 HydrophobicContact CE1-CD2 3.95Å; F1054-Y1290 AromaticContact CE1-CE1 3.72Å; F1054-Y1290 HydrophobicContact CE1-CE1 3.72Å; F1054-Y1290 AromaticContact CE1-CE2 3.6Å; F1054-Y1290 HydrophobicContact CE1-CE2 3.6Å; F1054-Y1290 HydrophobicContact CE1-CG 4.14Å; F1054-Y1290 AromaticContact CE1-CZ 3.48Å; F1054-Y1290 VanDerWaalsContact CE1-CZ 3.48Å; F1054-Y1290 HydrophobicContact CE2-CD2 4.48Å; F1054-Y1290 HydrophobicContact CE2-CG 4.39Å; F1054-Y1290 AromaticContact CZ-CD1 3.78Å; F1054-Y1290 HydrophobicContact CZ-CD1 3.78Å; F1054-Y1290 AromaticContact CZ-CD2 3.99Å; F1054-Y1290 HydrophobicContact CZ-CD2 3.99Å; F1054-Y1290 AromaticContact CZ-CE1 3.95Å; F1054-Y1290 HydrophobicContact CZ-CE1 3.95Å; F1054-Y1290 HydrophobicContact CZ-CE2 4.12Å; F1054-Y1290 AromaticContact CZ-CG 3.81Å; F1054-Y1290 HydrophobicContact CZ-CG 3.81Å; E1057-Y1290 PolarHBondContact OE2-OH 3.42Å; Y1286-Y1290 HydrophobicContact CD1-CE2 4.25Å; Y1286-Y1290 HydrophobicContact CE1-CD2 4.31Å; Y1286-Y1290 AromaticContact CE1-CE2 3.62Å; Y1286-Y1290 HydrophobicContact CE1-CE2 3.62Å; Y1286-Y1290 HydrophobicContact CE2-CE2 4.29Å; Y1286-Y1290 AromaticContact CZ-CE2 3.62Å; Y1286-Y1290 PolarHBondContact O-N 2.79Å; Q1287-Y1290 PolarHBondContact O-N 3.4Å; Q1287-Y1290 VanDerWaalsContact O-N 3.15Å; Y1290-L1294 WeakPolarHBondContact O-CB 3.06Å; Y1290-L1294 PolarHBondContact O-N 3.44Å
1291	T	82.7	Confident	83	Confident	22 Å²	22	31.6 Å²	31.6	14%	0.135	18%	0.176	C	C	.	.	H	α-helix	trans	-66.3	-46.4	177.3	-71.1	0	0	0	0	111.8	P1236 Q1287 F1288 I1289 L1293 L1294 E1295 Y1412	P1236-T1291 HydrophobicContact CG-CG2 3.85Å; Q1287-T1291 WeakPolarHBondContact O-CB 3.49Å; Q1287-T1291 PolarHBondContact O-N 3.22Å; Q1287-T1291 PolarHBondContact O-OG1 2.74Å; F1288-T1291 PolarHBondContact O-N 2.77Å; I1289-T1291 VanDerWaalsContact C-N 3.29Å; I1289-T1291 PolarHBondContact O-N 2.82Å; T1291-L1293 PolarHBondContact O-N 2.84Å; T1291-L1294 PolarHBondContact O-N 3.11Å; T1291-E1295 WeakPolarHBondContact O-CB 3.37Å; T1291-E1295 PolarHBondContact O-N 3.05Å; T1291-Y1412 WeakPolarHBondContact CA-OH 3.15Å; T1291-Y1412 HydrophobicContact CG2-CE1 3.6Å; T1291-Y1412 PolarHBondContact O-OH 2.83Å
1292	A	84.9	Confident	83.7	Confident	8 Å²	8	30 Å²	30	7%	0.066	17%	0.169	C	C	.	.	H	α-helix	trans	-64.3	-38.8	175.7	0	0	0	0	0	112.4	P1236 L1240 F1288 I1289 S1296	P1236-A1292 HydrophobicContact CB-CB 3.65Å; P1236-A1292 HydrophobicContact CG-CB 4.37Å; L1240-A1292 HydrophobicContact CD2-CB 4.24Å; F1288-A1292 WeakPolarHBondContact O-CB 3.43Å; F1288-A1292 PolarHBondContact O-N 2.87Å; I1289-A1292 PolarHBondContact O-N 3.11Å; A1292-S1296 VanDerWaalsContact O-CB 3.24Å; A1292-S1296 WeakPolarHBondContact O-CB 3.16Å; A1292-S1296 PolarHBondContact O-N 3.33Å
1293	L	88.1	Confident	84.2	Confident	84 Å²	84	30.8 Å²	30.8	44%	0.44	17%	0.172	S	C	.	.	H	α-helix	trans	-65.6	-48.6	174.5	-73.9	170.7	0	0	0	111.4	F1039 I1289 T1291 E1295 S1296 I1297	F1039-L1293 HydrophobicContact CE1-CB 3.6Å; F1039-L1293 HydrophobicContact CZ-CB 3.63Å; F1039-L1293 HydrophobicContact CZ-CD1 3.87Å; F1039-L1293 HydrophobicContact CZ-CG 4.42Å; I1289-L1293 HydrophobicContact CG2-CD1 3.89Å; I1289-L1293 HydrophobicContact CG2-CG 4.39Å; I1289-L1293 WeakPolarHBondContact O-CB 3.41Å; I1289-L1293 VanDerWaalsContact O-CG 3.25Å; I1289-L1293 WeakPolarHBondContact O-CG 3.08Å; I1289-L1293 PolarHBondContact O-N 3.17Å; T1291-L1293 PolarHBondContact O-N 2.84Å; L1293-E1295 VanDerWaalsContact C-N 3.31Å; L1293-E1295 PolarHBondContact O-N 2.99Å; L1293-S1296 PolarHBondContact O-N 2.98Å; L1293-I1297 WeakPolarHBondContact O-CB 3.46Å; L1293-I1297 WeakPolarHBondContact O-CD1 3.07Å; L1293-I1297 WeakPolarHBondContact O-CG1 3.48Å; L1293-I1297 PolarHBondContact O-N 3.3Å
1294	L	86.1	Confident	84.6	Confident	8 Å²	8	31.5 Å²	31.5	4%	0.042	18%	0.176	C	C	.	.	H	α-helix	trans	-62.8	-39.2	179.1	172.9	60.7	0	0	0	111.4	F1039 Q1040 I1043 Y1290 T1291 T1298 Y1412	F1039-L1294 HydrophobicContact CD1-CB 4.09Å; F1039-L1294 HydrophobicContact CE1-CB 3.98Å; Q1040-L1294 HydrophobicContact CB-CD1 3.73Å; Q1040-L1294 HydrophobicContact CG-CD1 4.02Å; Q1040-L1294 HydrophobicContact CG-CD2 4.37Å; I1043-L1294 HydrophobicContact CB-CD2 4.38Å; I1043-L1294 HydrophobicContact CD1-CB 3.59Å; I1043-L1294 HydrophobicContact CD1-CD2 3.68Å; I1043-L1294 HydrophobicContact CD1-CG 4.16Å; I1043-L1294 HydrophobicContact CG2-CD2 4.14Å; Y1290-L1294 WeakPolarHBondContact O-CB 3.06Å; Y1290-L1294 PolarHBondContact O-N 3.44Å; T1291-L1294 PolarHBondContact O-N 3.11Å; L1294-T1298 VanDerWaalsContact O-CB 3.26Å; L1294-T1298 WeakPolarHBondContact O-CB 3.26Å; L1294-T1298 PolarHBondContact O-N 3.49Å; L1294-T1298 PolarHBondContact O-OG1 2.78Å; L1294-Y1412 WeakPolarHBondContact CB-OH 3.25Å; L1294-Y1412 HydrophobicContact CD2-CE2 4.3Å; L1294-Y1412 WeakPolarHBondContact CD2-OH 3.31Å; L1294-Y1412 HydrophobicContact CG-CE2 4.45Å
1295	E	83.9	Confident	84.9	Confident	8 Å²	8	31 Å²	31	4%	0.037	18%	0.178	C	C	.	.	H	α-helix	trans	-64	-47.7	172.8	179.2	161	125.3	0	0	112.2	P1236 T1237 L1240 T1291 L1293 I1297 T1298 D1299 K1634	P1236-E1295 HydrophobicContact CG-CB 3.93Å; P1236-E1295 VanDerWaalsContact CG-CD 3.49Å; P1236-E1295 HydrophobicContact CG-CG 4.25Å; T1237-E1295 WeakPolarHBondContact CA-OE1 3.19Å; T1237-E1295 PolarHBondContact N-OE1 3.4Å; T1237-E1295 VanDerWaalsContact N-OE1 3.08Å; L1240-E1295 HydrophobicContact CD1-CB 3.93Å; L1240-E1295 HydrophobicContact CD1-CG 3.67Å; T1291-E1295 WeakPolarHBondContact O-CB 3.37Å; T1291-E1295 PolarHBondContact O-N 3.05Å; L1293-E1295 VanDerWaalsContact C-N 3.31Å; L1293-E1295 PolarHBondContact O-N 2.99Å; E1295-I1297 VanDerWaalsContact C-N 3.28Å; E1295-I1297 PolarHBondContact O-N 2.96Å; E1295-T1298 PolarHBondContact O-N 3.47Å; E1295-T1298 VanDerWaalsContact O-N 3.11Å; E1295-D1299 WeakPolarHBondContact O-CB 2.89Å; E1295-D1299 PolarHBondContact O-N 2.77Å; E1295-K1634 IonicContact OE1-NZ 3.43Å; E1295-K1634 PolarHBondContact OE1-NZ 3.3Å; E1295-K1634 IonicContact OE2-NZ 2.68Å; E1295-K1634 PolarHBondContact OE2-NZ 3.03Å
1296	S	85.8	Confident	85.4	Confident	51 Å²	51	30.7 Å²	30.7	36%	0.357	18%	0.18	S	C	.	.	H	α-helix	trans	-59.4	-37.7	177.5	-168.2	0	0	0	0	112.7	A1292 L1293 G1300	A1292-S1296 VanDerWaalsContact O-CB 3.24Å; A1292-S1296 WeakPolarHBondContact O-CB 3.16Å; A1292-S1296 PolarHBondContact O-N 3.33Å; L1293-S1296 PolarHBondContact O-N 2.98Å; S1296-G1300 PolarHBondContact O-N 2.81Å; S1296-G1300 VanDerWaalsContact O-N 3.15Å
1297	I	86.1	Confident	85.6	Confident	78 Å²	78	41 Å²	41	40%	0.4	22%	0.219	S	C	.	.	H	α-helix	trans	-68.2	-42.8	173.8	-69.5	160.1	0	0	0	111.4	V1036 F1039 L1293 E1295	V1036-I1297 HydrophobicContact CG1-CD1 4.14Å; V1036-I1297 HydrophobicContact CG1-CG1 4.2Å; V1036-I1297 HydrophobicContact CG1-CG2 3.69Å; F1039-I1297 HydrophobicContact CB-CD1 4.49Å; F1039-I1297 HydrophobicContact CD1-CD1 3.72Å; F1039-I1297 HydrophobicContact CE1-CD1 4.15Å; F1039-I1297 HydrophobicContact CG-CD1 4.15Å; L1293-I1297 WeakPolarHBondContact O-CB 3.46Å; L1293-I1297 WeakPolarHBondContact O-CD1 3.07Å; L1293-I1297 WeakPolarHBondContact O-CG1 3.48Å; L1293-I1297 PolarHBondContact O-N 3.3Å; E1295-I1297 VanDerWaalsContact C-N 3.28Å; E1295-I1297 PolarHBondContact O-N 2.96Å
1298	T	82.8	Confident	86	Confident	59 Å²	59	41.8 Å²	41.8	36%	0.362	22%	0.223	S	C	.	.	H	α-helix	trans	-74.6	-44.7	-174.4	-59	0	0	0	0	112.5	L1294 E1295 K1378	L1294-T1298 VanDerWaalsContact O-CB 3.26Å; L1294-T1298 WeakPolarHBondContact O-CB 3.26Å; L1294-T1298 PolarHBondContact O-N 3.49Å; L1294-T1298 PolarHBondContact O-OG1 2.78Å; E1295-T1298 PolarHBondContact O-N 3.47Å; E1295-T1298 VanDerWaalsContact O-N 3.11Å; T1298-K1378 PolarHBondContact O-NZ 2.84Å
1299	D	83.5	Confident	86.4	Confident	7 Å²	7	41.3 Å²	41.3	4%	0.037	22%	0.221	C	C	.	.	H	α-helix	trans	-77.6	-46.9	-177.6	-73.3	-11	0	0	0	111	E1295 K1378 Y1630 Q1631 K1634	E1295-D1299 WeakPolarHBondContact O-CB 2.89Å; E1295-D1299 PolarHBondContact O-N 2.77Å; D1299-K1378 PolarHBondContact O-NZ 3.39Å; D1299-Y1630 HydrophobicContact CB-CE1 3.9Å; D1299-Y1630 VanDerWaalsContact CG-CE1 3.42Å; D1299-Y1630 WeakPolarHBondContact OD1-CE1 3.29Å; D1299-Y1630 PolarHBondContact OD1-OH 2.96Å; D1299-Q1631 PolarHBondContact OD2-NE2 3.23Å; D1299-Q1631 VanDerWaalsContact OD2-NE2 3.14Å; D1299-K1634 IonicContact OD2-NZ 2.71Å; D1299-K1634 PolarHBondContact OD2-NZ 3.07Å
1300	G	84	Confident	86.6	Confident	29 Å²	29	45.8 Å²	45.8	30%	0.299	24%	0.236	S	C	.	.			trans	76.6	-173.8	-166.1	0	0	0	0	0	112.3	R1244 S1296	R1244-G1300 PolarHBondContact NH2-O 3.37Å; S1296-G1300 PolarHBondContact O-N 2.81Å; S1296-G1300 VanDerWaalsContact O-N 3.15Å
1301	N	84.2	Confident	86.8	Confident	86 Å²	86	48.1 Å²	48.1	46%	0.46	25%	0.253	S	S	.	.			trans	-82	124.4	170.2	-175.1	40.9	0	0	0	110.7	R1244 E1303	R1244-N1301 PolarHBondContact NH1-OD1 3.47Å; N1301-E1303 PolarHBondContact ND2-O 2.89Å; N1301-E1303 PolarHBondContact OD1-N 2.74Å
1302	T	88	Confident	87.3	Confident	13 Å²	13	48.9 Å²	48.9	8%	0.08	25%	0.254	C	S	.	.			trans	-117.2	1.1	-179.3	47.9	0	0	0	0	112.4	R1244 D1628 Y1630 Q1631	R1244-T1302 PolarHBondContact NH1-OG1 2.82Å; T1302-D1628 VanDerWaalsContact CB-OD1 3.29Å; T1302-D1628 WeakPolarHBondContact CB-OD1 3.13Å; T1302-D1628 PolarHBondContact OG1-OD1 3.01Å; T1302-D1628 PolarHBondContact OG1-OD2 3.26Å; T1302-Y1630 HydrophobicContact CG2-CD1 3.8Å; T1302-Y1630 HydrophobicContact CG2-CG 3.83Å; T1302-Q1631 WeakPolarHBondContact OG1-CG 3.31Å
1303	E	88.4	Confident	87.6	Confident	31 Å²	31	49.1 Å²	49.1	15%	0.145	25%	0.254	C	S	.	.			trans	-83	131.8	177	-172.8	171	107.9	0	0	111.6	N1301 R1620 V1626 I1627 D1628	N1301-E1303 PolarHBondContact ND2-O 2.89Å; N1301-E1303 PolarHBondContact OD1-N 2.74Å; E1303-R1620 IonicContact OE2-CZ 2.78Å; E1303-R1620 VanDerWaalsContact OE2-CZ 3.26Å; E1303-R1620 IonicContact OE2-NH1 3.45Å; E1303-R1620 PolarHBondContact OE2-NH1 3.16Å; E1303-R1620 IonicContact OE2-NH2 2.72Å; E1303-R1620 PolarHBondContact OE2-NH2 2.75Å; E1303-V1626 HydrophobicContact CG-CB 3.93Å; E1303-V1626 HydrophobicContact CG-CG2 4.04Å; E1303-I1627 WeakPolarHBondContact CA-O 3.16Å; E1303-D1628 HydrophobicContact CB-CB 4.14Å; E1303-D1628 HydrophobicContact CG-CB 4.39Å; E1303-D1628 PolarHBondContact N-OD2 2.8Å
1304	V	89.7	Confident	87.7	Confident	15 Å²	15	49.3 Å²	49.3	9%	0.091	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	127	-174	-172.2	0	0	0	0	108.9	N1308 H1312 V1626 I1627	V1304-N1308 HydrophobicContact CG1-CB 3.85Å; V1304-H1312 HydrophobicContact CG1-CB 3.85Å; V1304-H1312 HydrophobicContact CG2-CB 4.23Å; V1304-H1312 WeakPolarHBondContact CG2-ND1 3.18Å; V1304-V1626 CarbonylContact O-C 3.59Å; V1304-V1626 WeakPolarHBondContact O-CA 3.2Å; V1304-I1627 PolarHBondContact N-O 3.15Å; V1304-I1627 PolarHBondContact O-N 3.03Å
1305	S	87	Confident	87.8	Confident	38 Å²	38	51.4 Å²	51.4	27%	0.266	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	142.4	170	179.4	0	0	0	0	110.5	R1307 N1308 L1309	S1305-R1307 PolarHBondContact O-N 2.74Å; S1305-N1308 WeakPolarHBondContact O-CA 3.12Å; S1305-N1308 PolarHBondContact O-N 2.78Å; S1305-L1309 PolarHBondContact O-N 2.51Å
1306	A	88.6	Confident	88	Confident	18 Å²	18	51.4 Å²	51.4	15%	0.149	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-44.5	-43.2	179.4	0	0	0	0	0	113.7	N1308 L1309 L1621 S1625 L1661	A1306-N1308 PolarHBondContact O-N 3.19Å; A1306-L1309 WeakPolarHBondContact O-CB 2.84Å; A1306-L1309 PolarHBondContact O-N 2.69Å; A1306-L1309 VanDerWaalsContact O-N 3.07Å; A1306-L1621 HydrophobicContact CB-CD1 3.67Å; A1306-S1625 WeakPolarHBondContact CB-O 3.32Å; A1306-S1625 PolarHBondContact N-O 2.91Å; A1306-L1661 HydrophobicContact CB-CD1 4.1Å; A1306-L1661 HydrophobicContact CB-CD2 4.11Å
1307	R	87.3	Confident	88.1	Confident	229 Å²	229	50.9 Å²	50.9	86%	0.864	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-60.8	-26	179	-55.9	179.3	-171.9	168.4	3.5	113.9	S1305	S1305-R1307 PolarHBondContact O-N 2.74Å
1308	N	90.3	Very high	88	Confident	26 Å²	26	50.3 Å²	50.3	14%	0.139	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-100.6	1.9	-179.9	-69.7	-28.5	0	0	0	112.8	N942 V1304 S1305 A1306 Y1310 T1311 H1312	N942-N1308 PolarHBondContact OD1-ND2 3.28Å; V1304-N1308 HydrophobicContact CG1-CB 3.85Å; S1305-N1308 WeakPolarHBondContact O-CA 3.12Å; S1305-N1308 PolarHBondContact O-N 2.78Å; A1306-N1308 PolarHBondContact O-N 3.19Å; N1308-Y1310 PolarHBondContact O-N 2.7Å; N1308-T1311 PolarHBondContact O-N 2.89Å; N1308-T1311 PolarHBondContact O-OG1 3.03Å; N1308-T1311 VanDerWaalsContact O-OG1 3.06Å; N1308-H1312 VanDerWaalsContact O-CB 3.32Å; N1308-H1312 WeakPolarHBondContact O-CB 3.48Å; N1308-H1312 PolarHBondContact O-N 3.2Å
1309	L	90.7	Very high	87.9	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-58.6	-46.9	-178.9	-177	67.8	0	0	0	111.5	S1305 A1306 T1311 H1312 I1313 I1627 Y1654 T1657 L1658 L1661	S1305-L1309 PolarHBondContact O-N 2.51Å; A1306-L1309 WeakPolarHBondContact O-CB 2.84Å; A1306-L1309 PolarHBondContact O-N 2.69Å; A1306-L1309 VanDerWaalsContact O-N 3.07Å; L1309-T1311 PolarHBondContact O-N 2.77Å; L1309-H1312 PolarHBondContact O-N 3.03Å; L1309-I1313 HydrophobicContact CD1-CD1 4.03Å; L1309-I1313 HydrophobicContact CD1-CG1 4.28Å; L1309-I1313 HydrophobicContact CD2-CD1 4.18Å; L1309-I1313 HydrophobicContact CG-CD1 3.74Å; L1309-I1313 HydrophobicContact CG-CG1 4.34Å; L1309-I1313 WeakPolarHBondContact O-CB 2.86Å; L1309-I1313 WeakPolarHBondContact O-CG1 2.88Å; L1309-I1313 PolarHBondContact O-N 3.11Å; L1309-I1627 HydrophobicContact CB-CD1 4.14Å; L1309-I1627 HydrophobicContact CD1-CD1 3.72Å; L1309-I1627 HydrophobicContact CD1-CG2 4.31Å; L1309-I1627 HydrophobicContact CD2-CD1 3.65Å; L1309-I1627 HydrophobicContact CG-CD1 4.01Å; L1309-Y1654 HydrophobicContact CD1-CD1 3.9Å; L1309-Y1654 HydrophobicContact CD1-CE1 4.18Å; L1309-T1657 HydrophobicContact CD2-CG2 4Å; L1309-L1658 HydrophobicContact CD2-CB 3.94Å; L1309-L1658 HydrophobicContact CD2-CD1 4.31Å; L1309-L1661 HydrophobicContact CB-CD1 4.19Å; L1309-L1661 HydrophobicContact CD2-CD1 3.76Å
1310	Y	90.9	Very high	87.1	Confident	134 Å²	134	55.4 Å²	55.4	53%	0.525	28%	0.279	S	S	.	.	H	α-helix	trans	-58.5	-49.2	179.2	-177.5	-90.9	0	0	0	111.8	N1308 H1312 I1313 Q1314 L1658	N1308-Y1310 PolarHBondContact O-N 2.7Å; Y1310-H1312 VanDerWaalsContact C-N 3.31Å; Y1310-H1312 PolarHBondContact O-N 2.98Å; Y1310-I1313 PolarHBondContact O-N 3.19Å; Y1310-Q1314 HydrophobicContact CD1-CG 4.14Å; Y1310-Q1314 HydrophobicContact CE1-CG 3.78Å; Y1310-Q1314 WeakPolarHBondContact O-CG 3.18Å; Y1310-Q1314 PolarHBondContact O-N 3.2Å; Y1310-Q1314 PolarHBondContact OH-NE2 3.49Å; Y1310-L1658 HydrophobicContact CD2-CD1 4.33Å; Y1310-L1658 HydrophobicContact CD2-CD2 3.98Å
1311	T	90.7	Very high	85.7	Confident	67 Å²	67	57.6 Å²	57.6	41%	0.411	29%	0.286	S	S	.	.	H	α-helix	trans	-68.2	-31.6	-178.5	54.9	0	0	0	0	112.3	N1308 L1309 H1315	N1308-T1311 PolarHBondContact O-N 2.89Å; N1308-T1311 PolarHBondContact O-OG1 3.03Å; N1308-T1311 VanDerWaalsContact O-OG1 3.06Å; L1309-T1311 PolarHBondContact O-N 2.77Å; T1311-H1315 PolarHBondContact O-N 3.25Å
1312	H	91.3	Very high	83.9	Confident	37 Å²	37	56.7 Å²	56.7	17%	0.171	28%	0.284	C	S	.	.	H	α-helix	trans	-69.6	-43.6	171.5	178.9	92.3	0	0	0	112.6	V1304 N1308 L1309 Y1310 Q1314 H1315 L1316 Y1654	V1304-H1312 HydrophobicContact CG1-CB 3.85Å; V1304-H1312 HydrophobicContact CG2-CB 4.23Å; V1304-H1312 WeakPolarHBondContact CG2-ND1 3.18Å; N1308-H1312 VanDerWaalsContact O-CB 3.32Å; N1308-H1312 WeakPolarHBondContact O-CB 3.48Å; N1308-H1312 PolarHBondContact O-N 3.2Å; L1309-H1312 PolarHBondContact O-N 3.03Å; Y1310-H1312 VanDerWaalsContact C-N 3.31Å; Y1310-H1312 PolarHBondContact O-N 2.98Å; H1312-Q1314 VanDerWaalsContact C-N 3.31Å; H1312-Q1314 PolarHBondContact O-N 2.82Å; H1312-H1315 PolarHBondContact O-N 3.11Å; H1312-H1315 VanDerWaalsContact O-N 3.14Å; H1312-L1316 VanDerWaalsContact NE2-CD1 3.32Å; H1312-L1316 WeakPolarHBondContact NE2-CD1 3.46Å; H1312-L1316 PolarHBondContact O-N 2.75Å; H1312-Y1654 AromaticContact CD2-CE1 3.61Å; H1312-Y1654 AromaticContact NE2-CE1 3.7Å; H1312-Y1654 AromaticContact NE2-CZ 3.85Å; H1312-Y1654 PolarHBondContact NE2-OH 3.2Å
1313	I	91.3	Very high	81.6	Confident	13 Å²	13	63.3 Å²	63.3	7%	0.067	32%	0.319	C	S	.	.	H	α-helix	trans	-60.9	-40.2	174.5	-73.1	171.9	0	0	0	111.1	L1309 Y1310 S1317 F1372 Y1654 L1658	L1309-I1313 HydrophobicContact CD1-CD1 4.03Å; L1309-I1313 HydrophobicContact CD1-CG1 4.28Å; L1309-I1313 HydrophobicContact CD2-CD1 4.18Å; L1309-I1313 HydrophobicContact CG-CD1 3.74Å; L1309-I1313 HydrophobicContact CG-CG1 4.34Å; L1309-I1313 WeakPolarHBondContact O-CB 2.86Å; L1309-I1313 WeakPolarHBondContact O-CG1 2.88Å; L1309-I1313 PolarHBondContact O-N 3.11Å; Y1310-I1313 PolarHBondContact O-N 3.19Å; I1313-S1317 WeakPolarHBondContact O-CB 3.39Å; I1313-S1317 PolarHBondContact O-N 3Å; I1313-S1317 PolarHBondContact O-OG 3.26Å; I1313-F1372 HydrophobicContact CG2-CZ 4.28Å; I1313-Y1654 HydrophobicContact CD1-CD1 4.06Å; I1313-Y1654 WeakPolarHBondContact CD1-O 3.24Å; I1313-Y1654 HydrophobicContact CG1-CD1 3.66Å; I1313-Y1654 HydrophobicContact CG1-CG 4.28Å; I1313-L1658 HydrophobicContact CD1-CB 4.09Å; I1313-L1658 HydrophobicContact CD1-CD2 4.23Å
1314	Q	90.2	Very high	79.1	Confident	89 Å²	89	66.7 Å²	66.7	42%	0.416	34%	0.342	S	S	.	.	H	α-helix	trans	-61.5	-48.3	172.3	-67.3	-59.3	-26.5	0	0	110.7	Y1310 H1312 L1316 S1317 I1318	Y1310-Q1314 HydrophobicContact CD1-CG 4.14Å; Y1310-Q1314 HydrophobicContact CE1-CG 3.78Å; Y1310-Q1314 WeakPolarHBondContact O-CG 3.18Å; Y1310-Q1314 PolarHBondContact O-N 3.2Å; Y1310-Q1314 PolarHBondContact OH-NE2 3.49Å; H1312-Q1314 VanDerWaalsContact C-N 3.31Å; H1312-Q1314 PolarHBondContact O-N 2.82Å; Q1314-L1316 PolarHBondContact O-N 3.11Å; Q1314-S1317 WeakPolarHBondContact O-CB 3.41Å; Q1314-S1317 PolarHBondContact O-N 3.16Å; Q1314-I1318 WeakPolarHBondContact O-CG1 3.36Å; Q1314-I1318 PolarHBondContact O-N 2.8Å
1315	H	88.8	Confident	76.4	Confident	51 Å²	51	72.6 Å²	72.6	24%	0.236	38%	0.378	C	S	.	.	H	α-helix	trans	-60.9	-42	177.8	-176.3	-117.9	0	0	0	113.4	T1311 H1312 S1317 I1318	T1311-H1315 PolarHBondContact O-N 3.25Å; H1312-H1315 PolarHBondContact O-N 3.11Å; H1312-H1315 VanDerWaalsContact O-N 3.14Å; H1315-S1317 PolarHBondContact O-N 2.75Å; H1315-I1318 PolarHBondContact O-N 2.8Å
1316	L	89.5	Confident	73.9	Confident	9 Å²	9	77.8 Å²	77.8	5%	0.047	40%	0.401	C	S	.	.	H	α-helix	trans	-67.2	-20.6	174.7	-70.2	-172.4	0	0	0	113.2	H1312 Q1314 T1370 G1371 F1372 Y1654	H1312-L1316 VanDerWaalsContact NE2-CD1 3.32Å; H1312-L1316 WeakPolarHBondContact NE2-CD1 3.46Å; H1312-L1316 PolarHBondContact O-N 2.75Å; Q1314-L1316 PolarHBondContact O-N 3.11Å; L1316-T1370 WeakPolarHBondContact O-CB 3.44Å; L1316-G1371 WeakPolarHBondContact O-CA 3.45Å; L1316-G1371 PolarHBondContact O-N 3.4Å; L1316-F1372 HydrophobicContact CB-CD1 4.05Å; L1316-F1372 HydrophobicContact CB-CD2 3.73Å; L1316-F1372 HydrophobicContact CB-CE1 3.91Å; L1316-F1372 HydrophobicContact CB-CE2 3.58Å; L1316-F1372 HydrophobicContact CB-CG 3.96Å; L1316-F1372 HydrophobicContact CB-CZ 3.68Å; L1316-F1372 HydrophobicContact CD1-CD1 3.78Å; L1316-F1372 HydrophobicContact CD1-CE1 3.53Å; L1316-F1372 HydrophobicContact CD1-CG 4.46Å; L1316-F1372 HydrophobicContact CD1-CZ 4.04Å; L1316-F1372 HydrophobicContact CG-CE1 4.4Å; L1316-F1372 VanDerWaalsContact O-CD2 3.25Å; L1316-F1372 WeakPolarHBondContact O-CD2 3.27Å; L1316-F1372 PolarHBondContact O-N 2.93Å; L1316-F1372 VanDerWaalsContact O-N 3.1Å; L1316-Y1654 HydrophobicContact CD1-CE1 4.21Å; L1316-Y1654 HydrophobicContact CD1-CE2 4.28Å
1317	S	87.2	Confident	71.1	Confident	39 Å²	39	81.8 Å²	81.8	27%	0.273	43%	0.428	S	S	.	.	H	α-helix	trans	-80.6	-18.2	175.3	-58.9	0	0	0	0	113.5	I1313 Q1314 H1315	I1313-S1317 WeakPolarHBondContact O-CB 3.39Å; I1313-S1317 PolarHBondContact O-N 3Å; I1313-S1317 PolarHBondContact O-OG 3.26Å; Q1314-S1317 WeakPolarHBondContact O-CB 3.41Å; Q1314-S1317 PolarHBondContact O-N 3.16Å; H1315-S1317 PolarHBondContact O-N 2.75Å
1318	I	84.5	Confident	68.5	Low	66 Å²	66	75.9 Å²	75.9	34%	0.338	42%	0.422	S	S	.	.	S	Bend	trans	-75.3	138.7	-179.9	-57.6	167.4	0	0	0	110.3	T947 Q1314 H1315 T1370	T947-I1318 HydrophobicContact CG2-CB 4.28Å; T947-I1318 HydrophobicContact CG2-CD1 4.28Å; T947-I1318 HydrophobicContact CG2-CG2 3.81Å; Q1314-I1318 WeakPolarHBondContact O-CG1 3.36Å; Q1314-I1318 PolarHBondContact O-N 2.8Å; H1315-I1318 PolarHBondContact O-N 2.8Å; I1318-T1370 WeakPolarHBondContact O-CA 3.33Å
1319	L	80	Confident	65.6	Low	113 Å²	113	80.2 Å²	80.2	59%	0.592	45%	0.449	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.7	122.5	173.3	-64.7	168.9	0	0	0	110.7	G1368 T1370	L1319-G1368 WeakPolarHBondContact CD2-O 3.19Å; L1319-T1370 HydrophobicContact CD2-CG2 3.76Å
1320	Q	67	Low	62.8	Low	61 Å²	61	87.5 Å²	87.5	29%	0.285	49%	0.488	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	130.4	177.7	-58.6	-174.5	4.6	0	0	110.6	T1322 G1368 L1369 L1374	Q1320-T1322 PolarHBondContact O-N 3.14Å; Q1320-G1368 VanDerWaalsContact O-CA 3.27Å; Q1320-G1368 WeakPolarHBondContact O-CA 3.36Å; Q1320-L1369 PolarHBondContact N-O 2.9Å; Q1320-L1369 PolarHBondContact O-N 2.88Å; Q1320-L1374 HydrophobicContact CB-CD1 3.99Å; Q1320-L1374 HydrophobicContact CG-CD1 4.3Å
1321	T	53.3	Low	59.8	Low	75 Å²	75	86.3 Å²	86.3	46%	0.46	49%	0.491	S	S	.	.			trans	-87.6	103.7	177.6	38.5	0	0	0	0	111	I950 N1323	I950-T1321 HydrophobicContact CD1-CG2 4.47Å; T1321-N1323 PolarHBondContact O-N 3.09Å
1322	T	47.5	Very low	56.8	Low	67 Å²	67	91.3 Å²	91.3	41%	0.411	50%	0.504	S	S	.	.			trans	-82.6	106.3	179.4	43.7	0	0	0	0	111.2	Q1320 T1324 L1374	Q1320-T1322 PolarHBondContact O-N 3.14Å; T1322-T1324 PolarHBondContact O-N 2.64Å; T1322-L1374 HydrophobicContact CG2-CD2 4.35Å
1323	N	39	Very low	54	Low	151 Å²	151	98.8 Å²	98.8	81%	0.807	54%	0.541	S	S	*	.			trans	-74.7	56.2	172.1	-77.3	-5.7	0	0	0	112.1	T1321	T1321-N1323 PolarHBondContact O-N 3.09Å
1324	T	36.2	Very low	51.1	Low	103 Å²	103	102 Å²	102	63%	0.632	56%	0.564	S	S	*	*			trans	-93.5	111.7	168.7	42.9	0	0	0	0	109.3	T1322 I1326	T1322-T1324 PolarHBondContact O-N 2.64Å; T1324-I1326 PolarHBondContact O-N 2.76Å; T1324-I1326 VanDerWaalsContact O-N 3.13Å
1325	T	33.5	Very low	48.2	Very low	138 Å²	138	104.6 Å²	104.6	85%	0.847	58%	0.581	S	S	*	*			trans	-59.2	111.3	165.5	39.8	0	0	0	0	109.6	S1327	T1325-S1327 PolarHBondContact O-N 3.01Å
1326	I	33.6	Very low	45.4	Very low	147 Å²	147	112.4 Å²	112.4	75%	0.754	62%	0.615	S	S	*	*			trans	-73.3	96.2	176.3	-57.6	174.3	0	0	0	108.1	T1324 S1328	T1324-I1326 PolarHBondContact O-N 2.76Å; T1324-I1326 VanDerWaalsContact O-N 3.13Å; I1326-S1328 PolarHBondContact O-N 2.87Å
1327	S	31.5	Very low	42.6	Very low	102 Å²	102	119 Å²	119	71%	0.713	65%	0.65	S	S	*	*			trans	-62.9	118.7	157.7	40.2	0	0	0	0	107.9	T1325 T1329	T1325-S1327 PolarHBondContact O-N 3.01Å; S1327-T1329 PolarHBondContact O-N 3.27Å
1328	S	31.2	Very low	39.9	Very low	106 Å²	106	124.7 Å²	124.7	74%	0.741	68%	0.678	S	S	*	*			trans	-82	90	-163.1	57.9	0	0	0	0	113.1	I1326	I1326-S1328 PolarHBondContact O-N 2.87Å
1329	T	30.7	Very low	37.3	Very low	116 Å²	116	127.3 Å²	127.3	71%	0.712	70%	0.699	S	S	*	*			trans	-122.2	87	156	55.2	0	0	0	0	109.4	S1327 D1331	S1327-T1329 PolarHBondContact O-N 3.27Å; T1329-D1331 PolarHBondContact O-N 2.82Å
1330	N	30.6	Very low	34.9	Very low	153 Å²	153	129.7 Å²	129.7	82%	0.818	71%	0.711	S	S	*	*			trans	-69.3	106.9	165.5	-75	-34	0	0	0	108.5
1331	D	28.9	Very low	33.1	Very low	109 Å²	109	133.1 Å²	133.1	58%	0.583	74%	0.737	S	S	*	*			trans	-160.1	161.5	158	-101.6	-39.2	0	0	0	110.3	T1329	T1329-D1331 PolarHBondContact O-N 2.82Å
1332	Y	27.9	Very low	32.1	Very low	173 Å²	173	135.5 Å²	135.5	68%	0.678	75%	0.751	S	S	*	*	S	Bend	trans	65.2	37.6	176.1	-51.1	-72.4	0	0	0	118.2
1333	M	31	Very low	31.2	Very low	194 Å²	194	138.1 Å²	138.1	96%	0.956	77%	0.767	S	S	*	*	S	Bend	trans	-126.5	13.9	162.9	-92	-168.5	68	0	0	115.5
1334	S	31.9	Very low	30.9	Very low	79 Å²	79	138.8 Å²	138.8	55%	0.552	77%	0.769	S	S	*	*	S	Bend	trans	-107.5	-25.3	-178.2	46.6	0	0	0	0	115.4	F1336	S1334-F1336 PolarHBondContact O-N 2.86Å
1335	N	28	Very low	30.7	Very low	145 Å²	145	139.5 Å²	139.5	78%	0.775	77%	0.773	S	S	*	*			trans	-103	52	-166.2	-74.6	-11.1	0	0	0	114.8
1336	F	29.9	Very low	30.8	Very low	215 Å²	215	138 Å²	138	94%	0.943	77%	0.766	S	S	*	*			trans	-140.3	45	163.6	-101	-71.7	0	0	0	112.5	S1334	S1334-F1336 PolarHBondContact O-N 2.86Å
1337	N	31.8	Very low	30.8	Very low	147 Å²	147	136.4 Å²	136.4	79%	0.786	76%	0.764	S	S	*	*			trans	-109.8	148.7	164.3	-78.8	-54.1	0	0	0	110.1
1338	N	30.5	Very low	30.9	Very low	159 Å²	159	137.3 Å²	137.3	85%	0.85	77%	0.765	S	S	*	*			trans	-59.9	152.8	-173.9	-61.9	-64.1	0	0	0	113.6
1339	P	29.7	Very low	31.1	Very low	120 Å²	120	137.8 Å²	137.8	78%	0.779	76%	0.763	S	S	*	*				-137.3	108.6	127.9	34.3	-21	0	0	0	113
1340	L	28.7	Very low	31.1	Very low	163 Å²	163	137 Å²	137	85%	0.853	76%	0.763	S	S	*	*			trans	-159.9	57	158.6	-117.3	168.4	0	0	0	112
1341	T	30.9	Very low	31.4	Very low	134 Å²	134	135 Å²	135	82%	0.822	76%	0.756	S	S	*	*			trans	-140.4	94.5	169.4	47.8	0	0	0	0	109.6
1342	T	31.8	Very low	31.6	Very low	125 Å²	125	136.7 Å²	136.7	77%	0.767	77%	0.765	S	S	*	*			trans	-85.6	127.9	172.4	45	0	0	0	0	110.6
1343	T	28.7	Very low	32.1	Very low	121 Å²	121	134.9 Å²	134.9	74%	0.742	77%	0.772	S	S	*	*			trans	32.2	125.7	148.9	54.1	0	0	0	0	118.4
1344	I	32.8	Very low	32	Very low	166 Å²	166	133.1 Å²	133.1	85%	0.851	77%	0.766	S	S	*	*				-146.7	153.9	78.5	-86.4	148.8	0	0	0	112.7
1345	T	30.8	Very low	32.2	Very low	117 Å²	117	135.8 Å²	135.8	72%	0.718	77%	0.774	S	S	*	*			trans	-100.6	-176.6	-176.2	50.7	0	0	0	0	112.6
1346	P	35.8	Very low	32.5	Very low	106 Å²	106	134.7 Å²	134.7	69%	0.688	77%	0.768	S	S	*	*			cis	-131.6	-167.2	-49.9	36.7	-18.7	0	0	0	111.2
1347	T	33.1	Very low	32.6	Very low	115 Å²	115	131.7 Å²	131.7	71%	0.706	76%	0.761	S	S	*	*				153.8	133.8	123	51.1	0	0	0	0	114.2
1348	T	34.6	Very low	32.6	Very low	120 Å²	120	129 Å²	129	74%	0.736	75%	0.753	S	S	*	*			trans	56.3	141	143.8	58.7	0	0	0	0	120.8
1349	T	34.2	Very low	32.7	Very low	116 Å²	116	127.8 Å²	127.8	71%	0.712	75%	0.747	S	S	*	*			cis	-167.5	159.9	0.3	11.6	0	0	0	0	110.9
1350	S	32.1	Very low	32.7	Very low	101 Å²	101	128.9 Å²	128.9	71%	0.706	75%	0.747	S	S	*	*			trans	61.8	144	146.7	59.6	0	0	0	0	120.6
1351	T	35.7	Very low	32.8	Very low	110 Å²	110	126.8 Å²	126.8	68%	0.675	74%	0.741	S	S	*	*			cis	-168.8	146.8	-6.5	18.4	0	0	0	0	110.3
1352	N	34	Very low	32.7	Very low	145 Å²	145	127.7 Å²	127.7	78%	0.775	75%	0.746	S	S	*	*			trans	59.4	150.4	145.5	-52	-10.9	0	0	0	118.8
1353	T	37.7	Very low	32.7	Very low	134 Å²	134	126.8 Å²	126.8	82%	0.822	74%	0.741	S	S	*	*			cis	-136	161.8	23.8	43.2	0	0	0	0	114.1
1354	L	29.1	Very low	32.7	Very low	158 Å²	158	127.9 Å²	127.9	83%	0.827	75%	0.748	S	S	*	*			trans	-97.4	-175.1	174	-90.8	91.3	0	0	0	112.9
1355	N	36.3	Very low	32.7	Very low	134 Å²	134	126 Å²	126	72%	0.717	74%	0.739	S	S	*	*			trans	113.4	136.1	165.2	-71	51	0	0	0	113.6
1356	D	34.8	Very low	33.1	Very low	122 Å²	122	125.3 Å²	125.3	65%	0.652	74%	0.739	S	S	*	*			cis	-146.5	131.4	-14.1	-85.3	-45.2	0	0	0	107.3
1357	L	32.4	Very low	33.9	Very low	153 Å²	153	127.3 Å²	127.3	80%	0.801	74%	0.743	S	S	*	*				73.5	116.8	80.6	-109.6	171.5	0	0	0	117.1
1358	S	31.3	Very low	35.4	Very low	89 Å²	89	122.7 Å²	122.7	62%	0.622	72%	0.718	S	S	*	*			trans	96.1	145.9	151.5	81.2	0	0	0	0	122
1359	N	31.6	Very low	37.6	Very low	134 Å²	134	118.1 Å²	118.1	72%	0.717	69%	0.689	S	S	*	*			trans	64.4	102	159.2	-49.7	-30.3	0	0	0	117.6
1360	N	29.9	Very low	40.1	Very low	144 Å²	144	113.7 Å²	113.7	77%	0.77	66%	0.662	S	S	*	*				-173.2	160.8	59.4	-89.6	-46.8	0	0	0	113.9
1361	T	32.1	Very low	42.7	Very low	119 Å²	119	109 Å²	109	73%	0.73	63%	0.63	S	S	*	*			trans	34.8	113.6	154.2	55.5	0	0	0	0	120	T1363	T1361-T1363 PolarHBondContact O-N 3.04Å; T1361-T1363 VanDerWaalsContact O-N 3.16Å
1362	T	27.1	Very low	45.3	Very low	153 Å²	153	104 Å²	104	94%	0.939	60%	0.599	S	S	*	*			trans	-60.6	107.4	169.6	48.2	0	0	0	0	113.3
1363	T	31.7	Very low	47.9	Very low	106 Å²	106	99.3 Å²	99.3	65%	0.65	57%	0.572	S	S	*	*			trans	-104.8	128.8	162.8	53.3	0	0	0	0	110.3	T1361 N1365	T1361-T1363 PolarHBondContact O-N 3.04Å; T1361-T1363 VanDerWaalsContact O-N 3.16Å; T1363-N1365 PolarHBondContact O-N 2.96Å; T1363-N1365 PolarHBondContact OG1-OD1 2.05Å
1364	T	29.2	Very low	50.2	Low	144 Å²	144	95.1 Å²	95.1	88%	0.883	55%	0.545	S	S	*	.			trans	-72.9	88.8	176.5	48.9	0	0	0	0	110.1	S1366	T1364-S1366 PolarHBondContact O-N 3.15Å
1365	N	32.9	Very low	53	Low	126 Å²	126	88.7 Å²	88.7	67%	0.674	51%	0.51	S	S	*	.			trans	-65.2	106.7	177.9	-73.2	-3.8	0	0	0	110.2	T1363 L1367	T1363-N1365 PolarHBondContact O-N 2.96Å; T1363-N1365 PolarHBondContact OG1-OD1 2.05Å; N1365-L1367 PolarHBondContact O-N 3.22Å
1366	S	39.2	Very low	55.5	Low	102 Å²	102	83 Å²	83	71%	0.713	48%	0.479	S	S	*	.			trans	-62.8	101.8	160.7	53.5	0	0	0	0	108.2	T1364 G1368	T1364-S1366 PolarHBondContact O-N 3.15Å; S1366-G1368 PolarHBondContact O-N 2.84Å
1367	L	53.8	Low	58	Low	148 Å²	148	83.5 Å²	83.5	78%	0.775	47%	0.472	S	S	*	.			trans	-61.7	106.7	174.7	-88.5	80.5	0	0	0	108.7	N1365	N1365-L1367 PolarHBondContact O-N 3.22Å
1368	G	63.6	Low	60.5	Low	18 Å²	18	80.1 Å²	80.1	19%	0.186	45%	0.451	C	S	.	.			trans	-58.3	146.1	165.8	0	0	0	0	0	109.6	L1319 Q1320 S1366	L1319-G1368 WeakPolarHBondContact CD2-O 3.19Å; Q1320-G1368 VanDerWaalsContact O-CA 3.27Å; Q1320-G1368 WeakPolarHBondContact O-CA 3.36Å; S1366-G1368 PolarHBondContact O-N 2.84Å
1369	L	80	Confident	63	Low	25 Å²	25	75.9 Å²	75.9	13%	0.131	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	140.7	179.1	-64.4	171.4	0	0	0	108.6	Q1320 Q1373 L1374	Q1320-L1369 PolarHBondContact N-O 2.9Å; Q1320-L1369 PolarHBondContact O-N 2.88Å; L1369-Q1373 HydrophobicContact CB-CB 4.1Å; L1369-Q1373 HydrophobicContact CD2-CB 4.33Å; L1369-L1374 HydrophobicContact CB-CD1 4.37Å; L1369-L1374 HydrophobicContact CB-CD2 3.99Å; L1369-L1374 HydrophobicContact CB-CG 3.83Å; L1369-L1374 HydrophobicContact CD1-CD2 3.69Å; L1369-L1374 HydrophobicContact CD1-CG 4.4Å; L1369-L1374 HydrophobicContact CG-CD2 4.49Å
1370	T	88.1	Confident	65.3	Low	23 Å²	23	72 Å²	72	14%	0.141	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	157.9	170.5	61.9	0	0	0	0	110.1	L1316 I1318 L1319 F1372 Q1373 L1374	L1316-T1370 WeakPolarHBondContact O-CB 3.44Å; I1318-T1370 WeakPolarHBondContact O-CA 3.33Å; L1319-T1370 HydrophobicContact CD2-CG2 3.76Å; T1370-F1372 PolarHBondContact O-N 2.86Å; T1370-Q1373 VanDerWaalsContact N-OE1 3.11Å; T1370-Q1373 WeakPolarHBondContact O-CB 2.88Å; T1370-Q1373 PolarHBondContact O-N 2.88Å; T1370-Q1373 VanDerWaalsContact O-N 3.08Å; T1370-Q1373 WeakPolarHBondContact OG1-CB 3.19Å; T1370-Q1373 VanDerWaalsContact OG1-CG 3.25Å; T1370-Q1373 WeakPolarHBondContact OG1-CG 3.44Å; T1370-Q1373 PolarHBondContact OG1-N 2.84Å; T1370-L1374 PolarHBondContact O-N 3.41Å
1371	G	86.2	Confident	67.4	Low	3 Å²	3	73.5 Å²	73.5	3%	0.031	40%	0.4	C	S	.	.	H	α-helix	trans	-55.4	-41.7	169.1	0	0	0	0	0	111.6	L1316 Q1373 L1374 E1375	L1316-G1371 WeakPolarHBondContact O-CA 3.45Å; L1316-G1371 PolarHBondContact O-N 3.4Å; G1371-Q1373 VanDerWaalsContact C-N 3.32Å; G1371-Q1373 PolarHBondContact O-N 3.12Å; G1371-L1374 PolarHBondContact O-N 3.35Å; G1371-E1375 WeakPolarHBondContact O-CB 3.32Å; G1371-E1375 PolarHBondContact O-N 3.32Å
1372	F	89.8	Confident	68.8	Low	3 Å²	3	70.4 Å²	70.4	1%	0.013	38%	0.379	C	S	.	.	H	α-helix	trans	-54.7	-43.6	172.3	-70.8	-65.7	0	0	0	113	I1313 L1316 T1370 F1376 R1651 Y1654	I1313-F1372 HydrophobicContact CG2-CZ 4.28Å; L1316-F1372 HydrophobicContact CB-CD1 4.05Å; L1316-F1372 HydrophobicContact CB-CD2 3.73Å; L1316-F1372 HydrophobicContact CB-CE1 3.91Å; L1316-F1372 HydrophobicContact CB-CE2 3.58Å; L1316-F1372 HydrophobicContact CB-CG 3.96Å; L1316-F1372 HydrophobicContact CB-CZ 3.68Å; L1316-F1372 HydrophobicContact CD1-CD1 3.78Å; L1316-F1372 HydrophobicContact CD1-CE1 3.53Å; L1316-F1372 HydrophobicContact CD1-CG 4.46Å; L1316-F1372 HydrophobicContact CD1-CZ 4.04Å; L1316-F1372 HydrophobicContact CG-CE1 4.4Å; L1316-F1372 VanDerWaalsContact O-CD2 3.25Å; L1316-F1372 WeakPolarHBondContact O-CD2 3.27Å; L1316-F1372 PolarHBondContact O-N 2.93Å; L1316-F1372 VanDerWaalsContact O-N 3.1Å; T1370-F1372 PolarHBondContact O-N 2.86Å; F1372-F1376 VanDerWaalsContact O-CB 3.27Å; F1372-F1376 WeakPolarHBondContact O-CB 3.22Å; F1372-F1376 PolarHBondContact O-N 2.97Å; F1372-R1651 HydrophobicContact CD1-CG 4.45Å; F1372-R1651 HydrophobicContact CD2-CG 4.34Å; F1372-R1651 HydrophobicContact CE1-CG 4.32Å; F1372-R1651 HydrophobicContact CE2-CG 4.2Å; F1372-R1651 HydrophobicContact CG-CG 4.47Å; F1372-R1651 HydrophobicContact CZ-CG 4.2Å; F1372-Y1654 HydrophobicContact CD1-CD2 4.37Å; F1372-Y1654 HydrophobicContact CE1-CD1 4.45Å; F1372-Y1654 AromaticContact CE1-CD2 3.63Å; F1372-Y1654 HydrophobicContact CE1-CD2 3.63Å; F1372-Y1654 HydrophobicContact CE1-CE2 4.02Å; F1372-Y1654 AromaticContact CE1-CG 3.85Å; F1372-Y1654 HydrophobicContact CE1-CG 3.85Å; F1372-Y1654 HydrophobicContact CZ-CG 4.42Å
1373	Q	88.1	Confident	70.1	Confident	47 Å²	47	63.7 Å²	63.7	22%	0.22	34%	0.338	C	S	.	.	H	α-helix	trans	-66.1	-44.2	177.7	-81	164.9	-0.5	0	0	112.6	L1369 T1370 G1371 E1375 R1377 E1647	L1369-Q1373 HydrophobicContact CB-CB 4.1Å; L1369-Q1373 HydrophobicContact CD2-CB 4.33Å; T1370-Q1373 VanDerWaalsContact N-OE1 3.11Å; T1370-Q1373 WeakPolarHBondContact O-CB 2.88Å; T1370-Q1373 PolarHBondContact O-N 2.88Å; T1370-Q1373 VanDerWaalsContact O-N 3.08Å; T1370-Q1373 WeakPolarHBondContact OG1-CB 3.19Å; T1370-Q1373 VanDerWaalsContact OG1-CG 3.25Å; T1370-Q1373 WeakPolarHBondContact OG1-CG 3.44Å; T1370-Q1373 PolarHBondContact OG1-N 2.84Å; G1371-Q1373 VanDerWaalsContact C-N 3.32Å; G1371-Q1373 PolarHBondContact O-N 3.12Å; Q1373-E1375 VanDerWaalsContact C-N 3.35Å; Q1373-R1377 WeakPolarHBondContact O-CB 3.28Å; Q1373-R1377 VanDerWaalsContact O-CD 3.32Å; Q1373-R1377 WeakPolarHBondContact O-CD 3.08Å; Q1373-R1377 WeakPolarHBondContact O-CG 3.35Å; Q1373-R1377 PolarHBondContact O-N 2.77Å; Q1373-E1647 VanDerWaalsContact CG-OE1 3.28Å; Q1373-E1647 WeakPolarHBondContact CG-OE1 3.26Å; Q1373-E1647 WeakPolarHBondContact CG-OE2 3.4Å; Q1373-E1647 PolarHBondContact NE2-OE1 2.69Å
1374	L	86.2	Confident	71	Confident	47 Å²	47	60.3 Å²	60.3	25%	0.246	32%	0.318	C	S	.	.	H	α-helix	trans	-63.6	-44.3	178.4	-70.4	167	0	0	0	110.9	Q1320 T1322 L1369 T1370 G1371 R1377 K1378	Q1320-L1374 HydrophobicContact CB-CD1 3.99Å; Q1320-L1374 HydrophobicContact CG-CD1 4.3Å; T1322-L1374 HydrophobicContact CG2-CD2 4.35Å; L1369-L1374 HydrophobicContact CB-CD1 4.37Å; L1369-L1374 HydrophobicContact CB-CD2 3.99Å; L1369-L1374 HydrophobicContact CB-CG 3.83Å; L1369-L1374 HydrophobicContact CD1-CD2 3.69Å; L1369-L1374 HydrophobicContact CD1-CG 4.4Å; L1369-L1374 HydrophobicContact CG-CD2 4.49Å; T1370-L1374 PolarHBondContact O-N 3.41Å; G1371-L1374 PolarHBondContact O-N 3.35Å; L1374-R1377 PolarHBondContact O-N 3.48Å; L1374-K1378 PolarHBondContact O-N 2.94Å
1375	E	89.2	Confident	71.5	Confident	22 Å²	22	59.4 Å²	59.4	10%	0.103	31%	0.308	C	S	.	.	H	α-helix	trans	-67	-51.5	-179.9	-170.3	171	115	0	0	112	G1371 Q1373 R1377 K1378 I1379 Y1630 Y1650 Y1654	G1371-E1375 WeakPolarHBondContact O-CB 3.32Å; G1371-E1375 PolarHBondContact O-N 3.32Å; Q1373-E1375 VanDerWaalsContact C-N 3.35Å; E1375-R1377 VanDerWaalsContact C-N 3.26Å; E1375-R1377 PolarHBondContact O-N 3.19Å; E1375-K1378 WeakPolarHBondContact O-CA 3.13Å; E1375-K1378 WeakPolarHBondContact O-CB 3.4Å; E1375-K1378 PolarHBondContact O-N 3.44Å; E1375-I1379 PolarHBondContact O-N 3.43Å; E1375-I1379 VanDerWaalsContact O-N 3.13Å; E1375-Y1630 HydrophobicContact CG-CD2 3.47Å; E1375-Y1630 VanDerWaalsContact CG-CD2 3.47Å; E1375-Y1630 HydrophobicContact CG-CE2 4.09Å; E1375-Y1630 HydrophobicContact CG-CG 4.36Å; E1375-Y1650 HydrophobicContact CG-CE1 4.27Å; E1375-Y1650 VanDerWaalsContact OE1-CE1 3.28Å; E1375-Y1650 WeakPolarHBondContact OE1-CE1 3.23Å; E1375-Y1650 VanDerWaalsContact OE1-CZ 3.32Å; E1375-Y1650 PolarHBondContact OE1-OH 2.62Å; E1375-Y1654 PolarHBondContact OE1-OH 3.22Å
1376	F	89.1	Confident	72	Confident	14 Å²	14	55.5 Å²	55.5	6%	0.061	29%	0.287	C	S	.	.	H	α-helix	trans	-62.9	-32.1	176	-170.1	-112.5	0	0	0	112.2	F1372 I1379 N1380 I1644 E1647 Y1650	F1372-F1376 VanDerWaalsContact O-CB 3.27Å; F1372-F1376 WeakPolarHBondContact O-CB 3.22Å; F1372-F1376 PolarHBondContact O-N 2.97Å; F1376-I1379 PolarHBondContact O-N 3Å; F1376-N1380 VanDerWaalsContact CD1-ND2 3.29Å; F1376-N1380 WeakPolarHBondContact CD1-ND2 3.32Å; F1376-N1380 WeakPolarHBondContact CE1-ND2 3.37Å; F1376-N1380 VanDerWaalsContact O-CG 3.31Å; F1376-N1380 PolarHBondContact O-N 3.22Å; F1376-N1380 PolarHBondContact O-ND2 3.27Å; F1376-I1644 HydrophobicContact CE2-CG2 4.16Å; F1376-E1647 HydrophobicContact CD1-CB 3.81Å; F1376-E1647 HydrophobicContact CD1-CG 4.5Å; F1376-E1647 HydrophobicContact CE1-CB 4.19Å; F1376-E1647 VanDerWaalsContact CE1-N 3.29Å; F1376-E1647 HydrophobicContact CG-CB 4.33Å; F1376-Y1650 HydrophobicContact CB-CD1 4.38Å; F1376-Y1650 HydrophobicContact CD2-CD1 4.33Å; F1376-Y1650 HydrophobicContact CD2-CD2 4.35Å; F1376-Y1650 AromaticContact CD2-CG 3.92Å; F1376-Y1650 HydrophobicContact CD2-CG 3.92Å
1377	R	86.5	Confident	71.6	Confident	134 Å²	134	54.9 Å²	54.9	51%	0.506	28%	0.279	S	S	.	.	H	α-helix	trans	-67.3	-33.1	171.1	-75.1	170.1	-174.2	-150.9	2.2	112.9	Q1373 L1374 E1375 K1381	Q1373-R1377 WeakPolarHBondContact O-CB 3.28Å; Q1373-R1377 VanDerWaalsContact O-CD 3.32Å; Q1373-R1377 WeakPolarHBondContact O-CD 3.08Å; Q1373-R1377 WeakPolarHBondContact O-CG 3.35Å; Q1373-R1377 PolarHBondContact O-N 2.77Å; L1374-R1377 PolarHBondContact O-N 3.48Å; E1375-R1377 VanDerWaalsContact C-N 3.26Å; E1375-R1377 PolarHBondContact O-N 3.19Å; R1377-K1381 WeakPolarHBondContact O-CG 3.48Å; R1377-K1381 PolarHBondContact O-N 2.77Å; R1377-K1381 VanDerWaalsContact O-N 3.08Å
1378	K	85	Confident	70.4	Confident	81 Å²	81	52.4 Å²	52.4	35%	0.352	27%	0.265	S	S	.	.	H	α-helix	trans	-62	-48.7	168.8	-68	-170.6	-174.6	-168.3	0	110.6	T1298 D1299 L1374 E1375 N1380 K1381 L1382 Y1630	T1298-K1378 PolarHBondContact O-NZ 2.84Å; D1299-K1378 PolarHBondContact O-NZ 3.39Å; L1374-K1378 PolarHBondContact O-N 2.94Å; E1375-K1378 WeakPolarHBondContact O-CA 3.13Å; E1375-K1378 WeakPolarHBondContact O-CB 3.4Å; E1375-K1378 PolarHBondContact O-N 3.44Å; K1378-N1380 VanDerWaalsContact C-N 3.3Å; K1378-N1380 PolarHBondContact O-N 3Å; K1378-K1381 WeakPolarHBondContact O-CB 3.49Å; K1378-K1381 PolarHBondContact O-N 2.86Å; K1378-K1381 VanDerWaalsContact O-N 3.11Å; K1378-L1382 WeakPolarHBondContact O-CG 3.32Å; K1378-L1382 PolarHBondContact O-N 3.36Å; K1378-Y1630 HydrophobicContact CB-CE2 3.87Å; K1378-Y1630 WeakPolarHBondContact CB-OH 3.36Å; K1378-Y1630 HydrophobicContact CD-CE2 4.35Å
1379	I	83.5	Confident	68.7	Low	1 Å²	1	56.6 Å²	56.6	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-58.3	-41.6	178.4	-54	178.7	0	0	0	111.3	E1375 F1376 L1382 S1383 Y1630 V1633 Y1650	E1375-I1379 PolarHBondContact O-N 3.43Å; E1375-I1379 VanDerWaalsContact O-N 3.13Å; F1376-I1379 PolarHBondContact O-N 3Å; I1379-L1382 PolarHBondContact O-N 3.32Å; I1379-S1383 PolarHBondContact O-OG 3.34Å; I1379-S1383 VanDerWaalsContact O-OG 3.09Å; I1379-Y1630 HydrophobicContact CD1-CD2 3.73Å; I1379-Y1630 HydrophobicContact CD1-CE2 4.13Å; I1379-Y1630 HydrophobicContact CG1-CD2 3.5Å; I1379-Y1630 HydrophobicContact CG1-CE2 3.35Å; I1379-V1633 HydrophobicContact CD1-CB 4.32Å; I1379-V1633 HydrophobicContact CD1-CG1 4.15Å; I1379-V1633 HydrophobicContact CG2-CG1 4.27Å; I1379-Y1650 HydrophobicContact CD1-CD2 4.21Å; I1379-Y1650 HydrophobicContact CD1-CE2 3.6Å
1380	N	80.6	Confident	66.1	Low	53 Å²	53	62.7 Å²	62.7	28%	0.283	32%	0.319	S	S	.	.	H	α-helix	trans	-66.5	-37.4	177	-69.2	-30.4	0	0	0	112.9	F1376 K1378 L1382 S1383 R1637	F1376-N1380 VanDerWaalsContact CD1-ND2 3.29Å; F1376-N1380 WeakPolarHBondContact CD1-ND2 3.32Å; F1376-N1380 WeakPolarHBondContact CE1-ND2 3.37Å; F1376-N1380 VanDerWaalsContact O-CG 3.31Å; F1376-N1380 PolarHBondContact O-N 3.22Å; F1376-N1380 PolarHBondContact O-ND2 3.27Å; K1378-N1380 VanDerWaalsContact C-N 3.3Å; K1378-N1380 PolarHBondContact O-N 3Å; N1380-L1382 PolarHBondContact O-N 3.26Å; N1380-S1383 WeakPolarHBondContact O-CB 3.5Å; N1380-S1383 PolarHBondContact O-N 3.38Å; N1380-S1383 PolarHBondContact O-OG 2.94Å; N1380-R1637 PolarHBondContact OD1-NH1 2.78Å; N1380-R1637 PolarHBondContact OD1-NH2 2.82Å; N1380-R1637 VanDerWaalsContact OD1-NH2 3.11Å
1381	K	73.1	Confident	63.2	Low	175 Å²	175	68.3 Å²	68.3	76%	0.761	35%	0.349	S	S	*	.	H	α-helix	trans	-64.5	-22.7	173.7	-75.8	179.4	176.8	-172.9	0	113.9	R1377 K1378	R1377-K1381 WeakPolarHBondContact O-CG 3.48Å; R1377-K1381 PolarHBondContact O-N 2.77Å; R1377-K1381 VanDerWaalsContact O-N 3.08Å; K1378-K1381 WeakPolarHBondContact O-CB 3.49Å; K1378-K1381 PolarHBondContact O-N 2.86Å; K1378-K1381 VanDerWaalsContact O-N 3.11Å
1382	L	61.7	Low	60.3	Low	53 Å²	53	74 Å²	74	28%	0.277	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-4.9	177.6	-68.4	165.4	0	0	0	113.5	K1378 I1379 N1380 Y1630 K1634	K1378-L1382 WeakPolarHBondContact O-CG 3.32Å; K1378-L1382 PolarHBondContact O-N 3.36Å; I1379-L1382 PolarHBondContact O-N 3.32Å; N1380-L1382 PolarHBondContact O-N 3.26Å; L1382-Y1630 WeakPolarHBondContact CD1-OH 3.3Å; L1382-K1634 HydrophobicContact CD1-CD 4.03Å; L1382-K1634 HydrophobicContact CD1-CG 4.42Å
1383	S	54.9	Low	57.4	Low	13 Å²	13	81.3 Å²	81.3	9%	0.091	42%	0.424	C	S	.	.	S	Bend	trans	-80	134	-174.9	-58.1	0	0	0	0	111	I1379 N1380 N1385 R1637	I1379-S1383 PolarHBondContact O-OG 3.34Å; I1379-S1383 VanDerWaalsContact O-OG 3.09Å; N1380-S1383 WeakPolarHBondContact O-CB 3.5Å; N1380-S1383 PolarHBondContact O-N 3.38Å; N1380-S1383 PolarHBondContact O-OG 2.94Å; S1383-N1385 PolarHBondContact O-N 3.44Å; S1383-R1637 PolarHBondContact OG-NH1 2.94Å
1384	P	49.9	Very low	54.5	Low	35 Å²	35	88.6 Å²	88.6	23%	0.227	46%	0.458	C	S	.	.			trans	-66.1	123.2	-174.6	24.9	-33	0	0	0	111	I1386 F1438 V1641	P1384-I1386 PolarHBondContact O-N 2.8Å; P1384-F1438 HydrophobicContact CG-CE1 4.04Å; P1384-F1438 HydrophobicContact CG-CZ 3.97Å; P1384-V1641 HydrophobicContact CG-CG1 4.49Å
1385	N	41.1	Very low	51.9	Low	125 Å²	125	91.5 Å²	91.5	67%	0.668	48%	0.483	S	S	*	.			trans	-69.1	90.1	176.7	-85	-39.8	0	0	0	110.6	S1383 T1387	S1383-N1385 PolarHBondContact O-N 3.44Å; N1385-T1387 VanDerWaalsContact C-N 3.33Å; N1385-T1387 PolarHBondContact O-N 3.12Å; N1385-T1387 PolarHBondContact O-OG1 2.99Å
1386	I	41.6	Very low	49.1	Very low	44 Å²	44	99.5 Å²	99.5	23%	0.226	52%	0.517	C	S	.	.			trans	-59.2	95.5	171	-51	174.9	0	0	0	108	P1384 L1388 S1434 V1641	P1384-I1386 PolarHBondContact O-N 2.8Å; I1386-L1388 HydrophobicContact CG2-CD2 4.26Å; I1386-L1388 HydrophobicContact CG2-CG 4.41Å; I1386-L1388 PolarHBondContact O-N 2.97Å; I1386-S1434 WeakPolarHBondContact CD1-O 3.41Å; I1386-V1641 HydrophobicContact CD1-CB 4.35Å; I1386-V1641 HydrophobicContact CD1-CG1 4.06Å; I1386-V1641 HydrophobicContact CD1-CG2 4.33Å
1387	T	31.7	Very low	46.4	Very low	89 Å²	89	105.6 Å²	105.6	55%	0.546	56%	0.555	S	S	.	*			trans	-76.9	99.4	-179.6	-55.6	0	0	0	0	107.8	N1385 T1389	N1385-T1387 VanDerWaalsContact C-N 3.33Å; N1385-T1387 PolarHBondContact O-N 3.12Å; N1385-T1387 PolarHBondContact O-OG1 2.99Å; T1387-T1389 PolarHBondContact O-N 3.36Å; T1387-T1389 PolarHBondContact O-OG1 3.03Å
1388	L	28.5	Very low	43.6	Very low	95 Å²	95	102.6 Å²	102.6	50%	0.497	57%	0.567	S	S	.	*			trans	-76.4	72.5	178.7	-71.1	170.9	0	0	0	110.5	I1386 L1390 V1433	I1386-L1388 HydrophobicContact CG2-CD2 4.26Å; I1386-L1388 HydrophobicContact CG2-CG 4.41Å; I1386-L1388 PolarHBondContact O-N 2.97Å; L1388-L1390 PolarHBondContact O-N 2.83Å; L1388-V1433 HydrophobicContact CD2-CG1 4.41Å
1389	T	27.3	Very low	41	Very low	106 Å²	106	109.1 Å²	109.1	65%	0.65	60%	0.595	S	S	*	*			trans	-71.5	77.4	174.9	4.3	0	0	0	0	111	T1387 N1391	T1387-T1389 PolarHBondContact O-N 3.36Å; T1387-T1389 PolarHBondContact O-OG1 3.03Å; T1389-N1391 PolarHBondContact O-N 3.1Å
1390	L	26.6	Very low	38.3	Very low	153 Å²	153	114.7 Å²	114.7	80%	0.801	63%	0.629	S	S	*	*			trans	-71.5	52.1	175	-80.8	165.3	0	0	0	112.6	L1388 C1392	L1388-L1390 PolarHBondContact O-N 2.83Å; L1390-C1392 PolarHBondContact O-N 2.8Å; L1390-C1392 VanDerWaalsContact O-N 3.15Å
1391	N	27.2	Very low	35.7	Very low	142 Å²	142	118.1 Å²	118.1	76%	0.759	65%	0.647	S	S	*	*			trans	-90.1	48.8	-179.7	-76.8	-5.4	0	0	0	112.6	T1389	T1389-N1391 PolarHBondContact O-N 3.1Å
1392	C	24.2	Very low	33.6	Very low	121 Å²	121	119.8 Å²	119.8	82%	0.818	65%	0.65	S	S	*	*	S	Bend	trans	-140.8	55.8	170.6	-112.7	0	0	0	0	111.6	L1390	L1390-C1392 PolarHBondContact O-N 2.8Å; L1390-C1392 VanDerWaalsContact O-N 3.15Å
1393	I	30.2	Very low	32.1	Very low	157 Å²	157	123.3 Å²	123.3	81%	0.805	67%	0.674	S	S	*	*			trans	-166.8	103.7	148.2	-90.3	140.8	0	0	0	105.5
1394	Q	27.3	Very low	30.9	Very low	201 Å²	201	126.1 Å²	126.1	94%	0.939	69%	0.692	S	S	*	*			trans	-90.4	103.3	165.7	-79.4	-172.8	-16.6	0	0	108.5
1395	S	31.1	Very low	29.7	Very low	108 Å²	108	130.6 Å²	130.6	76%	0.755	72%	0.721	S	S	*	*			trans	-84.2	160.3	160.9	64.1	0	0	0	0	110.2
1396	K	30.1	Very low	29.1	Very low	189 Å²	189	127.5 Å²	127.5	82%	0.822	72%	0.719	S	S	*	*	S	Bend	trans	-80.5	173.8	-168.2	-64.3	177.2	179.5	175.6	0	112.7
1397	T	33	Very low	28.5	Very low	142 Å²	142	129 Å²	129	87%	0.871	73%	0.733	S	S	*	*			trans	62.3	100.8	168.4	57.4	0	0	0	0	115.3
1398	G	26.7	Very low	28.3	Very low	72 Å²	72	130.9 Å²	130.9	74%	0.742	75%	0.747	S	S	*	*			trans	-88.1	176.2	177.5	0	0	0	0	0	114.3
1399	F	30.7	Very low	28.2	Very low	218 Å²	218	131.5 Å²	131.5	96%	0.956	75%	0.75	S	S	*	*			trans	-134.2	170	148.8	-117.6	-89.2	0	0	0	108.8
1400	V	27.8	Very low	28.2	Very low	118 Å²	118	130.2 Å²	130.2	72%	0.715	74%	0.736	S	S	*	*			trans	-122.7	152.7	-155	163	0	0	0	0	112.3
1401	N	25.7	Very low	28.3	Very low	124 Å²	124	124.8 Å²	124.8	66%	0.663	72%	0.717	S	S	*	*			trans	91.6	148.1	160.1	-79.9	-14.9	0	0	0	122.5
1402	Y	28.6	Very low	28.5	Very low	211 Å²	211	121 Å²	121	83%	0.827	69%	0.693	S	S	*	*			trans	72.4	118.8	160.8	-59.7	-56.3	0	0	0	121.4
1403	T	30.4	Very low	29	Very low	127 Å²	127	122.8 Å²	122.8	78%	0.779	69%	0.686	S	S	*	*	P	Polyproline II helix	trans	-103.8	155.7	164.2	46.5	0	0	0	0	110.6
1404	P	28.6	Very low	29.5	Very low	72 Å²	72	118.4 Å²	118.4	47%	0.468	66%	0.664	S	S	.	*	P	Polyproline II helix	trans	-103.1	119.1	154.3	-0.9	21.3	0	0	0	110.7
1405	P	26	Very low	30.5	Very low	128 Å²	128	114.5 Å²	114.5	83%	0.831	66%	0.659	S	S	*	*	P	Polyproline II helix	trans	-78.2	128	167	31	-31.2	0	0	0	110.2
1406	G	27.2	Very low	32	Very low	60 Å²	60	110.8 Å²	110.8	62%	0.619	63%	0.632	S	S	*	*			trans	171.4	-2.3	177.3	0	0	0	0	0	119.9
1407	S	29.5	Very low	34.1	Very low	77 Å²	77	104.3 Å²	104.3	54%	0.538	61%	0.61	S	S	.	*			trans	-89.5	125.7	-175.6	47.4	0	0	0	0	113.5	I1409	S1407-I1409 PolarHBondContact O-N 3.21Å; S1407-I1409 VanDerWaalsContact O-N 3.11Å
1408	P	27.1	Very low	36.5	Very low	127 Å²	127	97.8 Å²	97.8	83%	0.825	57%	0.57	S	S	*	*			trans	-83.5	84.3	-178.7	32.1	-34.9	0	0	0	112.4	H1410	P1408-H1410 VanDerWaalsContact C-N 3.33Å; P1408-H1410 PolarHBondContact O-N 3.36Å
1409	I	26.5	Very low	39.3	Very low	109 Å²	109	98.7 Å²	98.7	56%	0.559	56%	0.558	S	S	*	*			trans	-83.1	62.3	-173.5	-43	179.5	0	0	0	112.8	S1407	S1407-I1409 PolarHBondContact O-N 3.21Å; S1407-I1409 VanDerWaalsContact O-N 3.11Å
1410	H	28.2	Very low	42.1	Very low	78 Å²	78	89.1 Å²	89.1	36%	0.361	52%	0.517	S	S	.	.			trans	-125.1	66.1	-179.8	-80.8	87.2	0	0	0	115.7	Q1040 Y1044 P1408	Q1040-H1410 PolarHBondContact NE2-O 3.18Å; Q1040-H1410 VanDerWaalsContact NE2-O 3.15Å; Y1044-H1410 AromaticContact CD2-CD2 3.47Å; Y1044-H1410 VanDerWaalsContact CD2-CD2 3.47Å; Y1044-H1410 WeakPolarHBondContact CD2-CD2 3.46Å; Y1044-H1410 AromaticContact CD2-CE1 3.53Å; Y1044-H1410 AromaticContact CD2-CG 3.81Å; Y1044-H1410 AromaticContact CD2-ND1 3.81Å; Y1044-H1410 AromaticContact CD2-NE2 3.3Å; Y1044-H1410 VanDerWaalsContact CD2-NE2 3.3Å; Y1044-H1410 WeakPolarHBondContact CD2-NE2 3.42Å; Y1044-H1410 AromaticContact CE2-CD2 3.77Å; Y1044-H1410 AromaticContact CE2-CE1 2.96Å; Y1044-H1410 WeakPolarHBondContact CE2-CE1 3.06Å; Y1044-H1410 AromaticContact CE2-CG 3.99Å; Y1044-H1410 AromaticContact CE2-ND1 3.49Å; Y1044-H1410 WeakPolarHBondContact CE2-ND1 3.29Å; Y1044-H1410 AromaticContact CE2-NE2 3.14Å; Y1044-H1410 WeakPolarHBondContact CE2-NE2 3.43Å; Y1044-H1410 AromaticContact CZ-CE1 3.47Å; Y1044-H1410 VanDerWaalsContact CZ-CE1 3.47Å; Y1044-H1410 AromaticContact CZ-ND1 3.7Å; P1408-H1410 VanDerWaalsContact C-N 3.33Å; P1408-H1410 PolarHBondContact O-N 3.36Å
1411	G	28.4	Very low	45.1	Very low	39 Å²	39	83.5 Å²	83.5	40%	0.402	48%	0.484	S	S	.	.	S	Bend	trans	-101.1	166	149	0	0	0	0	0	110.5	K1413	G1411-K1413 PolarHBondContact O-N 2.87Å
1412	Y	32	Very low	48	Very low	64 Å²	64	82.1 Å²	82.1	25%	0.251	47%	0.472	S	S	.	.			trans	-61.7	98.1	179.3	-72	-94.7	0	0	0	111.6	R1047 T1291 L1294 L1414	R1047-Y1412 VanDerWaalsContact NH2-CE1 3.28Å; T1291-Y1412 WeakPolarHBondContact CA-OH 3.15Å; T1291-Y1412 HydrophobicContact CG2-CE1 3.6Å; T1291-Y1412 PolarHBondContact O-OH 2.83Å; L1294-Y1412 WeakPolarHBondContact CB-OH 3.25Å; L1294-Y1412 HydrophobicContact CD2-CE2 4.3Å; L1294-Y1412 WeakPolarHBondContact CD2-OH 3.31Å; L1294-Y1412 HydrophobicContact CG-CE2 4.45Å; Y1412-L1414 PolarHBondContact O-N 3.46Å
1413	K	35.2	Very low	50.9	Low	158 Å²	158	78.7 Å²	78.7	69%	0.687	46%	0.457	S	S	*	.			trans	-81.4	60.1	180	-159.7	-180	-176.4	-175.6	0	111.2	G1411 S1415	G1411-K1413 PolarHBondContact O-N 2.87Å; K1413-S1415 PolarHBondContact O-N 3.41Å; K1413-S1415 VanDerWaalsContact O-N 3.15Å
1414	L	39.4	Very low	53.7	Low	65 Å²	65	77.4 Å²	77.4	34%	0.34	45%	0.453	S	S	.	.			trans	-65.6	112.5	174.7	-158.6	81.4	0	0	0	108.7	T1234 Y1235 Y1412 V1416	T1234-L1414 HydrophobicContact CG2-CD1 4.05Å; T1234-L1414 HydrophobicContact CG2-CD2 3.67Å; T1234-L1414 HydrophobicContact CG2-CG 4.42Å; Y1235-L1414 HydrophobicContact CD1-CD2 4.29Å; Y1235-L1414 HydrophobicContact CE1-CD2 3.5Å; Y1235-L1414 HydrophobicContact CE2-CD2 4.07Å; Y1235-L1414 WeakPolarHBondContact OH-CD2 3.36Å; Y1412-L1414 PolarHBondContact O-N 3.46Å; L1414-V1416 HydrophobicContact CB-CG2 4.37Å; L1414-V1416 HydrophobicContact CD2-CG2 3.69Å; L1414-V1416 HydrophobicContact CG-CG2 4.15Å; L1414-V1416 PolarHBondContact O-N 2.83Å
1415	S	48.1	Very low	56.7	Low	118 Å²	118	77.1 Å²	77.1	83%	0.825	45%	0.451	S	S	*	.			trans	-79.5	65.5	-178.6	55.6	0	0	0	0	110.9	K1413 S1417	K1413-S1415 PolarHBondContact O-N 3.41Å; K1413-S1415 VanDerWaalsContact O-N 3.15Å; S1415-S1417 PolarHBondContact O-N 3.05Å
1416	V	62.9	Low	59.9	Low	30 Å²	30	71 Å²	71	18%	0.182	41%	0.411	C	S	.	.			trans	-64.5	124	174.9	-166.7	0	0	0	0	108.8	L1414 F1438 W1440	L1414-V1416 HydrophobicContact CB-CG2 4.37Å; L1414-V1416 HydrophobicContact CD2-CG2 3.69Å; L1414-V1416 HydrophobicContact CG-CG2 4.15Å; L1414-V1416 PolarHBondContact O-N 2.83Å; V1416-F1438 HydrophobicContact CB-CD1 3.73Å; V1416-F1438 HydrophobicContact CB-CE1 3.97Å; V1416-F1438 HydrophobicContact CB-CG 4.39Å; V1416-F1438 HydrophobicContact CG1-CB 3.66Å; V1416-F1438 HydrophobicContact CG1-CD1 3.35Å; V1416-F1438 HydrophobicContact CG1-CD2 4.35Å; V1416-F1438 HydrophobicContact CG1-CE1 4.03Å; V1416-F1438 HydrophobicContact CG1-CG 3.55Å; V1416-F1438 HydrophobicContact CG2-CE1 4.48Å; V1416-W1440 VanDerWaalsContact CG1-CD1 3.49Å
1417	S	74.6	Confident	63	Low	53 Å²	53	71.7 Å²	71.7	37%	0.371	40%	0.4	S	S	.	.			trans	-66.5	141	-178.7	-169.2	0	0	0	0	111.5	S1415 F1438 D1439	S1415-S1417 PolarHBondContact O-N 3.05Å; S1417-F1438 WeakPolarHBondContact O-CA 3.37Å; S1417-D1439 VanDerWaalsContact CB-OD2 3.26Å; S1417-D1439 WeakPolarHBondContact CB-OD2 3.45Å; S1417-D1439 PolarHBondContact O-N 2.84Å; S1417-D1439 PolarHBondContact OG-OD2 2.8Å
1418	C	82.9	Confident	66	Low	5 Å²	5	71.8 Å²	71.8	3%	0.034	40%	0.4	C	S	.	.			trans	-137.8	27.5	171	-71	0	0	0	0	109.1	A1421 K1422 V1436 P1437 F1438 D1439	C1418-A1421 WeakPolarHBondContact O-CB 3.22Å; C1418-A1421 PolarHBondContact O-N 2.67Å; C1418-K1422 WeakPolarHBondContact O-CE 3.38Å; C1418-K1422 VanDerWaalsContact O-CG 3.29Å; C1418-K1422 WeakPolarHBondContact O-CG 3.03Å; C1418-K1422 PolarHBondContact O-N 3.12Å; C1418-V1436 HydrophobicContact CB-CG2 3.92Å; C1418-P1437 PolarHBondContact SG-O 2.75Å; C1418-F1438 VanDerWaalsContact SG-CD1 3.56Å; C1418-D1439 PolarHBondContact N-OD2 3.24Å
1419	D	85.4	Confident	69.2	Low	92 Å²	92	67 Å²	67	49%	0.492	37%	0.367	S	S	.	.	H	α-helix	trans	-82.5	-24	-162.5	-70.1	3.7	0	0	0	111.3	A1421 K1422 R1423 D1439	D1419-A1421 VanDerWaalsContact C-N 3.35Å; D1419-K1422 PolarHBondContact O-N 2.94Å; D1419-K1422 WeakPolarHBondContact OD1-CE 3.49Å; D1419-K1422 IonicContact OD1-NZ 2.74Å; D1419-K1422 PolarHBondContact OD1-NZ 3.38Å; D1419-R1423 WeakPolarHBondContact O-CG 3.39Å; D1419-R1423 PolarHBondContact O-N 2.78Å; D1419-D1439 PolarHBondContact N-OD1 2.89Å; D1419-D1439 PolarHBondContact N-OD2 3.39Å
1420	V	89.9	Confident	72.5	Confident	16 Å²	16	62.3 Å²	62.3	10%	0.097	34%	0.343	C	S	.	.	H	α-helix	trans	-65.5	-41.8	167.3	-173.3	0	0	0	0	110.3	K1422 R1423 N1426 D1439 Y1456	V1420-K1422 VanDerWaalsContact C-N 3.27Å; V1420-K1422 PolarHBondContact O-N 3.4Å; V1420-R1423 WeakPolarHBondContact O-CB 3.04Å; V1420-R1423 PolarHBondContact O-N 3Å; V1420-N1426 PolarHBondContact O-ND2 3.25Å; V1420-D1439 WeakPolarHBondContact CB-OD1 3.46Å; V1420-D1439 PolarHBondContact N-OD1 2.81Å; V1420-D1439 PolarHBondContact N-OD2 3.14Å; V1420-Y1456 HydrophobicContact CG1-CD2 4.07Å
1421	A	90.9	Very high	75.6	Confident	1 Å²	1	60.9 Å²	60.9	1%	0.008	33%	0.334	C	S	.	.	H	α-helix	trans	-67.4	-25.5	177.8	0	0	0	0	0	113.7	C1418 D1419 N1430 V1436 Y1456	C1418-A1421 WeakPolarHBondContact O-CB 3.22Å; C1418-A1421 PolarHBondContact O-N 2.67Å; D1419-A1421 VanDerWaalsContact C-N 3.35Å; A1421-N1430 PolarHBondContact O-ND2 3.05Å; A1421-V1436 HydrophobicContact CB-CB 3.67Å; A1421-V1436 HydrophobicContact CB-CG1 3.79Å; A1421-V1436 HydrophobicContact CB-CG2 4.36Å; A1421-Y1456 HydrophobicContact CB-CE2 3.64Å; A1421-Y1456 VanDerWaalsContact CB-OH 3.29Å; A1421-Y1456 WeakPolarHBondContact CB-OH 3.32Å
1422	K	86.4	Confident	78.6	Confident	95 Å²	95	62.6 Å²	62.6	41%	0.413	33%	0.334	S	S	.	.	H	α-helix	trans	-85.8	-10.6	177.3	-65.9	166.4	-155.4	161.8	0	114.2	C1418 D1419 V1420 S1424	C1418-K1422 WeakPolarHBondContact O-CE 3.38Å; C1418-K1422 VanDerWaalsContact O-CG 3.29Å; C1418-K1422 WeakPolarHBondContact O-CG 3.03Å; C1418-K1422 PolarHBondContact O-N 3.12Å; D1419-K1422 PolarHBondContact O-N 2.94Å; D1419-K1422 WeakPolarHBondContact OD1-CE 3.49Å; D1419-K1422 IonicContact OD1-NZ 2.74Å; D1419-K1422 PolarHBondContact OD1-NZ 3.38Å; V1420-K1422 VanDerWaalsContact C-N 3.27Å; V1420-K1422 PolarHBondContact O-N 3.4Å; K1422-S1424 PolarHBondContact O-N 2.94Å
1423	R	89.4	Confident	81.2	Confident	138 Å²	138	63.1 Å²	63.1	52%	0.521	34%	0.343	S	S	.	.	S	Bend	trans	-56.4	139.4	177.3	-67.5	-178.4	-178.8	-173	-0.8	110	D1419 V1420 V1425 N1426 L1427	D1419-R1423 WeakPolarHBondContact O-CG 3.39Å; D1419-R1423 PolarHBondContact O-N 2.78Å; V1420-R1423 WeakPolarHBondContact O-CB 3.04Å; V1420-R1423 PolarHBondContact O-N 3Å; R1423-V1425 VanDerWaalsContact C-N 3.26Å; R1423-V1425 HydrophobicContact CB-CG2 4.14Å; R1423-V1425 PolarHBondContact O-N 3.41Å; R1423-V1425 VanDerWaalsContact O-N 3.17Å; R1423-N1426 HydrophobicContact CB-CB 4.45Å; R1423-N1426 WeakPolarHBondContact O-CA 3.41Å; R1423-N1426 PolarHBondContact O-N 3.1Å; R1423-L1427 PolarHBondContact O-N 2.62Å
1424	S	89.1	Confident	83.6	Confident	100 Å²	100	58.3 Å²	58.3	70%	0.699	33%	0.329	S	S	*	.	H	α-helix	trans	-50.4	-43.3	-178.4	48.5	0	0	0	0	113.3	K1422 N1426 L1427	K1422-S1424 PolarHBondContact O-N 2.94Å; S1424-N1426 PolarHBondContact O-N 2.73Å; S1424-L1427 PolarHBondContact O-N 3.23Å
1425	V	91.5	Very high	85.9	Confident	67 Å²	67	55.5 Å²	55.5	41%	0.406	32%	0.315	S	S	.	.	H	α-helix	trans	-62.7	-23.3	176.7	-61.5	0	0	0	0	114.3	R1423	R1423-V1425 VanDerWaalsContact C-N 3.26Å; R1423-V1425 HydrophobicContact CB-CG2 4.14Å; R1423-V1425 PolarHBondContact O-N 3.41Å; R1423-V1425 VanDerWaalsContact O-N 3.17Å
1426	N	94	Very high	88	Confident	0 Å²	0	50.1 Å²	50.1	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-100.8	-12.7	-176.5	-71	-22.2	0	0	0	113.4	V1420 R1423 S1424 S1428 K1429 N1430 G1453 Y1456	V1420-N1426 PolarHBondContact O-ND2 3.25Å; R1423-N1426 HydrophobicContact CB-CB 4.45Å; R1423-N1426 WeakPolarHBondContact O-CA 3.41Å; R1423-N1426 PolarHBondContact O-N 3.1Å; S1424-N1426 PolarHBondContact O-N 2.73Å; N1426-S1428 VanDerWaalsContact C-N 3.28Å; N1426-S1428 PolarHBondContact O-N 3.49Å; N1426-K1429 WeakPolarHBondContact O-CB 3.49Å; N1426-K1429 PolarHBondContact O-N 3.5Å; N1426-N1430 PolarHBondContact O-ND2 3.28Å; N1426-G1453 WeakPolarHBondContact OD1-CA 3.04Å; N1426-G1453 PolarHBondContact OD1-O 3.36Å; N1426-Y1456 HydrophobicContact CB-CD1 3.64Å; N1426-Y1456 HydrophobicContact CB-CE1 3.98Å; N1426-Y1456 HydrophobicContact CB-CG 4.14Å; N1426-Y1456 VanDerWaalsContact CG-CD1 3.5Å; N1426-Y1456 WeakPolarHBondContact ND2-CB 3.2Å
1427	L	91.7	Very high	89.5	Confident	74 Å²	74	48.7 Å²	48.7	39%	0.387	27%	0.268	S	S	.	.	H	α-helix	trans	-59.4	-38.1	-179.9	-65.4	179.6	0	0	0	112.4	R1423 S1424 K1429 N1430 V1433	R1423-L1427 PolarHBondContact O-N 2.62Å; S1424-L1427 PolarHBondContact O-N 3.23Å; L1427-K1429 PolarHBondContact O-N 3.14Å; L1427-N1430 PolarHBondContact O-N 2.95Å; L1427-V1433 HydrophobicContact CD2-CG1 4.41Å
1428	S	92.4	Very high	90.2	Very high	78 Å²	78	46.3 Å²	46.3	55%	0.545	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-11.2	176.7	55	0	0	0	0	114.5	N1426 S1480	N1426-S1428 VanDerWaalsContact C-N 3.28Å; N1426-S1428 PolarHBondContact O-N 3.49Å; S1428-S1480 PolarHBondContact O-OG 2.94Å
1429	K	95	Very high	90.5	Very high	27 Å²	27	47.7 Å²	47.7	12%	0.117	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-2.5	174	-60.4	-173.4	171.3	-161.3	0	112.8	N1426 L1427 G1453 Y1456 Q1475 T1481 D1484	N1426-K1429 WeakPolarHBondContact O-CB 3.49Å; N1426-K1429 PolarHBondContact O-N 3.5Å; L1427-K1429 PolarHBondContact O-N 3.14Å; K1429-G1453 PolarHBondContact NZ-O 2.65Å; K1429-Y1456 HydrophobicContact CB-CD1 4.16Å; K1429-Y1456 HydrophobicContact CB-CE1 4.12Å; K1429-Y1456 HydrophobicContact CD-CD1 4.02Å; K1429-Y1456 WeakPolarHBondContact CD-O 3.09Å; K1429-Y1456 PolarHBondContact NZ-O 2.72Å; K1429-Q1475 PolarHBondContact O-NE2 2.87Å; K1429-T1481 HydrophobicContact CB-CG2 4.01Å; K1429-T1481 HydrophobicContact CG-CG2 4.32Å; K1429-D1484 VanDerWaalsContact CE-OD2 3.31Å; K1429-D1484 WeakPolarHBondContact CE-OD2 3.47Å; K1429-D1484 IonicContact NZ-OD2 3.26Å; K1429-D1484 PolarHBondContact NZ-OD2 2.53Å
1430	N	94.7	Very high	90.5	Very high	10 Å²	10	50.7 Å²	50.7	5%	0.053	26%	0.263	C	S	.	.			trans	-105.6	118.5	-178.8	-65.1	-42.5	0	0	0	111.5	A1421 N1426 L1427 L1432 Y1456 N1458	A1421-N1430 PolarHBondContact O-ND2 3.05Å; N1426-N1430 PolarHBondContact O-ND2 3.28Å; L1427-N1430 PolarHBondContact O-N 2.95Å; N1430-L1432 PolarHBondContact O-N 3.15Å; N1430-Y1456 WeakPolarHBondContact OD1-CE1 3.36Å; N1430-Y1456 PolarHBondContact OD1-OH 3.25Å; N1430-N1458 PolarHBondContact OD1-ND2 2.61Å
1431	R	93.5	Very high	90.5	Very high	48 Å²	48	50.4 Å²	50.4	18%	0.181	26%	0.261	C	S	.	.	S	Bend	trans	-65.6	-28.1	174.8	-170.4	177.5	-77.3	-84.1	2.8	112	G1476 P1477 M1478 E1509 K1510 S1602	R1431-G1476 PolarHBondContact NE-O 2.81Å; R1431-G1476 PolarHBondContact NH2-O 2.88Å; R1431-G1476 VanDerWaalsContact NH2-O 3.13Å; R1431-P1477 PolarHBondContact NH2-O 3.4Å; R1431-M1478 VanDerWaalsContact CA-SD 3.51Å; R1431-M1478 HydrophobicContact CB-CG 4.23Å; R1431-M1478 HydrophobicContact CB-SD 3.67Å; R1431-M1478 HydrophobicContact CG-CG 4.47Å; R1431-M1478 HydrophobicContact CG-SD 4.33Å; R1431-M1478 PolarHBondContact N-SD 3.13Å; R1431-M1478 VanDerWaalsContact N-SD 3.43Å; R1431-E1509 IonicContact CZ-OE1 3.53Å; R1431-E1509 VanDerWaalsContact CZ-OE1 3.23Å; R1431-E1509 IonicContact NH1-OE1 2.63Å; R1431-E1509 PolarHBondContact NH1-OE1 2.78Å; R1431-E1509 IonicContact NH2-OE1 3.51Å; R1431-E1509 PolarHBondContact NH2-OE1 3.13Å; R1431-K1510 VanDerWaalsContact CZ-O 3.28Å; R1431-K1510 PolarHBondContact NE-O 2.82Å; R1431-S1602 WeakPolarHBondContact CD-O 3.38Å
1432	L	90.8	Very high	90.7	Very high	75 Å²	75	52 Å²	52	39%	0.393	27%	0.266	S	S	.	.			trans	-141.6	118	173.6	-67.4	172.7	0	0	0	109.6	N1430 S1434 I1435	N1430-L1432 PolarHBondContact O-N 3.15Å; L1432-S1434 PolarHBondContact O-N 2.95Å; L1432-I1435 HydrophobicContact CB-CB 4.23Å; L1432-I1435 HydrophobicContact CB-CG1 4.49Å; L1432-I1435 HydrophobicContact CD1-CD1 3.93Å; L1432-I1435 HydrophobicContact CD1-CG1 4.47Å; L1432-I1435 CarbonylContact O-C 3.55Å; L1432-I1435 PolarHBondContact O-N 3.19Å; L1432-I1435 VanDerWaalsContact O-O 3.13Å
1433	V	88.1	Confident	91.2	Very high	75 Å²	75	47.5 Å²	47.5	46%	0.455	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-21.8	-178.7	-174.4	0	0	0	0	112.7	L1388 L1427	L1388-V1433 HydrophobicContact CD2-CG1 4.41Å; L1427-V1433 HydrophobicContact CD2-CG1 4.41Å
1434	S	84.5	Confident	91.5	Very high	57 Å²	57	44.1 Å²	44.1	40%	0.399	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85	-6.1	174.8	53.7	0	0	0	0	114.7	I1386 L1432	I1386-S1434 WeakPolarHBondContact CD1-O 3.41Å; L1432-S1434 PolarHBondContact O-N 2.95Å
1435	I	88.9	Confident	91.8	Very high	7 Å²	7	39.7 Å²	39.7	4%	0.036	21%	0.21	C	C	.	.	S	Bend	trans	-128.2	92.8	179.6	-58.4	-176.4	0	0	0	108.8	L1432 N1458 S1603 S1605 V1641	L1432-I1435 HydrophobicContact CB-CB 4.23Å; L1432-I1435 HydrophobicContact CB-CG1 4.49Å; L1432-I1435 HydrophobicContact CD1-CD1 3.93Å; L1432-I1435 HydrophobicContact CD1-CG1 4.47Å; L1432-I1435 CarbonylContact O-C 3.55Å; L1432-I1435 PolarHBondContact O-N 3.19Å; L1432-I1435 VanDerWaalsContact O-O 3.13Å; I1435-N1458 PolarHBondContact O-ND2 2.91Å; I1435-S1603 WeakPolarHBondContact CG2-O 3.46Å; I1435-S1605 VanDerWaalsContact CG2-OG 3.25Å; I1435-S1605 WeakPolarHBondContact CG2-OG 3.42Å; I1435-V1641 HydrophobicContact CB-CG2 4.43Å; I1435-V1641 HydrophobicContact CG2-CG2 4.14Å
1436	V	91.3	Very high	91.8	Very high	4 Å²	4	40.4 Å²	40.4	2%	0.024	22%	0.217	C	C	.	.			trans	-126.8	153.5	-175.3	-72.1	0	0	0	0	109.9	C1418 A1421 V1641	C1418-V1436 HydrophobicContact CB-CG2 3.92Å; A1421-V1436 HydrophobicContact CB-CB 3.67Å; A1421-V1436 HydrophobicContact CB-CG1 3.79Å; A1421-V1436 HydrophobicContact CB-CG2 4.36Å; V1436-V1641 WeakPolarHBondContact O-CG2 3.2Å
1437	P	93.5	Very high	91.7	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	25%	0.247	C	C	.	.	B	Isolated β-bridge	trans	-66.4	157	171.5	32.1	-36.5	0	0	0	110.6	C1418 R1442 Y1456 A1459 S1460	C1418-P1437 PolarHBondContact SG-O 2.75Å; P1437-R1442 HydrophobicContact CB-CB 3.78Å; P1437-R1442 HydrophobicContact CG-CB 3.87Å; P1437-Y1456 VanDerWaalsContact CD-OH 3.31Å; P1437-Y1456 WeakPolarHBondContact CD-OH 3.23Å; P1437-Y1456 HydrophobicContact CG-CE2 3.85Å; P1437-A1459 WeakPolarHBondContact CB-O 3.43Å; P1437-S1460 WeakPolarHBondContact CA-OG 3.38Å; P1437-S1460 VanDerWaalsContact CB-OG 3.31Å; P1437-S1460 WeakPolarHBondContact CB-OG 3.07Å
1438	F	90.4	Very high	91.5	Very high	3 Å²	3	43.5 Å²	43.5	1%	0.013	24%	0.241	C	C	.	.			trans	-76.1	145.3	162.4	-58.2	-60.6	0	0	0	109.3	P1384 V1416 S1417 C1418 W1440 N1441 R1442 Q1638 Q1639 V1641	P1384-F1438 HydrophobicContact CG-CE1 4.04Å; P1384-F1438 HydrophobicContact CG-CZ 3.97Å; V1416-F1438 HydrophobicContact CB-CD1 3.73Å; V1416-F1438 HydrophobicContact CB-CE1 3.97Å; V1416-F1438 HydrophobicContact CB-CG 4.39Å; V1416-F1438 HydrophobicContact CG1-CB 3.66Å; V1416-F1438 HydrophobicContact CG1-CD1 3.35Å; V1416-F1438 HydrophobicContact CG1-CD2 4.35Å; V1416-F1438 HydrophobicContact CG1-CE1 4.03Å; V1416-F1438 HydrophobicContact CG1-CG 3.55Å; V1416-F1438 HydrophobicContact CG2-CE1 4.48Å; S1417-F1438 WeakPolarHBondContact O-CA 3.37Å; C1418-F1438 VanDerWaalsContact SG-CD1 3.56Å; F1438-W1440 VanDerWaalsContact CB-CD1 3.47Å; F1438-W1440 HydrophobicContact CB-CG 4.47Å; F1438-W1440 AromaticContact CD2-NE1 3.84Å; F1438-W1440 AromaticContact CG-NE1 3.89Å; F1438-W1440 PolarHBondContact O-N 3.49Å; F1438-N1441 PolarHBondContact O-N 3.34Å; F1438-N1441 PolarHBondContact O-OD1 3.13Å; F1438-R1442 WeakPolarHBondContact O-CB 3.35Å; F1438-R1442 PolarHBondContact O-N 3.48Å; F1438-Q1638 WeakPolarHBondContact CE2-O 3.34Å; F1438-Q1639 VanDerWaalsContact CD2-O 3.3Å; F1438-Q1639 WeakPolarHBondContact CD2-O 3.38Å; F1438-V1641 HydrophobicContact CD1-CG1 4.31Å; F1438-V1641 HydrophobicContact CE1-CG1 3.45Å; F1438-V1641 VanDerWaalsContact CE1-CG1 3.45Å; F1438-V1641 HydrophobicContact CE2-CG1 4.32Å; F1438-V1641 HydrophobicContact CZ-CG1 3.45Å; F1438-V1641 VanDerWaalsContact CZ-CG1 3.45Å
1439	D	88.5	Confident	91.1	Very high	34 Å²	34	50.1 Å²	50.1	18%	0.182	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-23.3	-174.6	-68.3	-29.1	0	0	0	113.1	S1417 C1418 D1419 V1420	S1417-D1439 VanDerWaalsContact CB-OD2 3.26Å; S1417-D1439 WeakPolarHBondContact CB-OD2 3.45Å; S1417-D1439 PolarHBondContact O-N 2.84Å; S1417-D1439 PolarHBondContact OG-OD2 2.8Å; C1418-D1439 PolarHBondContact N-OD2 3.24Å; D1419-D1439 PolarHBondContact N-OD1 2.89Å; D1419-D1439 PolarHBondContact N-OD2 3.39Å; V1420-D1439 WeakPolarHBondContact CB-OD1 3.46Å; V1420-D1439 PolarHBondContact N-OD1 2.81Å; V1420-D1439 PolarHBondContact N-OD2 3.14Å
1440	W	85.9	Confident	90.5	Very high	156 Å²	156	52.9 Å²	52.9	59%	0.591	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-22.8	-177.4	73.3	-91.6	0	0	0	114.3	V1416 F1438 Q1639	V1416-W1440 VanDerWaalsContact CG1-CD1 3.49Å; F1438-W1440 VanDerWaalsContact CB-CD1 3.47Å; F1438-W1440 HydrophobicContact CB-CG 4.47Å; F1438-W1440 AromaticContact CD2-NE1 3.84Å; F1438-W1440 AromaticContact CG-NE1 3.89Å; F1438-W1440 PolarHBondContact O-N 3.49Å; W1440-Q1639 HydrophobicContact CH2-CG 4.1Å; W1440-Q1639 HydrophobicContact CZ2-CG 4.21Å
1441	N	91.1	Very high	90.1	Very high	9 Å²	9	56.1 Å²	56.1	5%	0.048	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.5	12.1	177.9	75.9	-28	0	0	0	113.9	F1438 S1460 F1461 Q1639	F1438-N1441 PolarHBondContact O-N 3.34Å; F1438-N1441 PolarHBondContact O-OD1 3.13Å; N1441-S1460 WeakPolarHBondContact O-CA 3.15Å; N1441-F1461 PolarHBondContact ND2-O 2.9Å; N1441-F1461 PolarHBondContact O-N 2.86Å; N1441-Q1639 PolarHBondContact ND2-O 2.95Å; N1441-Q1639 PolarHBondContact OD1-O 3.36Å
1442	R	94.8	Very high	89.8	Confident	35 Å²	35	60.6 Å²	60.6	13%	0.132	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	144.3	171.6	72	-177.1	-177.8	103.9	-5.9	110.1	P1437 F1438 T1444 D1455 A1459	P1437-R1442 HydrophobicContact CB-CB 3.78Å; P1437-R1442 HydrophobicContact CG-CB 3.87Å; F1438-R1442 WeakPolarHBondContact O-CB 3.35Å; F1438-R1442 PolarHBondContact O-N 3.48Å; R1442-T1444 HydrophobicContact CG-CG2 4.12Å; R1442-T1444 PolarHBondContact O-N 3.42Å; R1442-T1444 VanDerWaalsContact O-N 3.17Å; R1442-D1455 IonicContact CZ-OD2 3.7Å; R1442-D1455 PolarHBondContact NH1-O 2.79Å; R1442-D1455 IonicContact NH1-OD2 2.7Å; R1442-D1455 PolarHBondContact NH1-OD2 2.77Å; R1442-D1455 IonicContact NH2-OD2 3.62Å; R1442-D1455 PolarHBondContact NH2-OD2 3.43Å; R1442-A1459 CarbonylContact C-O 3.55Å; R1442-A1459 VanDerWaalsContact CA-O 3.31Å; R1442-A1459 WeakPolarHBondContact CA-O 3.41Å
1443	V	96.9	Very high	89.7	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	110.5	172.1	-172.9	0	0	0	0	108.7	I1457 A1459 F1461 I1472 M1488 K1492	V1443-I1457 HydrophobicContact CB-CG2 4.32Å; V1443-I1457 WeakPolarHBondContact O-CG2 3.34Å; V1443-A1459 HydrophobicContact CB-CB 3.96Å; V1443-A1459 HydrophobicContact CG2-CB 3.69Å; V1443-A1459 PolarHBondContact N-O 2.83Å; V1443-F1461 HydrophobicContact CB-CE2 4.21Å; V1443-F1461 HydrophobicContact CG1-CE2 4.09Å; V1443-F1461 HydrophobicContact CG1-CZ 4.03Å; V1443-F1461 HydrophobicContact CG2-CD1 4.44Å; V1443-F1461 HydrophobicContact CG2-CD2 3.95Å; V1443-F1461 HydrophobicContact CG2-CE1 4.38Å; V1443-F1461 HydrophobicContact CG2-CE2 3.89Å; V1443-F1461 HydrophobicContact CG2-CG 4.24Å; V1443-F1461 HydrophobicContact CG2-CZ 4.11Å; V1443-I1472 HydrophobicContact CG2-CD1 4.29Å; V1443-I1472 HydrophobicContact CG2-CG1 4.07Å; V1443-I1472 HydrophobicContact CG2-CG2 3.85Å; V1443-M1488 HydrophobicContact CB-CG 4.49Å; V1443-M1488 HydrophobicContact CB-SD 4.31Å; V1443-M1488 HydrophobicContact CG1-CG 3.74Å; V1443-M1488 HydrophobicContact CG1-SD 4.17Å; V1443-M1488 HydrophobicContact CG2-SD 4.43Å; V1443-K1492 HydrophobicContact CG1-CD 4.13Å; V1443-K1492 HydrophobicContact CG1-CG 3.69Å
1444	T	95.2	Very high	89.9	Confident	68 Å²	68	53.9 Å²	53.9	42%	0.417	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	123	177.9	52.8	0	0	0	0	110.9	R1442 K1492	R1442-T1444 HydrophobicContact CG-CG2 4.12Å; R1442-T1444 PolarHBondContact O-N 3.42Å; R1442-T1444 VanDerWaalsContact O-N 3.17Å; T1444-K1492 WeakPolarHBondContact O-CE 3.47Å; T1444-K1492 PolarHBondContact O-NZ 2.91Å
1445	L	95.5	Very high	90.4	Very high	7 Å²	7	52.4 Å²	52.4	4%	0.037	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-87.2	156.9	173.5	-54	-176.7	0	0	0	111.2	S1447 D1455 I1457 D1484 M1488 E1491	L1445-S1447 PolarHBondContact O-N 3.43Å; L1445-D1455 PolarHBondContact N-O 3.42Å; L1445-D1455 WeakPolarHBondContact O-CA 3.09Å; L1445-I1457 HydrophobicContact CD1-CB 4.13Å; L1445-I1457 HydrophobicContact CD1-CG2 4.03Å; L1445-I1457 HydrophobicContact CD2-CG2 4.1Å; L1445-I1457 HydrophobicContact CG-CG2 3.94Å; L1445-D1484 HydrophobicContact CD1-CB 3.91Å; L1445-D1484 WeakPolarHBondContact CD1-O 3.39Å; L1445-M1488 HydrophobicContact CD2-CB 3.72Å; L1445-M1488 HydrophobicContact CD2-CG 4.04Å; L1445-E1491 VanDerWaalsContact CA-OE2 3.26Å; L1445-E1491 WeakPolarHBondContact CA-OE2 3.27Å
1446	C	91.5	Very high	90.8	Very high	82 Å²	82	52 Å²	52	55%	0.554	29%	0.287	S	S	*	.	P	Polyproline II helix	trans	-61.9	124.7	170.2	-68	0	0	0	0	109.8	I1448 E1491	C1446-I1448 PolarHBondContact O-N 2.97Å; C1446-E1491 VanDerWaalsContact CB-OE1 3.29Å; C1446-E1491 WeakPolarHBondContact CB-OE1 3.06Å; C1446-E1491 PolarHBondContact N-OE1 3.42Å; C1446-E1491 PolarHBondContact N-OE2 2.98Å
1447	S	90.6	Very high	91.1	Very high	90 Å²	90	52.1 Å²	52.1	63%	0.629	29%	0.287	S	S	*	.	P	Polyproline II helix	trans	-65.9	124.5	-177.4	-48.8	0	0	0	0	111.1	L1445	L1445-S1447 PolarHBondContact O-N 3.43Å
1448	I	88.6	Confident	91.3	Very high	49 Å²	49	52.1 Å²	52.1	25%	0.251	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-76.8	123.5	173.3	-60.6	162.1	0	0	0	107.4	C1446 G1450 V1451 S1454 Q1524	C1446-I1448 PolarHBondContact O-N 2.97Å; I1448-G1450 PolarHBondContact O-N 2.96Å; I1448-V1451 HydrophobicContact CB-CB 4.21Å; I1448-V1451 HydrophobicContact CB-CG2 4.3Å; I1448-V1451 HydrophobicContact CG2-CB 4.31Å; I1448-V1451 HydrophobicContact CG2-CG2 3.85Å; I1448-V1451 PolarHBondContact O-N 3.33Å; I1448-S1454 PolarHBondContact N-OG 2.99Å; I1448-S1454 PolarHBondContact O-OG 2.96Å; I1448-Q1524 VanDerWaalsContact CD1-NE2 3.25Å
1449	R	84.9	Confident	91.6	Very high	216 Å²	216	52 Å²	52	82%	0.815	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54	125.1	179.5	-62	-176.1	-174.3	178.8	2.3	109.8
1450	G	81.7	Confident	92	Very high	86 Å²	86	50.4 Å²	50.4	89%	0.887	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.1	4.9	179.6	0	0	0	0	0	116.3	I1448	I1448-G1450 PolarHBondContact O-N 2.96Å
1451	V	86.4	Confident	92.6	Very high	78 Å²	78	44.9 Å²	44.9	47%	0.473	26%	0.258	S	S	.	.			trans	-120.6	98.2	177.6	-174.4	0	0	0	0	110.6	I1448 S1454	I1448-V1451 HydrophobicContact CB-CB 4.21Å; I1448-V1451 HydrophobicContact CB-CG2 4.3Å; I1448-V1451 HydrophobicContact CG2-CB 4.31Å; I1448-V1451 HydrophobicContact CG2-CG2 3.85Å; I1448-V1451 PolarHBondContact O-N 3.33Å; V1451-S1454 WeakPolarHBondContact O-CB 3.45Å; V1451-S1454 PolarHBondContact O-N 3.36Å; V1451-S1454 PolarHBondContact O-OG 3.02Å
1452	D	86.3	Confident	92.8	Very high	141 Å²	141	44.4 Å²	44.4	75%	0.754	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	135.4	175.2	-76.2	-23.3	0	0	0	111.7	S1454	D1452-S1454 PolarHBondContact O-N 3.28Å
1453	G	88.3	Confident	92.7	Very high	6 Å²	6	43.5 Å²	43.5	6%	0.062	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	73.8	8	-176.8	0	0	0	0	0	114.8	N1426 K1429 D1455 Y1456	N1426-G1453 WeakPolarHBondContact OD1-CA 3.04Å; N1426-G1453 PolarHBondContact OD1-O 3.36Å; K1429-G1453 PolarHBondContact NZ-O 2.65Å; G1453-D1455 WeakPolarHBondContact CA-OD1 3.48Å; G1453-D1455 PolarHBondContact O-N 3.01Å; G1453-Y1456 PolarHBondContact O-N 3.31Å; G1453-Y1456 VanDerWaalsContact O-N 3.09Å
1454	S	93.5	Very high	92.4	Very high	4 Å²	4	43.8 Å²	43.8	3%	0.028	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-16.7	170.4	55.9	0	0	0	0	114	I1448 V1451 D1452 Y1456 R1487	I1448-S1454 PolarHBondContact N-OG 2.99Å; I1448-S1454 PolarHBondContact O-OG 2.96Å; V1451-S1454 WeakPolarHBondContact O-CB 3.45Å; V1451-S1454 PolarHBondContact O-N 3.36Å; V1451-S1454 PolarHBondContact O-OG 3.02Å; D1452-S1454 PolarHBondContact O-N 3.28Å; S1454-Y1456 VanDerWaalsContact C-N 3.29Å; S1454-R1487 PolarHBondContact O-NH2 3.43Å
1455	D	94.9	Very high	92.2	Very high	25 Å²	25	41.7 Å²	41.7	13%	0.134	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-11.8	172.2	74.6	-61.6	0	0	0	113.4	R1442 L1445 G1453	R1442-D1455 IonicContact CZ-OD2 3.7Å; R1442-D1455 PolarHBondContact NH1-O 2.79Å; R1442-D1455 IonicContact NH1-OD2 2.7Å; R1442-D1455 PolarHBondContact NH1-OD2 2.77Å; R1442-D1455 IonicContact NH2-OD2 3.62Å; R1442-D1455 PolarHBondContact NH2-OD2 3.43Å; L1445-D1455 PolarHBondContact N-O 3.42Å; L1445-D1455 WeakPolarHBondContact O-CA 3.09Å; G1453-D1455 WeakPolarHBondContact CA-OD1 3.48Å; G1453-D1455 PolarHBondContact O-N 3.01Å
1456	Y	97.2	Very high	91.8	Very high	0 Å²	0	44 Å²	44	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	128.4	-172.1	179.7	-95.8	0	0	0	113.4	V1420 A1421 N1426 K1429 N1430 P1437 G1453 S1454	V1420-Y1456 HydrophobicContact CG1-CD2 4.07Å; A1421-Y1456 HydrophobicContact CB-CE2 3.64Å; A1421-Y1456 VanDerWaalsContact CB-OH 3.29Å; A1421-Y1456 WeakPolarHBondContact CB-OH 3.32Å; N1426-Y1456 HydrophobicContact CB-CD1 3.64Å; N1426-Y1456 HydrophobicContact CB-CE1 3.98Å; N1426-Y1456 HydrophobicContact CB-CG 4.14Å; N1426-Y1456 VanDerWaalsContact CG-CD1 3.5Å; N1426-Y1456 WeakPolarHBondContact ND2-CB 3.2Å; K1429-Y1456 HydrophobicContact CB-CD1 4.16Å; K1429-Y1456 HydrophobicContact CB-CE1 4.12Å; K1429-Y1456 HydrophobicContact CD-CD1 4.02Å; K1429-Y1456 WeakPolarHBondContact CD-O 3.09Å; K1429-Y1456 PolarHBondContact NZ-O 2.72Å; N1430-Y1456 WeakPolarHBondContact OD1-CE1 3.36Å; N1430-Y1456 PolarHBondContact OD1-OH 3.25Å; P1437-Y1456 VanDerWaalsContact CD-OH 3.31Å; P1437-Y1456 WeakPolarHBondContact CD-OH 3.23Å; P1437-Y1456 HydrophobicContact CG-CE2 3.85Å; G1453-Y1456 PolarHBondContact O-N 3.31Å; G1453-Y1456 VanDerWaalsContact O-N 3.09Å; S1454-Y1456 VanDerWaalsContact C-N 3.29Å
1457	I	97.3	Very high	91.6	Very high	5 Å²	5	44.3 Å²	44.3	3%	0.026	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	147.9	162.3	-178.5	163	0	0	0	108.8	V1443 L1445 A1459 D1484 F1485 M1488	V1443-I1457 HydrophobicContact CB-CG2 4.32Å; V1443-I1457 WeakPolarHBondContact O-CG2 3.34Å; L1445-I1457 HydrophobicContact CD1-CB 4.13Å; L1445-I1457 HydrophobicContact CD1-CG2 4.03Å; L1445-I1457 HydrophobicContact CD2-CG2 4.1Å; L1445-I1457 HydrophobicContact CG-CG2 3.94Å; I1457-A1459 HydrophobicContact CG1-CB 4.49Å; I1457-A1459 HydrophobicContact CG2-CB 4.13Å; I1457-A1459 PolarHBondContact O-N 2.68Å; I1457-D1484 HydrophobicContact CD1-CB 4.17Å; I1457-F1485 HydrophobicContact CD1-CB 4.25Å; I1457-M1488 HydrophobicContact CD1-CB 4.19Å; I1457-M1488 HydrophobicContact CD1-SD 3.92Å; I1457-M1488 HydrophobicContact CG2-CG 4.4Å; I1457-M1488 HydrophobicContact CG2-SD 4.03Å
1458	N	97.2	Very high	91.4	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	77.6	175.9	-169.5	-38.8	0	0	0	110.9	N1430 I1435 C1474 Q1475 R1640	N1430-N1458 PolarHBondContact OD1-ND2 2.61Å; I1435-N1458 PolarHBondContact O-ND2 2.91Å; N1458-C1474 WeakPolarHBondContact O-CA 3.44Å; N1458-C1474 WeakPolarHBondContact O-CB 3.08Å; N1458-Q1475 HydrophobicContact CB-CG 4.15Å; N1458-Q1475 PolarHBondContact O-N 3.17Å; N1458-R1640 PolarHBondContact OD1-NH1 2.82Å; N1458-R1640 PolarHBondContact OD1-NH2 2.85Å
1459	A	97.7	Very high	91.6	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	143.6	-179.9	0	0	0	0	0	110.4	P1437 R1442 V1443 I1457 I1472 A1473 C1474 M1488	P1437-A1459 WeakPolarHBondContact CB-O 3.43Å; R1442-A1459 CarbonylContact C-O 3.55Å; R1442-A1459 VanDerWaalsContact CA-O 3.31Å; R1442-A1459 WeakPolarHBondContact CA-O 3.41Å; V1443-A1459 HydrophobicContact CB-CB 3.96Å; V1443-A1459 HydrophobicContact CG2-CB 3.69Å; V1443-A1459 PolarHBondContact N-O 2.83Å; I1457-A1459 HydrophobicContact CG1-CB 4.49Å; I1457-A1459 HydrophobicContact CG2-CB 4.13Å; I1457-A1459 PolarHBondContact O-N 2.68Å; A1459-I1472 HydrophobicContact CB-CG2 3.9Å; A1459-A1473 WeakPolarHBondContact CA-O 3.43Å; A1459-C1474 HydrophobicContact CB-CB 3.47Å; A1459-C1474 VanDerWaalsContact CB-CB 3.47Å; A1459-M1488 HydrophobicContact CB-SD 3.57Å; A1459-M1488 VanDerWaalsContact CB-SD 3.57Å
1460	S	97.1	Very high	92	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	137.7	175.8	-60.7	0	0	0	0	109.9	P1437 N1441 I1472 A1473 R1640	P1437-S1460 WeakPolarHBondContact CA-OG 3.38Å; P1437-S1460 VanDerWaalsContact CB-OG 3.31Å; P1437-S1460 WeakPolarHBondContact CB-OG 3.07Å; N1441-S1460 WeakPolarHBondContact O-CA 3.15Å; S1460-I1472 CarbonylContact O-C 3.4Å; S1460-I1472 WeakPolarHBondContact O-CA 3.39Å; S1460-A1473 PolarHBondContact N-O 2.95Å; S1460-A1473 PolarHBondContact O-N 3.34Å; S1460-R1640 PolarHBondContact OG-NH1 2.91Å
1461	F	97.1	Very high	92.8	Very high	40 Å²	40	32.6 Å²	32.6	18%	0.175	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	135.7	160.2	-71.6	-72	0	0	0	109.8	N1441 V1443 N1469 I1472 K1492 P1596	N1441-F1461 PolarHBondContact ND2-O 2.9Å; N1441-F1461 PolarHBondContact O-N 2.86Å; V1443-F1461 HydrophobicContact CB-CE2 4.21Å; V1443-F1461 HydrophobicContact CG1-CE2 4.09Å; V1443-F1461 HydrophobicContact CG1-CZ 4.03Å; V1443-F1461 HydrophobicContact CG2-CD1 4.44Å; V1443-F1461 HydrophobicContact CG2-CD2 3.95Å; V1443-F1461 HydrophobicContact CG2-CE1 4.38Å; V1443-F1461 HydrophobicContact CG2-CE2 3.89Å; V1443-F1461 HydrophobicContact CG2-CG 4.24Å; V1443-F1461 HydrophobicContact CG2-CZ 4.11Å; F1461-N1469 HydrophobicContact CB-CB 4.14Å; F1461-N1469 WeakPolarHBondContact CB-OD1 2.92Å; F1461-N1469 HydrophobicContact CD1-CB 3.91Å; F1461-N1469 HydrophobicContact CG-CB 4.25Å; F1461-I1472 HydrophobicContact CD1-CD1 4.39Å; F1461-I1472 HydrophobicContact CD1-CG1 3.75Å; F1461-I1472 HydrophobicContact CE1-CD1 3.85Å; F1461-I1472 HydrophobicContact CE1-CG1 3.73Å; F1461-K1492 HydrophobicContact CZ-CD 4.14Å; F1461-K1492 HydrophobicContact CZ-CG 4.27Å; F1461-P1596 HydrophobicContact CE1-CG 4.41Å
1462	I	95.7	Very high	93.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	136.2	-179.1	-55.4	-64.9	0	0	0	108.7	N1469 A1470 Y1471 A1473 I1612 L1636 Q1639 R1640 M1643	I1462-N1469 CarbonylContact O-C 3.52Å; I1462-N1469 VanDerWaalsContact O-C 3.28Å; I1462-N1469 WeakPolarHBondContact O-CA 3.38Å; I1462-A1470 PolarHBondContact O-N 2.69Å; I1462-A1470 VanDerWaalsContact O-N 3.15Å; I1462-Y1471 PolarHBondContact N-O 2.87Å; I1462-Y1471 PolarHBondContact O-N 3.31Å; I1462-Y1471 VanDerWaalsContact O-N 3.07Å; I1462-A1473 HydrophobicContact CD1-CB 4.28Å; I1462-A1473 HydrophobicContact CG1-CB 3.54Å; I1462-I1612 HydrophobicContact CB-CD1 4.47Å; I1462-I1612 HydrophobicContact CG2-CD1 4.32Å; I1462-I1612 HydrophobicContact CG2-CG2 4.02Å; I1462-L1636 HydrophobicContact CG2-CD2 3.36Å; I1462-Q1639 HydrophobicContact CD1-CB 3.67Å; I1462-R1640 HydrophobicContact CD1-CB 3.81Å; I1462-M1643 HydrophobicContact CD1-CE 4.36Å; I1462-M1643 HydrophobicContact CG1-CE 4.39Å
1463	D	92.2	Very high	93.9	Very high	15 Å²	15	22.2 Å²	22.2	8%	0.08	11%	0.111	C	C	.	.			trans	-71.6	139.1	176.8	-67.5	-29.8	0	0	0	111.8	K1468 N1469 N1616 Q1639	D1463-K1468 WeakPolarHBondContact OD1-CA 3.41Å; D1463-K1468 WeakPolarHBondContact OD1-CB 3.37Å; D1463-K1468 IonicContact OD2-NZ 2.69Å; D1463-N1469 PolarHBondContact OD1-N 3.16Å; D1463-N1616 PolarHBondContact O-ND2 3.18Å; D1463-N1616 VanDerWaalsContact O-ND2 3.13Å; D1463-Q1639 PolarHBondContact OD2-NE2 2.84Å
1464	G	92.1	Very high	94.3	Very high	6 Å²	6	22 Å²	22	6%	0.062	11%	0.109	C	C	.	.			trans	-79.7	-173.3	162.1	0	0	0	0	0	111.4	A1201 E1467 N1616	A1201-G1464 WeakPolarHBondContact CB-O 3.5Å; G1464-E1467 WeakPolarHBondContact CA-O 3.43Å; G1464-E1467 PolarHBondContact N-O 3.47Å; G1464-N1616 WeakPolarHBondContact CA-OD1 3.2Å
1465	Y	89.7	Confident	94.5	Very high	25 Å²	25	22.1 Å²	22.1	10%	0.098	11%	0.109	C	C	.	.	S	Bend	trans	-81.8	-41.9	173.4	174.6	-97.9	0	0	0	111.8	L1200 A1201 N1616 E1619 R1620 Q1623 E1624	L1200-Y1465 HydrophobicContact CD1-CE1 4.41Å; L1200-Y1465 HydrophobicContact CD1-CE2 4.1Å; L1200-Y1465 VanDerWaalsContact CD1-OH 3.3Å; L1200-Y1465 WeakPolarHBondContact CD1-OH 3.34Å; L1200-Y1465 HydrophobicContact CD2-CD1 4.23Å; L1200-Y1465 HydrophobicContact CD2-CE1 3.46Å; L1200-Y1465 VanDerWaalsContact CD2-CE1 3.46Å; A1201-Y1465 PolarHBondContact N-O 2.76Å; Y1465-N1616 PolarHBondContact N-OD1 3.11Å; Y1465-E1619 WeakPolarHBondContact CB-OE2 3.44Å; Y1465-E1619 HydrophobicContact CD1-CB 4.21Å; Y1465-E1619 HydrophobicContact CD1-CG 3.94Å; Y1465-R1620 HydrophobicContact CD1-CB 4.4Å; Y1465-R1620 HydrophobicContact CD2-CB 3.72Å; Y1465-R1620 HydrophobicContact CD2-CG 4.13Å; Y1465-R1620 HydrophobicContact CE1-CB 4.22Å; Y1465-R1620 HydrophobicContact CE2-CB 3.52Å; Y1465-R1620 HydrophobicContact CE2-CG 3.46Å; Y1465-R1620 VanDerWaalsContact CE2-CG 3.46Å; Y1465-R1620 HydrophobicContact CG-CB 4.15Å; Y1465-Q1623 HydrophobicContact CE1-CB 3.85Å; Y1465-Q1623 HydrophobicContact CE1-CG 4Å; Y1465-E1624 VanDerWaalsContact OH-CG 3.24Å; Y1465-E1624 WeakPolarHBondContact OH-CG 3.25Å; Y1465-E1624 PolarHBondContact OH-OE2 3.02Å
1466	L	87.8	Confident	94.5	Very high	55 Å²	55	20.9 Å²	20.9	29%	0.288	10%	0.103	S	C	.	.	S	Bend	trans	-84	-39.8	174	-63	176.9	0	0	0	114.1	E1199 L1200 A1201 E1619	E1199-L1466 WeakPolarHBondContact O-CD2 3.36Å; L1200-L1466 CarbonylContact C-O 3.5Å; L1200-L1466 HydrophobicContact CD2-CD2 3.82Å; A1201-L1466 WeakPolarHBondContact CA-O 3.45Å; A1201-L1466 PolarHBondContact N-O 3.08Å; L1466-E1619 HydrophobicContact CD1-CG 4.18Å; L1466-E1619 HydrophobicContact CG-CG 4.14Å; L1466-E1619 WeakPolarHBondContact CG-OE2 3.28Å; L1466-E1619 PolarHBondContact N-OE2 2.77Å
1467	E	86.5	Confident	94.5	Very high	89 Å²	89	21 Å²	21	42%	0.416	10%	0.103	S	C	.	.	S	Bend	trans	-120.8	143.7	-169	-70.4	165.7	-146.3	0	0	112.9	G1464 A1470 K1588	G1464-E1467 WeakPolarHBondContact CA-O 3.43Å; G1464-E1467 PolarHBondContact N-O 3.47Å; E1467-A1470 HydrophobicContact CB-CB 3.99Å; E1467-K1588 IonicContact OE1-NZ 3.16Å; E1467-K1588 PolarHBondContact OE1-NZ 2.82Å; E1467-K1588 IonicContact OE2-NZ 3.52Å; E1467-K1588 PolarHBondContact OE2-NZ 3.24Å
1468	K	88	Confident	94.4	Very high	96 Å²	96	22.5 Å²	22.5	42%	0.417	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.3	149.1	169.2	-69.4	-152.7	174	-129.5	0	112.1	A1201 N1202 S1226 D1463 A1470	A1201-K1468 HydrophobicContact CB-CG 4.12Å; A1201-K1468 WeakPolarHBondContact O-CE 3.29Å; A1201-K1468 VanDerWaalsContact O-CG 3.28Å; A1201-K1468 WeakPolarHBondContact O-CG 3.32Å; N1202-K1468 WeakPolarHBondContact OD1-CE 3.16Å; N1202-K1468 PolarHBondContact OD1-NZ 2.84Å; S1226-K1468 WeakPolarHBondContact OG-CE 3.36Å; S1226-K1468 PolarHBondContact OG-NZ 2.87Å; D1463-K1468 WeakPolarHBondContact OD1-CA 3.41Å; D1463-K1468 WeakPolarHBondContact OD1-CB 3.37Å; D1463-K1468 IonicContact OD2-NZ 2.69Å; K1468-A1470 PolarHBondContact O-N 3.2Å
1469	N	91.9	Very high	94.3	Very high	83 Å²	83	28.7 Å²	28.7	44%	0.444	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	18.7	-178.3	-58.1	-35.3	0	0	0	115	F1461 I1462 D1463 Y1471 P1596	F1461-N1469 HydrophobicContact CB-CB 4.14Å; F1461-N1469 WeakPolarHBondContact CB-OD1 2.92Å; F1461-N1469 HydrophobicContact CD1-CB 3.91Å; F1461-N1469 HydrophobicContact CG-CB 4.25Å; I1462-N1469 CarbonylContact O-C 3.52Å; I1462-N1469 VanDerWaalsContact O-C 3.28Å; I1462-N1469 WeakPolarHBondContact O-CA 3.38Å; D1463-N1469 PolarHBondContact OD1-N 3.16Å; N1469-Y1471 PolarHBondContact O-N 3.37Å; N1469-P1596 WeakPolarHBondContact O-CB 3.38Å
1470	A	93.8	Very high	94	Very high	10 Å²	10	31.8 Å²	31.8	8%	0.083	16%	0.164	C	C	.	.			trans	-57.6	-21.3	-173.6	0	0	0	0	0	114.5	I1462 E1467 K1468 P1596 I1597	I1462-A1470 PolarHBondContact O-N 2.69Å; I1462-A1470 VanDerWaalsContact O-N 3.15Å; E1467-A1470 HydrophobicContact CB-CB 3.99Å; K1468-A1470 PolarHBondContact O-N 3.2Å; A1470-P1596 WeakPolarHBondContact O-CA 3.48Å; A1470-I1597 PolarHBondContact O-N 3.35Å
1471	Y	97.3	Very high	93.9	Very high	6 Å²	6	31.9 Å²	31.9	2%	0.024	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	145.3	-179.3	-54.2	-65.9	0	0	0	111.6	I1462 N1469 I1597 I1599 I1612 C1615	I1462-Y1471 PolarHBondContact N-O 2.87Å; I1462-Y1471 PolarHBondContact O-N 3.31Å; I1462-Y1471 VanDerWaalsContact O-N 3.07Å; N1469-Y1471 PolarHBondContact O-N 3.37Å; Y1471-I1597 WeakPolarHBondContact CA-O 3.37Å; Y1471-I1597 HydrophobicContact CD1-CB 4.03Å; Y1471-I1597 HydrophobicContact CE1-CB 4.4Å; Y1471-I1597 HydrophobicContact CE1-CD1 4.16Å; Y1471-I1599 HydrophobicContact CD1-CD1 3.31Å; Y1471-I1599 HydrophobicContact CD1-CG1 4.37Å; Y1471-I1599 HydrophobicContact CE1-CD1 3.91Å; Y1471-I1599 HydrophobicContact CG-CD1 3.89Å; Y1471-I1612 HydrophobicContact CD2-CD1 4.33Å; Y1471-I1612 HydrophobicContact CD2-CG1 4.16Å; Y1471-I1612 HydrophobicContact CD2-CG2 3.71Å; Y1471-I1612 HydrophobicContact CE2-CG2 3.93Å; Y1471-I1612 HydrophobicContact CG-CD1 4.11Å; Y1471-I1612 HydrophobicContact CG-CG1 4.13Å; Y1471-I1612 HydrophobicContact CG-CG2 4.49Å; Y1471-C1615 VanDerWaalsContact OH-CB 3.23Å; Y1471-C1615 WeakPolarHBondContact OH-CB 3.48Å
1472	I	98.1	Very high	93.9	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	110.2	161.8	-70	169.4	0	0	0	107.9	V1443 A1459 S1460 F1461 C1474 M1488 K1492 P1596 I1597 T1598 I1599	V1443-I1472 HydrophobicContact CG2-CD1 4.29Å; V1443-I1472 HydrophobicContact CG2-CG1 4.07Å; V1443-I1472 HydrophobicContact CG2-CG2 3.85Å; A1459-I1472 HydrophobicContact CB-CG2 3.9Å; S1460-I1472 CarbonylContact O-C 3.4Å; S1460-I1472 WeakPolarHBondContact O-CA 3.39Å; F1461-I1472 HydrophobicContact CD1-CD1 4.39Å; F1461-I1472 HydrophobicContact CD1-CG1 3.75Å; F1461-I1472 HydrophobicContact CE1-CD1 3.85Å; F1461-I1472 HydrophobicContact CE1-CG1 3.73Å; I1472-C1474 HydrophobicContact CG2-CB 4.37Å; I1472-M1488 HydrophobicContact CG2-CE 3.78Å; I1472-M1488 HydrophobicContact CG2-SD 3.83Å; I1472-K1492 HydrophobicContact CD1-CB 3.94Å; I1472-K1492 HydrophobicContact CD1-CG 4.28Å; I1472-P1596 HydrophobicContact CD1-CB 4.23Å; I1472-P1596 HydrophobicContact CD1-CG 3.69Å; I1472-P1596 HydrophobicContact CG1-CB 4.07Å; I1472-P1596 HydrophobicContact CG1-CG 4.07Å; I1472-I1597 PolarHBondContact N-O 3.44Å; I1472-T1598 CarbonylContact O-C 3.59Å; I1472-I1599 PolarHBondContact O-N 3.47Å
1473	A	98.1	Very high	93.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	106.9	173.9	0	0	0	0	0	110.1	A1459 S1460 I1462 T1608 I1612 R1640 M1643	A1459-A1473 WeakPolarHBondContact CA-O 3.43Å; S1460-A1473 PolarHBondContact N-O 2.95Å; S1460-A1473 PolarHBondContact O-N 3.34Å; I1462-A1473 HydrophobicContact CD1-CB 4.28Å; I1462-A1473 HydrophobicContact CG1-CB 3.54Å; A1473-T1608 HydrophobicContact CB-CG2 3.63Å; A1473-I1612 HydrophobicContact CB-CD1 4.22Å; A1473-R1640 PolarHBondContact O-NH1 2.9Å; A1473-M1643 HydrophobicContact CB-CE 4.39Å
1474	C	97.6	Very high	94.1	Very high	2 Å²	2	34.6 Å²	34.6	1%	0.014	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	162	-178.4	75.1	0	0	0	0	113.4	N1458 A1459 I1472 I1599 H1600 G1604	N1458-C1474 WeakPolarHBondContact O-CA 3.44Å; N1458-C1474 WeakPolarHBondContact O-CB 3.08Å; A1459-C1474 HydrophobicContact CB-CB 3.47Å; A1459-C1474 VanDerWaalsContact CB-CB 3.47Å; I1472-C1474 HydrophobicContact CG2-CB 4.37Å; C1474-I1599 PolarHBondContact N-O 3.27Å; C1474-H1600 WeakPolarHBondContact O-CA 3.45Å; C1474-H1600 VanDerWaalsContact O-CB 3.25Å; C1474-H1600 WeakPolarHBondContact O-CB 3.37Å; C1474-G1604 WeakPolarHBondContact O-CA 3.29Å
1475	Q	96.7	Very high	94.3	Very high	6 Å²	6	34.3 Å²	34.3	3%	0.028	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-65.2	157.6	168.8	75.2	-175.1	14.4	0	0	111	K1429 N1458 P1477	K1429-Q1475 PolarHBondContact O-NE2 2.87Å; N1458-Q1475 HydrophobicContact CB-CG 4.15Å; N1458-Q1475 PolarHBondContact O-N 3.17Å; Q1475-P1477 WeakPolarHBondContact O-CD 2.88Å
1476	G	96.5	Very high	94.7	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.171	C	C	.	.	P	Polyproline II helix	trans	-67.2	121.9	170.5	0	0	0	0	0	109.5	R1431 M1478 C1601 S1602	R1431-G1476 PolarHBondContact NE-O 2.81Å; R1431-G1476 PolarHBondContact NH2-O 2.88Å; R1431-G1476 VanDerWaalsContact NH2-O 3.13Å; G1476-M1478 PolarHBondContact O-N 2.88Å; G1476-C1601 WeakPolarHBondContact CA-O 3.41Å; G1476-C1601 PolarHBondContact N-O 2.82Å; G1476-S1602 PolarHBondContact N-O 3.04Å; G1476-S1602 VanDerWaalsContact N-O 3.13Å
1477	P	96.9	Very high	95.1	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.006	16%	0.158	C	C	.	.	P	Polyproline II helix	trans	-47	139.1	-172.1	-34.9	38	0	0	0	114	R1431 Q1475 F1485 F1512 Y1514	R1431-P1477 PolarHBondContact NH2-O 3.4Å; Q1475-P1477 WeakPolarHBondContact O-CD 2.88Å; P1477-F1485 HydrophobicContact CB-CB 4.39Å; P1477-F1485 HydrophobicContact CB-CG 4.42Å; P1477-F1485 HydrophobicContact CG-CB 3.97Å; P1477-F1485 HydrophobicContact CG-CD1 4Å; P1477-F1485 HydrophobicContact CG-CD2 3.48Å; P1477-F1485 VanDerWaalsContact CG-CD2 3.48Å; P1477-F1485 HydrophobicContact CG-CE1 4.4Å; P1477-F1485 HydrophobicContact CG-CE2 3.9Å; P1477-F1485 HydrophobicContact CG-CG 3.53Å; P1477-F1485 HydrophobicContact CG-CZ 4.35Å; P1477-F1512 VanDerWaalsContact O-CB 3.25Å; P1477-F1512 WeakPolarHBondContact O-CB 2.94Å; P1477-F1512 PolarHBondContact O-N 3.04Å; P1477-Y1514 HydrophobicContact CB-CD1 3.98Å; P1477-Y1514 HydrophobicContact CB-CG 4.28Å; P1477-Y1514 HydrophobicContact CG-CD1 3.68Å; P1477-Y1514 HydrophobicContact CG-CE1 4.08Å; P1477-Y1514 HydrophobicContact CG-CG 4.11Å
1478	M	95.5	Very high	95.6	Very high	38 Å²	38	26.6 Å²	26.6	19%	0.187	14%	0.138	C	C	.	.	P	Polyproline II helix	trans	-98.1	161.4	170.3	-66.1	164.4	60.5	0	0	108.7	R1431 G1476 S1480 T1481 V1482	R1431-M1478 VanDerWaalsContact CA-SD 3.51Å; R1431-M1478 HydrophobicContact CB-CG 4.23Å; R1431-M1478 HydrophobicContact CB-SD 3.67Å; R1431-M1478 HydrophobicContact CG-CG 4.47Å; R1431-M1478 HydrophobicContact CG-SD 4.33Å; R1431-M1478 PolarHBondContact N-SD 3.13Å; R1431-M1478 VanDerWaalsContact N-SD 3.43Å; G1476-M1478 PolarHBondContact O-N 2.88Å; M1478-S1480 PolarHBondContact O-N 2.87Å; M1478-S1480 VanDerWaalsContact O-N 3.15Å; M1478-T1481 HydrophobicContact CB-CG2 4.37Å; M1478-T1481 PolarHBondContact N-OG1 3.46Å; M1478-T1481 CarbonylContact O-C 2.65Å; M1478-T1481 PolarHBondContact O-N 3.13Å; M1478-T1481 PolarHBondContact O-OG1 3.2Å; M1478-V1482 WeakPolarHBondContact O-CG2 3.43Å; M1478-V1482 PolarHBondContact O-N 2.86Å; M1478-V1482 VanDerWaalsContact O-N 3.14Å
1479	I	93.1	Very high	96.1	Very high	130 Å²	130	22 Å²	22	67%	0.667	12%	0.119	S	C	*	.	G	3₁₀ helix	trans	-53.5	-34.6	173.7	-167.5	170.3	0	0	0	112.6	T1481 F1512	I1479-T1481 VanDerWaalsContact C-N 3.27Å; I1479-T1481 PolarHBondContact O-N 2.83Å; I1479-F1512 HydrophobicContact CB-CD2 4.04Å; I1479-F1512 HydrophobicContact CB-CE2 4.02Å; I1479-F1512 HydrophobicContact CB-CG 4.43Å; I1479-F1512 HydrophobicContact CB-CZ 4.4Å; I1479-F1512 HydrophobicContact CD1-CE2 4.02Å; I1479-F1512 HydrophobicContact CD1-CZ 4.18Å; I1479-F1512 HydrophobicContact CG1-CE2 4.09Å; I1479-F1512 HydrophobicContact CG1-CZ 4.09Å
1480	S	92.4	Very high	96.2	Very high	65 Å²	65	18.8 Å²	18.8	46%	0.455	10%	0.1	S	C	.	.	G	3₁₀ helix	trans	-75.5	-4.5	175.1	54	0	0	0	0	115.1	S1428 M1478	S1428-S1480 PolarHBondContact O-OG 2.94Å; M1478-S1480 PolarHBondContact O-N 2.87Å; M1478-S1480 VanDerWaalsContact O-N 3.15Å
1481	T	95.9	Very high	96.3	Very high	3 Å²	3	20.1 Å²	20.1	2%	0.018	11%	0.105	C	C	.	.	G	3₁₀ helix	trans	-133.6	13.2	-176	78.1	0	0	0	0	113.6	K1429 M1478 I1479 F1485	K1429-T1481 HydrophobicContact CB-CG2 4.01Å; K1429-T1481 HydrophobicContact CG-CG2 4.32Å; M1478-T1481 HydrophobicContact CB-CG2 4.37Å; M1478-T1481 PolarHBondContact N-OG1 3.46Å; M1478-T1481 CarbonylContact O-C 2.65Å; M1478-T1481 PolarHBondContact O-N 3.13Å; M1478-T1481 PolarHBondContact O-OG1 3.2Å; I1479-T1481 VanDerWaalsContact C-N 3.27Å; I1479-T1481 PolarHBondContact O-N 2.83Å; T1481-F1485 VanDerWaalsContact O-CB 3.3Å; T1481-F1485 WeakPolarHBondContact O-CB 3.47Å; T1481-F1485 PolarHBondContact O-N 3.09Å
1482	V	96.2	Very high	96.3	Very high	6 Å²	6	21.8 Å²	21.8	4%	0.036	11%	0.112	C	C	.	.	H	α-helix	trans	-65.1	-44.4	177.6	174.5	0	0	0	0	111.1	M1478 F1485 W1486 F1512 Y1523	M1478-V1482 WeakPolarHBondContact O-CG2 3.43Å; M1478-V1482 PolarHBondContact O-N 2.86Å; M1478-V1482 VanDerWaalsContact O-N 3.14Å; V1482-F1485 PolarHBondContact O-N 3.11Å; V1482-W1486 PolarHBondContact O-N 3.39Å; V1482-F1512 HydrophobicContact CG2-CD1 3.6Å; V1482-F1512 HydrophobicContact CG2-CE1 4.03Å; V1482-F1512 HydrophobicContact CG2-CG 4.5Å; V1482-Y1523 HydrophobicContact CG1-CD1 3.58Å; V1482-Y1523 HydrophobicContact CG1-CD2 3.93Å; V1482-Y1523 HydrophobicContact CG1-CE1 3.58Å; V1482-Y1523 HydrophobicContact CG1-CE2 3.94Å; V1482-Y1523 HydrophobicContact CG1-CG 3.76Å
1483	E	95	Very high	96.1	Very high	90 Å²	90	27 Å²	27	42%	0.421	14%	0.136	S	C	.	.	H	α-helix	trans	-66.8	-44	180	-53.5	-163.1	132.7	0	0	111.5	F1485 W1486 R1487 Q1524	E1483-F1485 VanDerWaalsContact C-N 3.27Å; E1483-F1485 PolarHBondContact O-N 2.95Å; E1483-W1486 PolarHBondContact O-N 2.84Å; E1483-R1487 VanDerWaalsContact O-CB 3.3Å; E1483-R1487 WeakPolarHBondContact O-CB 3.4Å; E1483-R1487 PolarHBondContact O-N 2.84Å; E1483-Q1524 HydrophobicContact CB-CB 4.15Å; E1483-Q1524 HydrophobicContact CG-CB 4.31Å; E1483-Q1524 WeakPolarHBondContact OE1-CA 3.21Å; E1483-Q1524 PolarHBondContact OE1-N 2.85Å
1484	D	96.5	Very high	95.9	Very high	15 Å²	15	27 Å²	27	8%	0.08	14%	0.136	C	C	.	.	H	α-helix	trans	-60.9	-35	173.2	-72.9	-11.7	0	0	0	112.1	K1429 L1445 I1457 R1487 M1488	K1429-D1484 VanDerWaalsContact CE-OD2 3.31Å; K1429-D1484 WeakPolarHBondContact CE-OD2 3.47Å; K1429-D1484 IonicContact NZ-OD2 3.26Å; K1429-D1484 PolarHBondContact NZ-OD2 2.53Å; L1445-D1484 HydrophobicContact CD1-CB 3.91Å; L1445-D1484 WeakPolarHBondContact CD1-O 3.39Å; I1457-D1484 HydrophobicContact CD1-CB 4.17Å; D1484-R1487 IonicContact OD1-CZ 2.67Å; D1484-R1487 IonicContact OD1-NH1 2.8Å; D1484-R1487 PolarHBondContact OD1-NH1 3.39Å; D1484-R1487 IonicContact OD1-NH2 2.68Å; D1484-R1487 PolarHBondContact OD1-NH2 2.8Å; D1484-M1488 WeakPolarHBondContact O-CB 3.37Å; D1484-M1488 PolarHBondContact O-N 2.83Å
1485	F	97.8	Very high	95.8	Very high	1 Å²	1	28.1 Å²	28.1	0%	0.004	14%	0.144	C	C	.	.	H	α-helix	trans	-69.2	-46.1	177.2	177.4	-92.9	0	0	0	112.4	I1457 P1477 T1481 V1482 E1483 R1487 M1488 V1489 I1497 Y1514 T1598	I1457-F1485 HydrophobicContact CD1-CB 4.25Å; P1477-F1485 HydrophobicContact CB-CB 4.39Å; P1477-F1485 HydrophobicContact CB-CG 4.42Å; P1477-F1485 HydrophobicContact CG-CB 3.97Å; P1477-F1485 HydrophobicContact CG-CD1 4Å; P1477-F1485 HydrophobicContact CG-CD2 3.48Å; P1477-F1485 VanDerWaalsContact CG-CD2 3.48Å; P1477-F1485 HydrophobicContact CG-CE1 4.4Å; P1477-F1485 HydrophobicContact CG-CE2 3.9Å; P1477-F1485 HydrophobicContact CG-CG 3.53Å; P1477-F1485 HydrophobicContact CG-CZ 4.35Å; T1481-F1485 VanDerWaalsContact O-CB 3.3Å; T1481-F1485 WeakPolarHBondContact O-CB 3.47Å; T1481-F1485 PolarHBondContact O-N 3.09Å; V1482-F1485 PolarHBondContact O-N 3.11Å; E1483-F1485 VanDerWaalsContact C-N 3.27Å; E1483-F1485 PolarHBondContact O-N 2.95Å; F1485-R1487 VanDerWaalsContact C-N 3.33Å; F1485-M1488 HydrophobicContact CD2-CE 3.97Å; F1485-M1488 HydrophobicContact CE2-CE 4.01Å; F1485-M1488 WeakPolarHBondContact O-CB 3.32Å; F1485-M1488 PolarHBondContact O-N 3.34Å; F1485-V1489 HydrophobicContact CD1-CG2 4.29Å; F1485-V1489 HydrophobicContact CE1-CG2 3.85Å; F1485-V1489 HydrophobicContact CZ-CG2 4Å; F1485-V1489 WeakPolarHBondContact O-CG2 3.28Å; F1485-V1489 PolarHBondContact O-N 2.98Å; F1485-I1497 HydrophobicContact CE1-CD1 4.06Å; F1485-I1497 HydrophobicContact CZ-CD1 4.05Å; F1485-I1497 HydrophobicContact CZ-CG2 4.19Å; F1485-Y1514 AromaticContact CD1-CD2 3.92Å; F1485-Y1514 HydrophobicContact CD1-CD2 3.92Å; F1485-Y1514 HydrophobicContact CD1-CE2 4.12Å; F1485-Y1514 HydrophobicContact CD1-CG 4.4Å; F1485-Y1514 AromaticContact CE1-CD2 3.67Å; F1485-Y1514 HydrophobicContact CE1-CD2 3.67Å; F1485-Y1514 AromaticContact CE1-CE2 3.38Å; F1485-Y1514 HydrophobicContact CE1-CE2 3.38Å; F1485-Y1514 HydrophobicContact CE1-CG 4.4Å; F1485-Y1514 AromaticContact CE1-CZ 3.89Å; F1485-Y1514 HydrophobicContact CZ-CE2 4.02Å; F1485-T1598 HydrophobicContact CE2-CG2 3.75Å; F1485-T1598 HydrophobicContact CZ-CG2 4.06Å
1486	W	97.4	Very high	95.8	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-68.2	-34.4	175.5	-74	112.4	0	0	0	112.3	V1482 E1483 M1488 V1489 W1490 I1497 Y1514 W1515 Y1523 F1526 I1528 F1544 L1546 I1557	V1482-W1486 PolarHBondContact O-N 3.39Å; E1483-W1486 PolarHBondContact O-N 2.84Å; W1486-M1488 VanDerWaalsContact C-N 3.35Å; W1486-V1489 HydrophobicContact CE3-CB 4.29Å; W1486-V1489 HydrophobicContact CE3-CG1 4.13Å; W1486-V1489 HydrophobicContact CZ3-CG1 4.26Å; W1486-V1489 PolarHBondContact O-N 2.67Å; W1486-W1490 PolarHBondContact O-N 2.78Å; W1486-I1497 HydrophobicContact CZ3-CD1 4.41Å; W1486-Y1514 AromaticContact CE2-CD2 3.94Å; W1486-Y1514 AromaticContact CZ2-CD2 3.72Å; W1486-Y1514 HydrophobicContact CZ2-CD2 3.72Å; W1486-Y1514 HydrophobicContact CZ2-CE2 4.03Å; W1486-Y1514 AromaticContact NE1-CD2 3.96Å; W1486-Y1514 PolarHBondContact NE1-O 2.79Å; W1486-W1515 HydrophobicContact CZ2-CB 4.46Å; W1486-Y1523 AromaticContact CD1-CD2 3.35Å; W1486-Y1523 AromaticContact CD1-CE2 3.98Å; W1486-Y1523 AromaticContact CD1-CG 4Å; W1486-Y1523 HydrophobicContact CG-CD2 4.31Å; W1486-Y1523 AromaticContact NE1-CD2 3.45Å; W1486-Y1523 AromaticContact NE1-CE2 3.61Å; W1486-F1526 HydrophobicContact CB-CD2 4.35Å; W1486-I1528 HydrophobicContact CD2-CD1 4.16Å; W1486-I1528 HydrophobicContact CD2-CG1 3.77Å; W1486-I1528 HydrophobicContact CE3-CG1 4.14Å; W1486-I1528 HydrophobicContact CG-CD1 4.12Å; W1486-I1528 HydrophobicContact CG-CG1 4.24Å; W1486-I1528 HydrophobicContact CH2-CG1 4.2Å; W1486-I1528 HydrophobicContact CH2-CG2 4.06Å; W1486-I1528 HydrophobicContact CZ2-CG1 3.85Å; W1486-I1528 HydrophobicContact CZ2-CG2 3.98Å; W1486-I1528 HydrophobicContact CZ3-CG1 4.33Å; W1486-F1544 HydrophobicContact CH2-CD2 4.24Å; W1486-F1544 HydrophobicContact CH2-CG 4.44Å; W1486-L1546 HydrophobicContact CD2-CD1 4.41Å; W1486-L1546 HydrophobicContact CE3-CD1 3.83Å; W1486-L1546 HydrophobicContact CE3-CD2 3.96Å; W1486-L1546 HydrophobicContact CZ3-CD1 4.33Å; W1486-L1546 HydrophobicContact CZ3-CD2 4.29Å; W1486-I1557 HydrophobicContact CZ3-CG2 4.31Å
1487	R	95.8	Very high	95.9	Very high	6 Å²	6	28 Å²	28	2%	0.023	14%	0.143	C	C	.	.	H	α-helix	trans	-62.1	-41.1	170.4	-169.6	161	77.9	-91.9	-6.6	111.8	S1454 E1483 D1484 F1485 W1490 E1491 Q1524 F1526	S1454-R1487 PolarHBondContact O-NH2 3.43Å; E1483-R1487 VanDerWaalsContact O-CB 3.3Å; E1483-R1487 WeakPolarHBondContact O-CB 3.4Å; E1483-R1487 PolarHBondContact O-N 2.84Å; D1484-R1487 IonicContact OD1-CZ 2.67Å; D1484-R1487 IonicContact OD1-NH1 2.8Å; D1484-R1487 PolarHBondContact OD1-NH1 3.39Å; D1484-R1487 IonicContact OD1-NH2 2.68Å; D1484-R1487 PolarHBondContact OD1-NH2 2.8Å; F1485-R1487 VanDerWaalsContact C-N 3.33Å; R1487-W1490 PolarHBondContact O-N 2.8Å; R1487-E1491 WeakPolarHBondContact CD-OE1 3.27Å; R1487-E1491 HydrophobicContact CG-CG 4.12Å; R1487-E1491 WeakPolarHBondContact CG-OE1 3.33Å; R1487-E1491 IonicContact NE-OE1 3.19Å; R1487-E1491 VanDerWaalsContact O-CB 3.31Å; R1487-E1491 WeakPolarHBondContact O-CB 3.37Å; R1487-E1491 VanDerWaalsContact O-CG 3.31Å; R1487-E1491 WeakPolarHBondContact O-CG 3.33Å; R1487-E1491 PolarHBondContact O-N 2.87Å; R1487-Q1524 VanDerWaalsContact NH1-OE1 3.17Å; R1487-F1526 HydrophobicContact CB-CE2 3.84Å; R1487-F1526 HydrophobicContact CB-CZ 4.48Å; R1487-F1526 HydrophobicContact CG-CE2 4.16Å; R1487-F1526 HydrophobicContact CG-CZ 4.44Å
1488	M	97.6	Very high	95.9	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-60.2	-48.5	172.6	-169.8	-171.2	72.8	0	0	112.3	V1443 L1445 I1457 A1459 I1472 D1484 F1485 W1486 W1490 K1492 T1598	V1443-M1488 HydrophobicContact CB-CG 4.49Å; V1443-M1488 HydrophobicContact CB-SD 4.31Å; V1443-M1488 HydrophobicContact CG1-CG 3.74Å; V1443-M1488 HydrophobicContact CG1-SD 4.17Å; V1443-M1488 HydrophobicContact CG2-SD 4.43Å; L1445-M1488 HydrophobicContact CD2-CB 3.72Å; L1445-M1488 HydrophobicContact CD2-CG 4.04Å; I1457-M1488 HydrophobicContact CD1-CB 4.19Å; I1457-M1488 HydrophobicContact CD1-SD 3.92Å; I1457-M1488 HydrophobicContact CG2-CG 4.4Å; I1457-M1488 HydrophobicContact CG2-SD 4.03Å; A1459-M1488 HydrophobicContact CB-SD 3.57Å; A1459-M1488 VanDerWaalsContact CB-SD 3.57Å; I1472-M1488 HydrophobicContact CG2-CE 3.78Å; I1472-M1488 HydrophobicContact CG2-SD 3.83Å; D1484-M1488 WeakPolarHBondContact O-CB 3.37Å; D1484-M1488 PolarHBondContact O-N 2.83Å; F1485-M1488 HydrophobicContact CD2-CE 3.97Å; F1485-M1488 HydrophobicContact CE2-CE 4.01Å; F1485-M1488 WeakPolarHBondContact O-CB 3.32Å; F1485-M1488 PolarHBondContact O-N 3.34Å; W1486-M1488 VanDerWaalsContact C-N 3.35Å; M1488-W1490 VanDerWaalsContact C-N 3.3Å; M1488-W1490 PolarHBondContact O-N 3.21Å; M1488-K1492 HydrophobicContact CG-CG 4.4Å; M1488-K1492 WeakPolarHBondContact O-CB 3.21Å; M1488-K1492 WeakPolarHBondContact O-CG 3.15Å; M1488-K1492 PolarHBondContact O-N 2.91Å; M1488-T1598 HydrophobicContact CE-CG2 3.69Å
1489	V	97.1	Very high	96	Very high	1 Å²	1	26.1 Å²	26.1	1%	0.006	13%	0.134	C	C	.	.	H	α-helix	trans	-58.3	-42.9	178.9	165.2	0	0	0	0	111.1	F1485 W1486 H1493 S1494 I1497 L1546 I1557	F1485-V1489 HydrophobicContact CD1-CG2 4.29Å; F1485-V1489 HydrophobicContact CE1-CG2 3.85Å; F1485-V1489 HydrophobicContact CZ-CG2 4Å; F1485-V1489 WeakPolarHBondContact O-CG2 3.28Å; F1485-V1489 PolarHBondContact O-N 2.98Å; W1486-V1489 HydrophobicContact CE3-CB 4.29Å; W1486-V1489 HydrophobicContact CE3-CG1 4.13Å; W1486-V1489 HydrophobicContact CZ3-CG1 4.26Å; W1486-V1489 PolarHBondContact O-N 2.67Å; V1489-H1493 PolarHBondContact O-N 2.88Å; V1489-S1494 PolarHBondContact O-N 2.79Å; V1489-I1497 HydrophobicContact CG2-CD1 3.96Å; V1489-I1497 HydrophobicContact CG2-CG1 4.43Å; V1489-L1546 HydrophobicContact CG1-CD2 3.92Å; V1489-I1557 HydrophobicContact CG1-CD1 3.95Å; V1489-I1557 HydrophobicContact CG1-CG1 4.16Å; V1489-I1557 HydrophobicContact CG1-CG2 4.07Å
1490	W	95.7	Very high	96	Very high	14 Å²	14	19.9 Å²	19.9	5%	0.053	10%	0.102	C	C	.	.	H	α-helix	trans	-68.9	-57.8	177.4	-171.8	-101.3	0	0	0	113	W1486 R1487 M1488 K1492 H1493 F1526 L1546 D1548 E1553 R1555	W1486-W1490 PolarHBondContact O-N 2.78Å; R1487-W1490 PolarHBondContact O-N 2.8Å; M1488-W1490 VanDerWaalsContact C-N 3.3Å; M1488-W1490 PolarHBondContact O-N 3.21Å; W1490-K1492 PolarHBondContact O-N 2.8Å; W1490-H1493 PolarHBondContact O-N 2.85Å; W1490-H1493 VanDerWaalsContact O-N 3.12Å; W1490-F1526 HydrophobicContact CB-CD1 4.41Å; W1490-F1526 HydrophobicContact CB-CE1 3.68Å; W1490-F1526 HydrophobicContact CB-CZ 3.85Å; W1490-F1526 AromaticContact CD1-CE1 3.6Å; W1490-F1526 AromaticContact CD1-CZ 3.93Å; W1490-F1526 HydrophobicContact CD2-CD1 4.27Å; W1490-F1526 AromaticContact CD2-CE1 3.72Å; W1490-F1526 HydrophobicContact CD2-CE1 3.72Å; W1490-F1526 HydrophobicContact CE3-CD1 4.47Å; W1490-F1526 HydrophobicContact CE3-CE1 4.36Å; W1490-F1526 HydrophobicContact CG-CD1 4.26Å; W1490-F1526 AromaticContact CG-CE1 3.38Å; W1490-F1526 HydrophobicContact CG-CE1 3.38Å; W1490-F1526 AromaticContact CG-CZ 3.89Å; W1490-F1526 HydrophobicContact CG-CZ 3.89Å; W1490-F1526 AromaticContact NE1-CE1 4Å; W1490-L1546 HydrophobicContact CB-CD2 4.48Å; W1490-L1546 HydrophobicContact CE3-CD2 3.68Å; W1490-L1546 HydrophobicContact CE3-CG 3.82Å; W1490-L1546 HydrophobicContact CZ3-CD2 4.36Å; W1490-L1546 HydrophobicContact CZ3-CG 4.1Å; W1490-L1546 WeakPolarHBondContact CZ3-O 3.39Å; W1490-D1548 HydrophobicContact CH2-CB 3.93Å; W1490-D1548 HydrophobicContact CZ2-CB 3.53Å; W1490-D1548 PolarHBondContact NE1-OD2 2.92Å; W1490-E1553 HydrophobicContact CH2-CB 3.59Å; W1490-E1553 HydrophobicContact CZ2-CB 3.71Å; W1490-R1555 HydrophobicContact CE3-CG 4.29Å; W1490-R1555 HydrophobicContact CH2-CG 3.87Å; W1490-R1555 HydrophobicContact CZ3-CB 3.94Å; W1490-R1555 VanDerWaalsContact CZ3-CD 3.45Å; W1490-R1555 HydrophobicContact CZ3-CG 3.54Å; W1490-R1555 PolarHBondContact O-NH1 2.81Å; W1490-R1555 VanDerWaalsContact O-NH1 3.07Å
1491	E	95.5	Very high	96	Very high	38 Å²	38	16.9 Å²	16.9	18%	0.178	8%	0.081	C	C	.	.	H	α-helix	trans	-65.5	-25.2	-173.7	-72.4	179.8	-170.1	0	0	113.6	L1445 C1446 R1487	L1445-E1491 VanDerWaalsContact CA-OE2 3.26Å; L1445-E1491 WeakPolarHBondContact CA-OE2 3.27Å; C1446-E1491 VanDerWaalsContact CB-OE1 3.29Å; C1446-E1491 WeakPolarHBondContact CB-OE1 3.06Å; C1446-E1491 PolarHBondContact N-OE1 3.42Å; C1446-E1491 PolarHBondContact N-OE2 2.98Å; R1487-E1491 WeakPolarHBondContact CD-OE1 3.27Å; R1487-E1491 HydrophobicContact CG-CG 4.12Å; R1487-E1491 WeakPolarHBondContact CG-OE1 3.33Å; R1487-E1491 IonicContact NE-OE1 3.19Å; R1487-E1491 VanDerWaalsContact O-CB 3.31Å; R1487-E1491 WeakPolarHBondContact O-CB 3.37Å; R1487-E1491 VanDerWaalsContact O-CG 3.31Å; R1487-E1491 WeakPolarHBondContact O-CG 3.33Å; R1487-E1491 PolarHBondContact O-N 2.87Å
1492	K	96	Very high	95.7	Very high	42 Å²	42	19.2 Å²	19.2	18%	0.183	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104	13	178.4	-48.8	-51.1	175.2	-122.2	0	112.8	V1443 T1444 F1461 I1472 M1488 W1490 S1494 P1596	V1443-K1492 HydrophobicContact CG1-CD 4.13Å; V1443-K1492 HydrophobicContact CG1-CG 3.69Å; T1444-K1492 WeakPolarHBondContact O-CE 3.47Å; T1444-K1492 PolarHBondContact O-NZ 2.91Å; F1461-K1492 HydrophobicContact CZ-CD 4.14Å; F1461-K1492 HydrophobicContact CZ-CG 4.27Å; I1472-K1492 HydrophobicContact CD1-CB 3.94Å; I1472-K1492 HydrophobicContact CD1-CG 4.28Å; M1488-K1492 HydrophobicContact CG-CG 4.4Å; M1488-K1492 WeakPolarHBondContact O-CB 3.21Å; M1488-K1492 WeakPolarHBondContact O-CG 3.15Å; M1488-K1492 PolarHBondContact O-N 2.91Å; W1490-K1492 PolarHBondContact O-N 2.8Å; K1492-S1494 PolarHBondContact O-N 2.96Å; K1492-S1494 VanDerWaalsContact O-N 3.11Å; K1492-P1596 VanDerWaalsContact O-CD 3.24Å; K1492-P1596 WeakPolarHBondContact O-CD 3.3Å
1493	H	94.1	Very high	95.5	Very high	109 Å²	109	20.8 Å²	20.8	51%	0.505	11%	0.107	S	C	.	.	T	Hydrogen-bonded Turn	trans	54	31.2	175.5	-61	-108.9	0	0	0	113.9	V1489 W1490 C1495	V1489-H1493 PolarHBondContact O-N 2.88Å; W1490-H1493 PolarHBondContact O-N 2.85Å; W1490-H1493 VanDerWaalsContact O-N 3.12Å; H1493-C1495 PolarHBondContact O-N 2.65Å
1494	S	95.4	Very high	95.2	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.116	C	C	.	.			trans	-82	76.9	-172.5	172.3	0	0	0	0	111.5	V1489 K1492 L1496 P1596 T1598	V1489-S1494 PolarHBondContact O-N 2.79Å; K1492-S1494 PolarHBondContact O-N 2.96Å; K1492-S1494 VanDerWaalsContact O-N 3.11Å; S1494-L1496 PolarHBondContact O-N 2.69Å; S1494-L1496 VanDerWaalsContact O-N 3.12Å; S1494-L1496 PolarHBondContact OG-O 2.79Å; S1494-P1596 WeakPolarHBondContact CA-O 3.44Å; S1494-P1596 WeakPolarHBondContact CB-O 3.29Å; S1494-P1596 PolarHBondContact OG-O 3.09Å; S1494-T1598 WeakPolarHBondContact CB-OG1 3.31Å; S1494-T1598 WeakPolarHBondContact OG-CB 3.1Å; S1494-T1598 PolarHBondContact OG-N 3.22Å; S1494-T1598 PolarHBondContact OG-OG1 3.41Å
1495	C	94.6	Very high	94.7	Very high	26 Å²	26	22.8 Å²	22.8	18%	0.176	11%	0.114	C	C	.	.			trans	-66.6	-10.4	-178.2	-62.4	0	0	0	0	115.1	H1493 I1557 R1558 Y1593	H1493-C1495 PolarHBondContact O-N 2.65Å; C1495-I1557 WeakPolarHBondContact O-CA 3.15Å; C1495-R1558 PolarHBondContact O-N 3.45Å; C1495-Y1593 HydrophobicContact CB-CD1 3.64Å; C1495-Y1593 HydrophobicContact CB-CD2 4.21Å; C1495-Y1593 HydrophobicContact CB-CE1 3.42Å; C1495-Y1593 VanDerWaalsContact CB-CE1 3.42Å; C1495-Y1593 HydrophobicContact CB-CE2 4.03Å; C1495-Y1593 HydrophobicContact CB-CG 4.01Å
1496	L	96.9	Very high	94	Very high	2 Å²	2	26.2 Å²	26.2	1%	0.01	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	127.2	-178.7	-165.7	60.4	0	0	0	111.5	S1494 R1558 L1560 V1584 I1587 Y1593 I1597 T1598	S1494-L1496 PolarHBondContact O-N 2.69Å; S1494-L1496 VanDerWaalsContact O-N 3.12Å; S1494-L1496 PolarHBondContact OG-O 2.79Å; L1496-R1558 CarbonylContact C-O 3.56Å; L1496-R1558 WeakPolarHBondContact CA-O 3.37Å; L1496-R1558 HydrophobicContact CD1-CB 3.74Å; L1496-L1560 HydrophobicContact CD1-CD1 3.51Å; L1496-V1584 HydrophobicContact CD2-CG1 4.01Å; L1496-I1587 HydrophobicContact CD1-CG2 3.67Å; L1496-I1587 HydrophobicContact CD2-CB 4.44Å; L1496-I1587 HydrophobicContact CD2-CG2 4.09Å; L1496-Y1593 HydrophobicContact CB-CD2 4.21Å; L1496-Y1593 HydrophobicContact CB-CE2 4.37Å; L1496-I1597 HydrophobicContact CB-CG1 4.33Å; L1496-I1597 HydrophobicContact CB-CG2 4.27Å; L1496-I1597 HydrophobicContact CD2-CD1 4.09Å; L1496-I1597 HydrophobicContact CD2-CG1 4.11Å; L1496-I1597 HydrophobicContact CD2-CG2 4.23Å; L1496-I1597 HydrophobicContact CG-CG2 4.14Å; L1496-T1598 PolarHBondContact O-N 3.18Å
1497	I	97.6	Very high	93.2	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	133.8	179.7	-55	169.9	0	0	0	109.1	F1485 W1486 V1489 I1557 R1558 Q1559 L1560 T1598	F1485-I1497 HydrophobicContact CE1-CD1 4.06Å; F1485-I1497 HydrophobicContact CZ-CD1 4.05Å; F1485-I1497 HydrophobicContact CZ-CG2 4.19Å; W1486-I1497 HydrophobicContact CZ3-CD1 4.41Å; V1489-I1497 HydrophobicContact CG2-CD1 3.96Å; V1489-I1497 HydrophobicContact CG2-CG1 4.43Å; I1497-I1557 HydrophobicContact CD1-CG2 3.61Å; I1497-I1557 HydrophobicContact CG1-CG2 4.04Å; I1497-R1558 PolarHBondContact N-O 2.83Å; I1497-Q1559 HydrophobicContact CB-CB 4.37Å; I1497-Q1559 HydrophobicContact CB-CG 4.38Å; I1497-Q1559 HydrophobicContact CG2-CG 4.32Å; I1497-Q1559 CarbonylContact O-C 3.55Å; I1497-Q1559 VanDerWaalsContact O-CA 3.3Å; I1497-Q1559 WeakPolarHBondContact O-CA 3.35Å; I1497-L1560 PolarHBondContact O-N 3.19Å; I1497-T1598 CarbonylContact C-O 3.58Å; I1497-T1598 VanDerWaalsContact CA-O 3.25Å; I1497-T1598 WeakPolarHBondContact CA-O 3.27Å; I1497-T1598 HydrophobicContact CG2-CG2 4.44Å
1498	V	97.4	Very high	92.8	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	118.6	174.2	-173.5	0	0	0	0	109.4	L1500 L1560 L1580 V1584 I1597 T1598 I1599 H1600 F1611	V1498-L1500 HydrophobicContact CG1-CD2 3.74Å; V1498-L1500 HydrophobicContact CG1-CG 4.12Å; V1498-L1560 WeakPolarHBondContact CA-O 3.46Å; V1498-L1580 HydrophobicContact CG1-CD2 4.3Å; V1498-V1584 HydrophobicContact CG2-CG1 4.37Å; V1498-V1584 HydrophobicContact CG2-CG2 3.72Å; V1498-I1597 HydrophobicContact CG2-CG2 3.82Å; V1498-T1598 PolarHBondContact N-O 2.96Å; V1498-I1599 HydrophobicContact CB-CG1 4.12Å; V1498-I1599 HydrophobicContact CB-CG2 4.34Å; V1498-I1599 HydrophobicContact CG2-CG1 4.31Å; V1498-I1599 WeakPolarHBondContact O-CA 3.28Å; V1498-H1600 PolarHBondContact O-N 2.96Å; V1498-F1611 HydrophobicContact CG1-CE2 4.16Å; V1498-F1611 HydrophobicContact CG1-CZ 4.21Å; V1498-F1611 HydrophobicContact CG2-CZ 4.46Å
1499	M	97	Very high	92.5	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	109.9	-179.4	175.3	166.3	-177.9	0	0	110	C1501 V1503 C1511 Y1514 W1515 L1560 Q1561 Y1562 H1600	M1499-C1501 VanDerWaalsContact CE-O 3.28Å; M1499-C1501 WeakPolarHBondContact CE-O 3.33Å; M1499-C1501 PolarHBondContact O-N 3.03Å; M1499-V1503 HydrophobicContact CE-CG2 4.45Å; M1499-C1511 HydrophobicContact CE-CB 3.8Å; M1499-Y1514 HydrophobicContact SD-CE1 4.31Å; M1499-W1515 HydrophobicContact CE-CH2 3.79Å; M1499-W1515 HydrophobicContact CE-CZ3 3.98Å; M1499-W1515 HydrophobicContact SD-CH2 3.7Å; M1499-W1515 HydrophobicContact SD-CZ3 3.58Å; M1499-W1515 VanDerWaalsContact SD-CZ3 3.58Å; M1499-L1560 PolarHBondContact N-O 3.22Å; M1499-Q1561 HydrophobicContact CB-CB 4.24Å; M1499-Q1561 HydrophobicContact CB-CG 4.3Å; M1499-Q1561 HydrophobicContact CG-CB 4.49Å; M1499-Q1561 HydrophobicContact CG-CG 4.04Å; M1499-Q1561 WeakPolarHBondContact O-CA 3.5Å; M1499-Q1561 HydrophobicContact SD-CG 4.24Å; M1499-Y1562 PolarHBondContact O-N 3.39Å; M1499-H1600 WeakPolarHBondContact CG-CE1 3.39Å
1500	L	94.6	Very high	92.2	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.234	C	C	.	.			trans	-99.8	32.8	-174.2	-56.2	169.9	0	0	0	112.3	V1498 L1580 I1599 H1600 C1601 R1607 F1611	V1498-L1500 HydrophobicContact CG1-CD2 3.74Å; V1498-L1500 HydrophobicContact CG1-CG 4.12Å; L1500-L1580 HydrophobicContact CD2-CD2 4Å; L1500-I1599 HydrophobicContact CD1-CG2 3.64Å; L1500-I1599 HydrophobicContact CG-CG2 4.37Å; L1500-H1600 WeakPolarHBondContact CB-O 3.26Å; L1500-H1600 PolarHBondContact N-O 3.09Å; L1500-C1601 HydrophobicContact CB-CB 4.13Å; L1500-R1607 HydrophobicContact CB-CB 4.05Å; L1500-R1607 HydrophobicContact CD1-CB 4.33Å; L1500-R1607 WeakPolarHBondContact CD1-O 3.34Å; L1500-R1607 WeakPolarHBondContact O-CD 3.31Å; L1500-R1607 PolarHBondContact O-NH1 2.92Å; L1500-F1611 HydrophobicContact CD1-CB 3.52Å; L1500-F1611 HydrophobicContact CD1-CD2 4.28Å; L1500-F1611 HydrophobicContact CD1-CG 3.97Å; L1500-F1611 HydrophobicContact CD2-CD2 3.84Å; L1500-F1611 HydrophobicContact CD2-CE2 4.47Å; L1500-F1611 HydrophobicContact CD2-CG 4.37Å
1501	C	91.2	Very high	92.1	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.007	23%	0.232	C	C	.	.	S	Bend	trans	-154.9	160.6	177.2	60.5	0	0	0	0	112.4	M1499 E1505 K1510 Q1561 R1607	M1499-C1501 VanDerWaalsContact CE-O 3.28Å; M1499-C1501 WeakPolarHBondContact CE-O 3.33Å; M1499-C1501 PolarHBondContact O-N 3.03Å; C1501-E1505 VanDerWaalsContact CA-OE1 3.32Å; C1501-E1505 WeakPolarHBondContact CA-OE1 3.28Å; C1501-E1505 VanDerWaalsContact CB-OE1 3.26Å; C1501-E1505 WeakPolarHBondContact CB-OE1 3.41Å; C1501-K1510 HydrophobicContact CB-CB 4.25Å; C1501-Q1561 PolarHBondContact O-NE2 2.97Å; C1501-R1607 VanDerWaalsContact CB-NH1 3.32Å
1502	S	90.4	Very high	92	Very high	53 Å²	53	43.2 Å²	43.2	37%	0.371	23%	0.234	S	C	.	.			trans	-84.4	154.9	163	-73.7	0	0	0	0	110.2	K1504 E1505 K1510	S1502-K1504 WeakPolarHBondContact CB-O 3.18Å; S1502-K1504 PolarHBondContact O-N 3.46Å; S1502-E1505 PolarHBondContact N-OE1 2.82Å; S1502-K1510 WeakPolarHBondContact O-CB 3.45Å
1503	V	91.2	Very high	92	Very high	39 Å²	39	43.6 Å²	43.6	24%	0.236	24%	0.24	C	C	.	.	S	Bend	trans	-52.1	-43.5	179.3	176.6	0	0	0	0	111	M1499 E1509 K1510 C1511 T1513 W1515	M1499-V1503 HydrophobicContact CE-CG2 4.45Å; V1503-E1509 WeakPolarHBondContact O-CA 3.14Å; V1503-K1510 PolarHBondContact O-N 2.92Å; V1503-C1511 WeakPolarHBondContact CA-O 3.33Å; V1503-C1511 WeakPolarHBondContact CG1-O 3.12Å; V1503-C1511 PolarHBondContact O-N 2.99Å; V1503-C1511 VanDerWaalsContact O-O 3.14Å; V1503-T1513 HydrophobicContact CG1-CG2 3.91Å; V1503-T1513 HydrophobicContact CG2-CG2 3.76Å; V1503-W1515 HydrophobicContact CG2-CH2 3.91Å; V1503-W1515 HydrophobicContact CG2-CZ2 4.33Å
1504	K	89.3	Confident	92	Very high	141 Å²	141	38.4 Å²	38.4	61%	0.613	22%	0.216	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-126.4	143.3	170.9	-62.2	175.2	-175.8	173.6	0	109.1	S1502 K1508	S1502-K1504 WeakPolarHBondContact CB-O 3.18Å; S1502-K1504 PolarHBondContact O-N 3.46Å; K1504-K1508 VanDerWaalsContact CA-O 3.31Å; K1504-K1508 WeakPolarHBondContact CA-O 3.42Å
1505	E	86.9	Confident	92	Very high	5 Å²	5	39 Å²	39	2%	0.023	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	130.6	170.2	-55.5	165.8	-176.3	0	0	108.4	C1501 S1502 G1507 K1508 K1510 E1567 R1607	C1501-E1505 VanDerWaalsContact CA-OE1 3.32Å; C1501-E1505 WeakPolarHBondContact CA-OE1 3.28Å; C1501-E1505 VanDerWaalsContact CB-OE1 3.26Å; C1501-E1505 WeakPolarHBondContact CB-OE1 3.41Å; S1502-E1505 PolarHBondContact N-OE1 2.82Å; E1505-G1507 PolarHBondContact O-N 2.97Å; E1505-K1508 PolarHBondContact N-O 2.77Å; E1505-K1508 PolarHBondContact O-N 3.29Å; E1505-K1510 HydrophobicContact CB-CG 4.04Å; E1505-K1510 HydrophobicContact CG-CG 3.85Å; E1505-K1510 VanDerWaalsContact OE2-CE 3.26Å; E1505-K1510 WeakPolarHBondContact OE2-CE 3.32Å; E1505-K1510 IonicContact OE2-NZ 3.89Å; E1505-E1567 VanDerWaalsContact CA-OE1 3.28Å; E1505-E1567 WeakPolarHBondContact CA-OE1 3.49Å; E1505-E1567 HydrophobicContact CB-CG 4.22Å; E1505-R1607 IonicContact OE1-CZ 3.29Å; E1505-R1607 IonicContact OE1-NH1 2.76Å; E1505-R1607 PolarHBondContact OE1-NH1 3.26Å; E1505-R1607 IonicContact OE1-NH2 3.54Å; E1505-R1607 PolarHBondContact OE1-NH2 3.19Å; E1505-R1607 IonicContact OE2-CZ 3.41Å; E1505-R1607 IonicContact OE2-NH1 3.23Å; E1505-R1607 PolarHBondContact OE2-NH1 3.22Å; E1505-R1607 IonicContact OE2-NH2 3.84Å; E1505-R1607 PolarHBondContact OE2-NH2 2.78Å
1506	S	82.5	Confident	91.9	Very high	74 Å²	74	38 Å²	38	52%	0.517	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.2	45.6	-173.4	-59	0	0	0	0	112	K1508 E1567	S1506-K1508 PolarHBondContact O-N 3.32Å; S1506-K1508 VanDerWaalsContact O-N 3.12Å; S1506-E1567 WeakPolarHBondContact CA-OE2 3.5Å; S1506-E1567 WeakPolarHBondContact CB-OE2 3.17Å; S1506-E1567 PolarHBondContact N-OE1 2.87Å; S1506-E1567 PolarHBondContact N-OE2 2.9Å; S1506-E1567 WeakPolarHBondContact OG-CB 3.49Å; S1506-E1567 PolarHBondContact OG-OE2 3.06Å
1507	G	81.5	Confident	91.5	Very high	74 Å²	74	44.1 Å²	44.1	76%	0.763	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.3	-10.7	-178.5	0	0	0	0	0	116	E1505	E1505-G1507 PolarHBondContact O-N 2.97Å
1508	K	86.8	Confident	90.8	Very high	146 Å²	146	51.7 Å²	51.7	64%	0.635	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.9	132.5	-177.4	-64	-178.6	-178.7	179.7	0	110.9	K1504 E1505 S1506 K1510	K1504-K1508 VanDerWaalsContact CA-O 3.31Å; K1504-K1508 WeakPolarHBondContact CA-O 3.42Å; E1505-K1508 PolarHBondContact N-O 2.77Å; E1505-K1508 PolarHBondContact O-N 3.29Å; S1506-K1508 PolarHBondContact O-N 3.32Å; S1506-K1508 VanDerWaalsContact O-N 3.12Å; K1508-K1510 PolarHBondContact O-N 3.36Å
1509	E	90.6	Very high	90.4	Very high	86 Å²	86	59.4 Å²	59.4	40%	0.402	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	126.5	171.1	-167.9	-154	99.8	0	0	110	R1431 V1503	R1431-E1509 IonicContact CZ-OE1 3.53Å; R1431-E1509 VanDerWaalsContact CZ-OE1 3.23Å; R1431-E1509 IonicContact NH1-OE1 2.63Å; R1431-E1509 PolarHBondContact NH1-OE1 2.78Å; R1431-E1509 IonicContact NH2-OE1 3.51Å; R1431-E1509 PolarHBondContact NH2-OE1 3.13Å; V1503-E1509 WeakPolarHBondContact O-CA 3.14Å
1510	K	91.4	Very high	90.3	Very high	56 Å²	56	63.1 Å²	63.1	24%	0.243	34%	0.338	C	S	.	.	S	Bend	trans	-101.9	-34.9	174.8	-58.4	-62.7	-172.4	163.6	0	111.9	R1431 C1501 S1502 V1503 E1505 K1508 S1602	R1431-K1510 VanDerWaalsContact CZ-O 3.28Å; R1431-K1510 PolarHBondContact NE-O 2.82Å; C1501-K1510 HydrophobicContact CB-CB 4.25Å; S1502-K1510 WeakPolarHBondContact O-CB 3.45Å; V1503-K1510 PolarHBondContact O-N 2.92Å; E1505-K1510 HydrophobicContact CB-CG 4.04Å; E1505-K1510 HydrophobicContact CG-CG 3.85Å; E1505-K1510 VanDerWaalsContact OE2-CE 3.26Å; E1505-K1510 WeakPolarHBondContact OE2-CE 3.32Å; E1505-K1510 IonicContact OE2-NZ 3.89Å; K1508-K1510 PolarHBondContact O-N 3.36Å; K1510-S1602 WeakPolarHBondContact CA-OG 3.14Å; K1510-S1602 WeakPolarHBondContact O-CA 3.49Å; K1510-S1602 PolarHBondContact O-OG 2.95Å
1511	C	93.6	Very high	90.2	Very high	0 Å²	0	65 Å²	65	0%	0	35%	0.351	C	S	.	.	S	Bend	trans	-151.3	140.8	-177.6	-178.7	0	0	0	0	108.3	M1499 V1503	M1499-C1511 HydrophobicContact CE-CB 3.8Å; V1503-C1511 WeakPolarHBondContact CA-O 3.33Å; V1503-C1511 WeakPolarHBondContact CG1-O 3.12Å; V1503-C1511 PolarHBondContact O-N 2.99Å; V1503-C1511 VanDerWaalsContact O-O 3.14Å
1512	F	94.2	Very high	90.3	Very high	53 Å²	53	72.5 Å²	72.5	23%	0.232	38%	0.38	C	S	.	.			trans	-74.5	154.5	170	-173.7	-97.3	0	0	0	110.7	P1477 I1479 V1482 Y1514	P1477-F1512 VanDerWaalsContact O-CB 3.25Å; P1477-F1512 WeakPolarHBondContact O-CB 2.94Å; P1477-F1512 PolarHBondContact O-N 3.04Å; I1479-F1512 HydrophobicContact CB-CD2 4.04Å; I1479-F1512 HydrophobicContact CB-CE2 4.02Å; I1479-F1512 HydrophobicContact CB-CG 4.43Å; I1479-F1512 HydrophobicContact CB-CZ 4.4Å; I1479-F1512 HydrophobicContact CD1-CE2 4.02Å; I1479-F1512 HydrophobicContact CD1-CZ 4.18Å; I1479-F1512 HydrophobicContact CG1-CE2 4.09Å; I1479-F1512 HydrophobicContact CG1-CZ 4.09Å; V1482-F1512 HydrophobicContact CG2-CD1 3.6Å; V1482-F1512 HydrophobicContact CG2-CE1 4.03Å; V1482-F1512 HydrophobicContact CG2-CG 4.5Å; F1512-Y1514 VanDerWaalsContact C-N 3.31Å; F1512-Y1514 WeakPolarHBondContact O-CD1 3.48Å; F1512-Y1514 PolarHBondContact O-N 2.83Å
1513	T	94.2	Very high	90.3	Very high	51 Å²	51	72 Å²	72	31%	0.313	37%	0.37	S	S	.	.			trans	-73.4	82.9	170.8	43.7	0	0	0	0	109.9	V1503 W1515	V1503-T1513 HydrophobicContact CG1-CG2 3.91Å; V1503-T1513 HydrophobicContact CG2-CG2 3.76Å; T1513-W1515 HydrophobicContact CG2-CZ2 4.36Å; T1513-W1515 PolarHBondContact O-N 2.82Å
1514	Y	95.2	Very high	90.2	Very high	0 Å²	0	72.2 Å²	72.2	0%	0	37%	0.368	C	S	.	.			trans	-79.3	3.2	-176.1	63.3	-97.2	0	0	0	114	P1477 F1485 W1486 M1499 F1512 Y1523 Q1559 H1600	P1477-Y1514 HydrophobicContact CB-CD1 3.98Å; P1477-Y1514 HydrophobicContact CB-CG 4.28Å; P1477-Y1514 HydrophobicContact CG-CD1 3.68Å; P1477-Y1514 HydrophobicContact CG-CE1 4.08Å; P1477-Y1514 HydrophobicContact CG-CG 4.11Å; F1485-Y1514 AromaticContact CD1-CD2 3.92Å; F1485-Y1514 HydrophobicContact CD1-CD2 3.92Å; F1485-Y1514 HydrophobicContact CD1-CE2 4.12Å; F1485-Y1514 HydrophobicContact CD1-CG 4.4Å; F1485-Y1514 AromaticContact CE1-CD2 3.67Å; F1485-Y1514 HydrophobicContact CE1-CD2 3.67Å; F1485-Y1514 AromaticContact CE1-CE2 3.38Å; F1485-Y1514 HydrophobicContact CE1-CE2 3.38Å; F1485-Y1514 HydrophobicContact CE1-CG 4.4Å; F1485-Y1514 AromaticContact CE1-CZ 3.89Å; F1485-Y1514 HydrophobicContact CZ-CE2 4.02Å; W1486-Y1514 AromaticContact CE2-CD2 3.94Å; W1486-Y1514 AromaticContact CZ2-CD2 3.72Å; W1486-Y1514 HydrophobicContact CZ2-CD2 3.72Å; W1486-Y1514 HydrophobicContact CZ2-CE2 4.03Å; W1486-Y1514 AromaticContact NE1-CD2 3.96Å; W1486-Y1514 PolarHBondContact NE1-O 2.79Å; M1499-Y1514 HydrophobicContact SD-CE1 4.31Å; F1512-Y1514 VanDerWaalsContact C-N 3.31Å; F1512-Y1514 WeakPolarHBondContact O-CD1 3.48Å; F1512-Y1514 PolarHBondContact O-N 2.83Å; Y1514-Y1523 WeakPolarHBondContact O-CE2 3.14Å; Y1514-Q1559 PolarHBondContact OH-NE2 2.86Å; Y1514-H1600 AromaticContact CE1-CE1 3.7Å; Y1514-H1600 AromaticContact CE1-NE2 3.46Å; Y1514-H1600 WeakPolarHBondContact CE1-NE2 3.28Å; Y1514-H1600 AromaticContact CZ-NE2 3.57Å; Y1514-H1600 PolarHBondContact OH-NE2 3.21Å
1515	W	95.1	Very high	90.3	Very high	12 Å²	12	69 Å²	69	5%	0.045	36%	0.355	C	S	.	.	S	Bend	trans	-121.8	154.2	-175.8	63.2	85.1	0	0	0	111.7	W1486 M1499 V1503 T1513 F1544	W1486-W1515 HydrophobicContact CZ2-CB 4.46Å; M1499-W1515 HydrophobicContact CE-CH2 3.79Å; M1499-W1515 HydrophobicContact CE-CZ3 3.98Å; M1499-W1515 HydrophobicContact SD-CH2 3.7Å; M1499-W1515 HydrophobicContact SD-CZ3 3.58Å; M1499-W1515 VanDerWaalsContact SD-CZ3 3.58Å; V1503-W1515 HydrophobicContact CG2-CH2 3.91Å; V1503-W1515 HydrophobicContact CG2-CZ2 4.33Å; T1513-W1515 HydrophobicContact CG2-CZ2 4.36Å; T1513-W1515 PolarHBondContact O-N 2.82Å; W1515-F1544 HydrophobicContact CB-CE1 3.66Å; W1515-F1544 HydrophobicContact CB-CE2 4.32Å; W1515-F1544 HydrophobicContact CB-CZ 3.44Å; W1515-F1544 VanDerWaalsContact CB-CZ 3.44Å; W1515-F1544 HydrophobicContact CG-CE1 4.25Å; W1515-F1544 AromaticContact CG-CZ 3.79Å; W1515-F1544 HydrophobicContact CG-CZ 3.79Å
1516	P	92	Very high	90.7	Very high	4 Å²	4	68.8 Å²	68.8	3%	0.026	35%	0.353	C	S	.	.			trans	-71.4	146.3	171.9	30.9	-36.8	0	0	0	112.1	K1519 I1528 L1530 F1544	P1516-K1519 WeakPolarHBondContact CB-O 3.23Å; P1516-I1528 HydrophobicContact CG-CB 4.25Å; P1516-I1528 HydrophobicContact CG-CG2 3.74Å; P1516-L1530 HydrophobicContact CG-CB 4.36Å; P1516-F1544 HydrophobicContact CG-CD1 4.33Å; P1516-F1544 HydrophobicContact CG-CE1 4.25Å
1517	E	88.1	Confident	91.3	Very high	131 Å²	131	67.2 Å²	67.2	61%	0.612	34%	0.341	S	S	*	.	S	Bend	trans	-102.8	-56.3	171.7	-60.8	-171.4	143.7	0	0	111.4	L1530	E1517-L1530 WeakPolarHBondContact O-CD2 3.35Å
1518	D	83.9	Confident	92	Very high	160 Å²	160	63.7 Å²	63.7	86%	0.856	31%	0.305	S	S	*	.	S	Bend	trans	-104.6	-23.3	-177.2	-65.8	-42.3	0	0	0	115.7
1519	K	89.9	Confident	92.4	Very high	161 Å²	161	59.7 Å²	59.7	70%	0.7	29%	0.29	S	S	*	.	S	Bend	trans	-144.4	143.3	-166.4	-68	-178.2	-177.9	174.6	0	112.5	P1516 S1521	P1516-K1519 WeakPolarHBondContact CB-O 3.23Å; K1519-S1521 PolarHBondContact O-N 3.09Å; K1519-S1521 PolarHBondContact O-OG 2.98Å
1520	P	92.9	Very high	92.7	Very high	79 Å²	79	57.8 Å²	57.8	51%	0.513	28%	0.282	S	S	.	.			trans	-50.6	127.4	173.7	-25.2	31.2	0	0	0	111.8	V1527 I1528 D1529	P1520-V1527 HydrophobicContact CB-CG1 4.07Å; P1520-I1528 CarbonylContact C-O 3.26Å; P1520-I1528 VanDerWaalsContact CA-O 3.26Å; P1520-I1528 WeakPolarHBondContact CA-O 3.43Å; P1520-D1529 HydrophobicContact CB-CB 4.33Å; P1520-D1529 HydrophobicContact CG-CB 4.26Å
1521	S	92.7	Very high	92.8	Very high	39 Å²	39	58.7 Å²	58.7	27%	0.273	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	132.8	-175.7	-67.9	0	0	0	0	110.2	K1519 I1528	K1519-S1521 PolarHBondContact O-N 3.09Å; K1519-S1521 PolarHBondContact O-OG 2.98Å; S1521-I1528 PolarHBondContact N-O 3.11Å; S1521-I1528 PolarHBondContact O-N 2.77Å
1522	R	93.2	Very high	92.8	Very high	158 Å²	158	59.6 Å²	59.6	60%	0.596	30%	0.3	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.3	125.4	179.3	-170.2	-179.5	-175.6	165.5	10	110.6	Q1524 F1526 V1527 T1549	R1522-Q1524 PolarHBondContact NE-O 3.33Å; R1522-F1526 CarbonylContact C-O 3.6Å; R1522-F1526 VanDerWaalsContact CA-O 3.27Å; R1522-F1526 WeakPolarHBondContact CA-O 3.46Å; R1522-V1527 HydrophobicContact CB-CG2 4.2Å; R1522-V1527 HydrophobicContact CG-CG2 4.08Å; R1522-T1549 PolarHBondContact NH2-OG1 2.63Å
1523	Y	91.6	Very high	92.9	Very high	42 Å²	42	61.9 Å²	61.9	17%	0.165	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	109.7	171.3	-61.4	-58	0	0	0	108	V1482 W1486 Y1514 F1525 F1526 I1528	V1482-Y1523 HydrophobicContact CG1-CD1 3.58Å; V1482-Y1523 HydrophobicContact CG1-CD2 3.93Å; V1482-Y1523 HydrophobicContact CG1-CE1 3.58Å; V1482-Y1523 HydrophobicContact CG1-CE2 3.94Å; V1482-Y1523 HydrophobicContact CG1-CG 3.76Å; W1486-Y1523 AromaticContact CD1-CD2 3.35Å; W1486-Y1523 AromaticContact CD1-CE2 3.98Å; W1486-Y1523 AromaticContact CD1-CG 4Å; W1486-Y1523 HydrophobicContact CG-CD2 4.31Å; W1486-Y1523 AromaticContact NE1-CD2 3.45Å; W1486-Y1523 AromaticContact NE1-CE2 3.61Å; Y1514-Y1523 WeakPolarHBondContact O-CE2 3.14Å; Y1523-F1525 PolarHBondContact O-N 2.81Å; Y1523-F1525 VanDerWaalsContact O-N 3.08Å; Y1523-F1526 PolarHBondContact N-O 3.31Å; Y1523-F1526 PolarHBondContact O-N 2.03Å; Y1523-I1528 HydrophobicContact CD2-CD1 3.65Å; Y1523-I1528 HydrophobicContact CD2-CG1 4.08Å; Y1523-I1528 HydrophobicContact CE2-CD1 4.45Å; Y1523-I1528 HydrophobicContact CE2-CG1 4.45Å
1524	Q	88.6	Confident	92.9	Very high	44 Å²	44	65.3 Å²	65.3	21%	0.206	32%	0.32	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.7	-111	-171.3	-159.7	-176.6	23.7	0	0	112.8	I1448 E1483 R1487 R1522	I1448-Q1524 VanDerWaalsContact CD1-NE2 3.25Å; E1483-Q1524 HydrophobicContact CB-CB 4.15Å; E1483-Q1524 HydrophobicContact CG-CB 4.31Å; E1483-Q1524 WeakPolarHBondContact OE1-CA 3.21Å; E1483-Q1524 PolarHBondContact OE1-N 2.85Å; R1487-Q1524 VanDerWaalsContact NH1-OE1 3.17Å; R1522-Q1524 PolarHBondContact NE-O 3.33Å
1525	F	90.9	Very high	92.7	Very high	74 Å²	74	70.2 Å²	70.2	33%	0.325	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-9	179.4	-57.8	-63.5	0	0	0	113.6	Y1523 T1549 R1550	Y1523-F1525 PolarHBondContact O-N 2.81Å; Y1523-F1525 VanDerWaalsContact O-N 3.08Å; F1525-T1549 WeakPolarHBondContact O-CB 3.11Å; F1525-T1549 WeakPolarHBondContact O-CG2 3.29Å; F1525-T1549 PolarHBondContact O-N 2.76Å; F1525-T1549 PolarHBondContact O-OG1 3.18Å; F1525-R1550 HydrophobicContact CB-CG 4.13Å; F1525-R1550 HydrophobicContact CD1-CG 3.87Å; F1525-R1550 HydrophobicContact CG-CG 4.07Å
1526	F	95.3	Very high	92.4	Very high	0 Å²	0	73.4 Å²	73.4	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	132.7	-171.4	-53.7	-72.7	0	0	0	111.6	W1486 R1487 W1490 R1522 Y1523 I1528 L1546 T1547 D1548	W1486-F1526 HydrophobicContact CB-CD2 4.35Å; R1487-F1526 HydrophobicContact CB-CE2 3.84Å; R1487-F1526 HydrophobicContact CB-CZ 4.48Å; R1487-F1526 HydrophobicContact CG-CE2 4.16Å; R1487-F1526 HydrophobicContact CG-CZ 4.44Å; W1490-F1526 HydrophobicContact CB-CD1 4.41Å; W1490-F1526 HydrophobicContact CB-CE1 3.68Å; W1490-F1526 HydrophobicContact CB-CZ 3.85Å; W1490-F1526 AromaticContact CD1-CE1 3.6Å; W1490-F1526 AromaticContact CD1-CZ 3.93Å; W1490-F1526 HydrophobicContact CD2-CD1 4.27Å; W1490-F1526 AromaticContact CD2-CE1 3.72Å; W1490-F1526 HydrophobicContact CD2-CE1 3.72Å; W1490-F1526 HydrophobicContact CE3-CD1 4.47Å; W1490-F1526 HydrophobicContact CE3-CE1 4.36Å; W1490-F1526 HydrophobicContact CG-CD1 4.26Å; W1490-F1526 AromaticContact CG-CE1 3.38Å; W1490-F1526 HydrophobicContact CG-CE1 3.38Å; W1490-F1526 AromaticContact CG-CZ 3.89Å; W1490-F1526 HydrophobicContact CG-CZ 3.89Å; W1490-F1526 AromaticContact NE1-CE1 4Å; R1522-F1526 CarbonylContact C-O 3.6Å; R1522-F1526 VanDerWaalsContact CA-O 3.27Å; R1522-F1526 WeakPolarHBondContact CA-O 3.46Å; Y1523-F1526 PolarHBondContact N-O 3.31Å; Y1523-F1526 PolarHBondContact O-N 2.03Å; F1526-I1528 HydrophobicContact CB-CD1 3.76Å; F1526-L1546 HydrophobicContact CB-CD1 3.76Å; F1526-L1546 HydrophobicContact CD1-CD1 4.34Å; F1526-L1546 HydrophobicContact CG-CD1 4.25Å; F1526-T1547 CarbonylContact C-O 3.54Å; F1526-T1547 WeakPolarHBondContact CA-O 3.37Å; F1526-D1548 HydrophobicContact CD1-CB 3.98Å; F1526-D1548 HydrophobicContact CE1-CB 3.93Å; F1526-D1548 VanDerWaalsContact CE1-OD2 3.26Å; F1526-D1548 WeakPolarHBondContact CE1-OD2 3.39Å
1527	V	96.2	Very high	92.1	Very high	42 Å²	42	77.5 Å²	77.5	26%	0.255	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	122.3	165.9	173.4	0	0	0	0	107.9	P1520 R1522 T1547 T1549	P1520-V1527 HydrophobicContact CB-CG1 4.07Å; R1522-V1527 HydrophobicContact CB-CG2 4.2Å; R1522-V1527 HydrophobicContact CG-CG2 4.08Å; V1527-T1547 PolarHBondContact N-O 2.98Å; V1527-T1547 PolarHBondContact O-N 2.81Å; V1527-T1549 HydrophobicContact CG2-CG2 3.67Å
1528	I	96.5	Very high	92	Very high	0 Å²	0	71.3 Å²	71.3	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	126.8	177.4	-59.7	52.6	0	0	0	106.3	W1486 P1516 P1520 S1521 Y1523 F1526 F1544 L1546	W1486-I1528 HydrophobicContact CD2-CD1 4.16Å; W1486-I1528 HydrophobicContact CD2-CG1 3.77Å; W1486-I1528 HydrophobicContact CE3-CG1 4.14Å; W1486-I1528 HydrophobicContact CG-CD1 4.12Å; W1486-I1528 HydrophobicContact CG-CG1 4.24Å; W1486-I1528 HydrophobicContact CH2-CG1 4.2Å; W1486-I1528 HydrophobicContact CH2-CG2 4.06Å; W1486-I1528 HydrophobicContact CZ2-CG1 3.85Å; W1486-I1528 HydrophobicContact CZ2-CG2 3.98Å; W1486-I1528 HydrophobicContact CZ3-CG1 4.33Å; P1516-I1528 HydrophobicContact CG-CB 4.25Å; P1516-I1528 HydrophobicContact CG-CG2 3.74Å; P1520-I1528 CarbonylContact C-O 3.26Å; P1520-I1528 VanDerWaalsContact CA-O 3.26Å; P1520-I1528 WeakPolarHBondContact CA-O 3.43Å; S1521-I1528 PolarHBondContact N-O 3.11Å; S1521-I1528 PolarHBondContact O-N 2.77Å; Y1523-I1528 HydrophobicContact CD2-CD1 3.65Å; Y1523-I1528 HydrophobicContact CD2-CG1 4.08Å; Y1523-I1528 HydrophobicContact CE2-CD1 4.45Å; Y1523-I1528 HydrophobicContact CE2-CG1 4.45Å; F1526-I1528 HydrophobicContact CB-CD1 3.76Å; I1528-F1544 HydrophobicContact CG2-CB 4.09Å; I1528-F1544 HydrophobicContact CG2-CD1 3.74Å; I1528-F1544 HydrophobicContact CG2-CE1 4.47Å; I1528-F1544 HydrophobicContact CG2-CG 4.09Å; I1528-L1546 HydrophobicContact CD1-CD1 3.6Å; I1528-L1546 HydrophobicContact CG1-CD1 3.75Å
1529	D	95.3	Very high	92.4	Very high	62 Å²	62	63.8 Å²	63.8	33%	0.332	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	140	175	-175.9	22.9	0	0	0	109.8	P1520 F1544 K1545	P1520-D1529 HydrophobicContact CB-CB 4.33Å; P1520-D1529 HydrophobicContact CG-CB 4.26Å; D1529-F1544 CarbonylContact O-C 3.56Å; D1529-F1544 WeakPolarHBondContact O-CA 3.1Å; D1529-K1545 HydrophobicContact CB-CB 4.4Å; D1529-K1545 PolarHBondContact N-O 2.74Å; D1529-K1545 PolarHBondContact O-N 2.78Å
1530	L	96.4	Very high	92.6	Very high	45 Å²	45	57.6 Å²	57.6	24%	0.236	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	101.8	-177.8	176.6	68.5	0	0	0	109.1	P1516 E1517 A1532 R1542 F1544	P1516-L1530 HydrophobicContact CG-CB 4.36Å; E1517-L1530 WeakPolarHBondContact O-CD2 3.35Å; L1530-A1532 WeakPolarHBondContact CD1-O 3.29Å; L1530-R1542 HydrophobicContact CD1-CB 4Å; L1530-R1542 HydrophobicContact CD1-CG 4.36Å; L1530-F1544 HydrophobicContact CB-CD1 4.23Å; L1530-F1544 HydrophobicContact CB-CE1 4.21Å; L1530-F1544 HydrophobicContact CD1-CD1 3.89Å; L1530-F1544 HydrophobicContact CD1-CE1 3.48Å; L1530-F1544 VanDerWaalsContact CD1-CE1 3.48Å; L1530-F1544 HydrophobicContact CD1-CZ 4.07Å; L1530-F1544 HydrophobicContact CG-CE1 4.41Å
1531	T	93.5	Very high	92.7	Very high	76 Å²	76	54.9 Å²	54.9	47%	0.466	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-29.3	-175.3	55	0	0	0	0	113.4	E1543 K1545	T1531-E1543 PolarHBondContact N-O 2.77Å; T1531-E1543 WeakPolarHBondContact OG1-CB 3.29Å; T1531-E1543 PolarHBondContact OG1-O 2.63Å; T1531-E1543 VanDerWaalsContact OG1-O 3.09Å; T1531-K1545 HydrophobicContact CG2-CB 3.72Å
1532	A	94.1	Very high	92.9	Very high	19 Å²	19	53.8 Å²	53.8	16%	0.157	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.7	155.4	175.2	0	0	0	0	0	112.7	L1530 Y1534 R1542 E1543	L1530-A1532 WeakPolarHBondContact CD1-O 3.29Å; A1532-Y1534 HydrophobicContact CB-CD2 4.41Å; A1532-Y1534 HydrophobicContact CB-CE2 3.58Å; A1532-R1542 WeakPolarHBondContact O-CA 3.48Å; A1532-E1543 HydrophobicContact CB-CB 4.17Å; A1532-E1543 HydrophobicContact CB-CG 4.23Å; A1532-E1543 PolarHBondContact N-O 3Å; A1532-E1543 PolarHBondContact O-N 2.8Å
1533	Q	94.8	Very high	93.1	Very high	101 Å²	101	47.7 Å²	47.7	47%	0.472	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	129.1	167.7	178.8	174.5	-107.9	0	0	110	I1540 L1541 R1542	Q1533-I1540 HydrophobicContact CG-CG2 3.72Å; Q1533-L1541 CarbonylContact C-O 3.54Å; Q1533-L1541 WeakPolarHBondContact CA-O 3.26Å; Q1533-R1542 HydrophobicContact CB-CG 4.41Å; Q1533-R1542 HydrophobicContact CG-CG 4.07Å
1534	Y	94.4	Very high	93.3	Very high	122 Å²	122	45.7 Å²	45.7	48%	0.478	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	128.6	178.7	-52.5	-80.1	0	0	0	109.6	A1532 I1540 L1541 E1543	A1532-Y1534 HydrophobicContact CB-CD2 4.41Å; A1532-Y1534 HydrophobicContact CB-CE2 3.58Å; Y1534-I1540 CarbonylContact O-C 3.59Å; Y1534-I1540 WeakPolarHBondContact O-CA 3.49Å; Y1534-L1541 HydrophobicContact CD2-CD2 4.07Å; Y1534-L1541 HydrophobicContact CD2-CG 4.24Å; Y1534-L1541 PolarHBondContact N-O 3.14Å; Y1534-L1541 PolarHBondContact O-N 2.8Å; Y1534-E1543 HydrophobicContact CE2-CG 4.34Å
1535	T	92.1	Very high	93.7	Very high	103 Å²	103	48 Å²	48	63%	0.632	25%	0.251	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.8	111.4	174.4	-57.5	0	0	0	0	109.1	I1540	T1535-I1540 HydrophobicContact CG2-CG1 4.28Å
1536	M	88.1	Confident	93.9	Very high	79 Å²	79	44.5 Å²	44.5	39%	0.389	24%	0.236	S	C	.	.			trans	-92.6	173.6	174.8	-51.6	-57.1	-73.5	0	0	110.4	S1538 H1539	M1536-S1538 VanDerWaalsContact C-N 3.27Å; M1536-S1538 PolarHBondContact O-N 3Å; M1536-H1539 WeakPolarHBondContact CA-O 3.44Å; M1536-H1539 VanDerWaalsContact CB-O 3.27Å; M1536-H1539 WeakPolarHBondContact CB-O 3.34Å; M1536-H1539 PolarHBondContact N-O 2.83Å
1537	S	85.7	Confident	94	Very high	90 Å²	90	46 Å²	46	63%	0.629	24%	0.244	S	C	*	.	S	Bend	trans	-55.5	-37	176.6	48.5	0	0	0	0	113.8	H1564	S1537-H1564 PolarHBondContact O-NE2 3.07Å
1538	S	86.2	Confident	94	Very high	2 Å²	2	44 Å²	44	1%	0.014	23%	0.232	C	C	.	.	S	Bend	trans	-117	-13.2	-173	66.5	0	0	0	0	115.4	M1536 Y1562 I1563 D1579	M1536-S1538 VanDerWaalsContact C-N 3.27Å; M1536-S1538 PolarHBondContact O-N 3Å; S1538-Y1562 WeakPolarHBondContact O-CD2 3.23Å; S1538-I1563 WeakPolarHBondContact O-CG1 3.47Å; S1538-I1563 PolarHBondContact O-N 2.95Å; S1538-D1579 VanDerWaalsContact CB-OD2 3.31Å; S1538-D1579 WeakPolarHBondContact CB-OD2 3.41Å; S1538-D1579 PolarHBondContact OG-OD2 3.23Å
1539	H	91.7	Very high	93.8	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.009	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	159.1	-175.8	52.4	-87.9	0	0	0	112.9	M1536 Q1561 L1580 H1583	M1536-H1539 WeakPolarHBondContact CA-O 3.44Å; M1536-H1539 VanDerWaalsContact CB-O 3.27Å; M1536-H1539 WeakPolarHBondContact CB-O 3.34Å; M1536-H1539 PolarHBondContact N-O 2.83Å; H1539-Q1561 CarbonylContact C-O 3.47Å; H1539-Q1561 WeakPolarHBondContact CA-O 2.84Å; H1539-Q1561 VanDerWaalsContact CB-O 3.28Å; H1539-Q1561 WeakPolarHBondContact CB-O 3.09Å; H1539-L1580 HydrophobicContact CB-CD1 3.97Å; H1539-H1583 AromaticContact CE1-CE1 3.98Å; H1539-H1583 AromaticContact CE1-CG 3.68Å; H1539-H1583 AromaticContact CE1-ND1 3.1Å; H1539-H1583 PolarHBondContact CE1-ND1 3.29Å; H1539-H1583 AromaticContact NE2-CG 3.85Å; H1539-H1583 AromaticContact NE2-ND1 3.06Å; H1539-H1583 PolarHBondContact NE2-ND1 3.43Å
1540	I	94.5	Very high	93.6	Very high	30 Å²	30	50.5 Å²	50.5	15%	0.154	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	123.1	168	-58.4	166.8	0	0	0	107.9	Q1533 Y1534 T1535 R1542 L1560 Q1561 I1563	Q1533-I1540 HydrophobicContact CG-CG2 3.72Å; Y1534-I1540 CarbonylContact O-C 3.59Å; Y1534-I1540 WeakPolarHBondContact O-CA 3.49Å; T1535-I1540 HydrophobicContact CG2-CG1 4.28Å; I1540-R1542 HydrophobicContact CG2-CG 4.23Å; I1540-L1560 CarbonylContact O-C 3.57Å; I1540-L1560 WeakPolarHBondContact O-CA 3.23Å; I1540-Q1561 HydrophobicContact CB-CB 4.49Å; I1540-Q1561 PolarHBondContact N-O 3.49Å; I1540-Q1561 PolarHBondContact O-N 3.25Å; I1540-I1563 HydrophobicContact CD1-CG2 4.03Å; I1540-I1563 HydrophobicContact CG1-CG2 4.01Å
1541	L	95.7	Very high	93.3	Very high	23 Å²	23	52.9 Å²	52.9	12%	0.12	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	120.3	169.7	170.4	62.9	0	0	0	109.1	Q1533 Y1534 R1558 Q1559 L1560	Q1533-L1541 CarbonylContact C-O 3.54Å; Q1533-L1541 WeakPolarHBondContact CA-O 3.26Å; Y1534-L1541 HydrophobicContact CD2-CD2 4.07Å; Y1534-L1541 HydrophobicContact CD2-CG 4.24Å; Y1534-L1541 PolarHBondContact N-O 3.14Å; Y1534-L1541 PolarHBondContact O-N 2.8Å; L1541-R1558 HydrophobicContact CD1-CB 4.05Å; L1541-R1558 HydrophobicContact CD1-CG 4.39Å; L1541-Q1559 CarbonylContact C-O 3.49Å; L1541-Q1559 WeakPolarHBondContact CA-O 3.1Å; L1541-L1560 HydrophobicContact CD1-CD1 3.79Å; L1541-L1560 HydrophobicContact CD1-CG 4.05Å
1542	R	96.6	Very high	93.1	Very high	15 Å²	15	51.5 Å²	51.5	6%	0.057	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	138.4	167.3	-58.5	-173.3	-172.7	89.2	7.6	109.9	L1530 A1532 Q1533 I1540 F1544 R1558 Q1559	L1530-R1542 HydrophobicContact CD1-CB 4Å; L1530-R1542 HydrophobicContact CD1-CG 4.36Å; A1532-R1542 WeakPolarHBondContact O-CA 3.48Å; Q1533-R1542 HydrophobicContact CB-CG 4.41Å; Q1533-R1542 HydrophobicContact CG-CG 4.07Å; I1540-R1542 HydrophobicContact CG2-CG 4.23Å; R1542-F1544 HydrophobicContact CB-CD2 4.43Å; R1542-F1544 HydrophobicContact CB-CE1 4.49Å; R1542-F1544 HydrophobicContact CB-CE2 3.66Å; R1542-F1544 HydrophobicContact CB-CZ 3.69Å; R1542-F1544 HydrophobicContact CG-CZ 4.34Å; R1542-R1558 CarbonylContact O-C 3.58Å; R1542-R1558 WeakPolarHBondContact O-CA 3.37Å; R1542-Q1559 HydrophobicContact CB-CB 4.39Å; R1542-Q1559 PolarHBondContact N-O 2.85Å; R1542-Q1559 PolarHBondContact O-N 2.83Å
1543	E	96	Very high	93.1	Very high	30 Å²	30	55.3 Å²	55.3	14%	0.14	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	128.4	169	-52.6	-155.9	152.7	0	0	109.1	T1531 A1532 Y1534 R1558	T1531-E1543 PolarHBondContact N-O 2.77Å; T1531-E1543 WeakPolarHBondContact OG1-CB 3.29Å; T1531-E1543 PolarHBondContact OG1-O 2.63Å; T1531-E1543 VanDerWaalsContact OG1-O 3.09Å; A1532-E1543 HydrophobicContact CB-CB 4.17Å; A1532-E1543 HydrophobicContact CB-CG 4.23Å; A1532-E1543 PolarHBondContact N-O 3Å; A1532-E1543 PolarHBondContact O-N 2.8Å; Y1534-E1543 HydrophobicContact CE2-CG 4.34Å; E1543-R1558 VanDerWaalsContact CD-NH2 3.34Å; E1543-R1558 HydrophobicContact CG-CG 4.29Å; E1543-R1558 IonicContact OE1-CZ 2.71Å; E1543-R1558 IonicContact OE1-NE 3.81Å; E1543-R1558 PolarHBondContact OE1-NE 3.32Å; E1543-R1558 IonicContact OE1-NH2 2.82Å; E1543-R1558 PolarHBondContact OE1-NH2 2.97Å; E1543-R1558 IonicContact OE2-NH2 3.44Å; E1543-R1558 PolarHBondContact OE2-NH2 2.82Å
1544	F	96.7	Very high	93.1	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	140.1	177.2	-58.5	-76.9	0	0	0	110.6	W1486 W1515 P1516 I1528 D1529 L1530 R1542 T1556 I1557 Q1559	W1486-F1544 HydrophobicContact CH2-CD2 4.24Å; W1486-F1544 HydrophobicContact CH2-CG 4.44Å; W1515-F1544 HydrophobicContact CB-CE1 3.66Å; W1515-F1544 HydrophobicContact CB-CE2 4.32Å; W1515-F1544 HydrophobicContact CB-CZ 3.44Å; W1515-F1544 VanDerWaalsContact CB-CZ 3.44Å; W1515-F1544 HydrophobicContact CG-CE1 4.25Å; W1515-F1544 AromaticContact CG-CZ 3.79Å; W1515-F1544 HydrophobicContact CG-CZ 3.79Å; P1516-F1544 HydrophobicContact CG-CD1 4.33Å; P1516-F1544 HydrophobicContact CG-CE1 4.25Å; I1528-F1544 HydrophobicContact CG2-CB 4.09Å; I1528-F1544 HydrophobicContact CG2-CD1 3.74Å; I1528-F1544 HydrophobicContact CG2-CE1 4.47Å; I1528-F1544 HydrophobicContact CG2-CG 4.09Å; D1529-F1544 CarbonylContact O-C 3.56Å; D1529-F1544 WeakPolarHBondContact O-CA 3.1Å; L1530-F1544 HydrophobicContact CB-CD1 4.23Å; L1530-F1544 HydrophobicContact CB-CE1 4.21Å; L1530-F1544 HydrophobicContact CD1-CD1 3.89Å; L1530-F1544 HydrophobicContact CD1-CE1 3.48Å; L1530-F1544 VanDerWaalsContact CD1-CE1 3.48Å; L1530-F1544 HydrophobicContact CD1-CZ 4.07Å; L1530-F1544 HydrophobicContact CG-CE1 4.41Å; R1542-F1544 HydrophobicContact CB-CD2 4.43Å; R1542-F1544 HydrophobicContact CB-CE1 4.49Å; R1542-F1544 HydrophobicContact CB-CE2 3.66Å; R1542-F1544 HydrophobicContact CB-CZ 3.69Å; R1542-F1544 HydrophobicContact CG-CZ 4.34Å; F1544-T1556 CarbonylContact O-C 3.6Å; F1544-T1556 WeakPolarHBondContact O-CA 3.47Å; F1544-I1557 HydrophobicContact CB-CB 4.5Å; F1544-I1557 PolarHBondContact N-O 2.65Å; F1544-I1557 PolarHBondContact O-N 3.12Å; F1544-Q1559 HydrophobicContact CD2-CB 4.47Å; F1544-Q1559 HydrophobicContact CE2-CB 3.81Å
1545	K	96.4	Very high	93.1	Very high	94 Å²	94	49.9 Å²	49.9	41%	0.409	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	111	159.3	-177.6	-177.1	177.7	-172	0	107.6	D1529 T1531 T1547 S1554	D1529-K1545 HydrophobicContact CB-CB 4.4Å; D1529-K1545 PolarHBondContact N-O 2.74Å; D1529-K1545 PolarHBondContact O-N 2.78Å; T1531-K1545 HydrophobicContact CG2-CB 3.72Å; K1545-T1547 WeakPolarHBondContact CE-OG1 3.39Å; K1545-S1554 VanDerWaalsContact CE-OG 3.26Å; K1545-S1554 WeakPolarHBondContact CE-OG 3.47Å
1546	L	96.6	Very high	93.3	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	114	173.3	178.3	64.3	0	0	0	107.8	W1486 V1489 W1490 F1526 I1528 S1554 R1555 I1557	W1486-L1546 HydrophobicContact CD2-CD1 4.41Å; W1486-L1546 HydrophobicContact CE3-CD1 3.83Å; W1486-L1546 HydrophobicContact CE3-CD2 3.96Å; W1486-L1546 HydrophobicContact CZ3-CD1 4.33Å; W1486-L1546 HydrophobicContact CZ3-CD2 4.29Å; V1489-L1546 HydrophobicContact CG1-CD2 3.92Å; W1490-L1546 HydrophobicContact CB-CD2 4.48Å; W1490-L1546 HydrophobicContact CE3-CD2 3.68Å; W1490-L1546 HydrophobicContact CE3-CG 3.82Å; W1490-L1546 HydrophobicContact CZ3-CD2 4.36Å; W1490-L1546 HydrophobicContact CZ3-CG 4.1Å; W1490-L1546 WeakPolarHBondContact CZ3-O 3.39Å; F1526-L1546 HydrophobicContact CB-CD1 3.76Å; F1526-L1546 HydrophobicContact CD1-CD1 4.34Å; F1526-L1546 HydrophobicContact CG-CD1 4.25Å; I1528-L1546 HydrophobicContact CD1-CD1 3.6Å; I1528-L1546 HydrophobicContact CG1-CD1 3.75Å; L1546-S1554 CarbonylContact O-C 3.55Å; L1546-S1554 VanDerWaalsContact O-CA 3.31Å; L1546-S1554 WeakPolarHBondContact O-CA 3.42Å; L1546-R1555 PolarHBondContact N-O 3.46Å; L1546-R1555 PolarHBondContact O-N 2.92Å; L1546-I1557 HydrophobicContact CB-CD1 4.49Å; L1546-I1557 HydrophobicContact CB-CG1 3.65Å; L1546-I1557 HydrophobicContact CD2-CD1 4.05Å; L1546-I1557 HydrophobicContact CD2-CG1 3.72Å; L1546-I1557 HydrophobicContact CG-CG1 4.35Å
1547	T	96.6	Very high	93.7	Very high	30 Å²	30	44.5 Å²	44.5	18%	0.184	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	127.5	179.8	-63.4	0	0	0	0	110.2	F1526 V1527 K1545 E1553 S1554	F1526-T1547 CarbonylContact C-O 3.54Å; F1526-T1547 WeakPolarHBondContact CA-O 3.37Å; V1527-T1547 PolarHBondContact N-O 2.98Å; V1527-T1547 PolarHBondContact O-N 2.81Å; K1545-T1547 WeakPolarHBondContact CE-OG1 3.39Å; T1547-E1553 VanDerWaalsContact CA-O 3.27Å; T1547-E1553 WeakPolarHBondContact CA-O 3.02Å; T1547-S1554 PolarHBondContact OG1-OG 2.83Å
1548	D	95.4	Very high	94.2	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	129.4	170.5	-169.8	-27.2	0	0	0	109.7	W1490 F1526 R1550 D1551 G1552 E1553	W1490-D1548 HydrophobicContact CH2-CB 3.93Å; W1490-D1548 HydrophobicContact CZ2-CB 3.53Å; W1490-D1548 PolarHBondContact NE1-OD2 2.92Å; F1526-D1548 HydrophobicContact CD1-CB 3.98Å; F1526-D1548 HydrophobicContact CE1-CB 3.93Å; F1526-D1548 VanDerWaalsContact CE1-OD2 3.26Å; F1526-D1548 WeakPolarHBondContact CE1-OD2 3.39Å; D1548-R1550 VanDerWaalsContact C-N 3.25Å; D1548-R1550 PolarHBondContact O-N 2.98Å; D1548-R1550 VanDerWaalsContact OD1-CB 3.29Å; D1548-R1550 WeakPolarHBondContact OD1-CB 2.96Å; D1548-R1550 VanDerWaalsContact OD1-CG 3.28Å; D1548-R1550 WeakPolarHBondContact OD1-CG 3.18Å; D1548-R1550 IonicContact OD1-CZ 3.08Å; D1548-R1550 PolarHBondContact OD1-N 2.85Å; D1548-R1550 IonicContact OD1-NE 2.74Å; D1548-R1550 PolarHBondContact OD1-NE 2.82Å; D1548-R1550 IonicContact OD2-CZ 2.79Å; D1548-R1550 VanDerWaalsContact OD2-CZ 3.25Å; D1548-R1550 IonicContact OD2-NE 3.63Å; D1548-R1550 PolarHBondContact OD2-NE 2.84Å; D1548-R1550 IonicContact OD2-NH2 2.8Å; D1548-R1550 PolarHBondContact OD2-NH2 3.2Å; D1548-D1551 WeakPolarHBondContact CB-OD1 3.44Å; D1548-G1552 VanDerWaalsContact O-CA 3.25Å; D1548-G1552 WeakPolarHBondContact O-CA 3.25Å; D1548-G1552 PolarHBondContact O-N 2.95Å; D1548-E1553 PolarHBondContact N-O 3.11Å
1549	T	93.2	Very high	94.7	Very high	59 Å²	59	41 Å²	41	36%	0.362	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.6	1.1	-177	56.4	0	0	0	0	113.6	R1522 F1525 V1527	R1522-T1549 PolarHBondContact NH2-OG1 2.63Å; F1525-T1549 WeakPolarHBondContact O-CB 3.11Å; F1525-T1549 WeakPolarHBondContact O-CG2 3.29Å; F1525-T1549 PolarHBondContact O-N 2.76Å; F1525-T1549 PolarHBondContact O-OG1 3.18Å; V1527-T1549 HydrophobicContact CG2-CG2 3.67Å
1550	R	91.1	Very high	95	Very high	141 Å²	141	41 Å²	41	53%	0.532	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-39.1	179.1	-60.6	174.9	-67.4	171.2	4.1	112.9	F1525 D1548	F1525-R1550 HydrophobicContact CB-CG 4.13Å; F1525-R1550 HydrophobicContact CD1-CG 3.87Å; F1525-R1550 HydrophobicContact CG-CG 4.07Å; D1548-R1550 VanDerWaalsContact C-N 3.25Å; D1548-R1550 PolarHBondContact O-N 2.98Å; D1548-R1550 VanDerWaalsContact OD1-CB 3.29Å; D1548-R1550 WeakPolarHBondContact OD1-CB 2.96Å; D1548-R1550 VanDerWaalsContact OD1-CG 3.28Å; D1548-R1550 WeakPolarHBondContact OD1-CG 3.18Å; D1548-R1550 IonicContact OD1-CZ 3.08Å; D1548-R1550 PolarHBondContact OD1-N 2.85Å; D1548-R1550 IonicContact OD1-NE 2.74Å; D1548-R1550 PolarHBondContact OD1-NE 2.82Å; D1548-R1550 IonicContact OD2-CZ 2.79Å; D1548-R1550 VanDerWaalsContact OD2-CZ 3.25Å; D1548-R1550 IonicContact OD2-NE 3.63Å; D1548-R1550 PolarHBondContact OD2-NE 2.84Å; D1548-R1550 IonicContact OD2-NH2 2.8Å; D1548-R1550 PolarHBondContact OD2-NH2 3.2Å
1551	D	90.3	Very high	95	Very high	95 Å²	95	40.2 Å²	40.2	51%	0.508	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.4	-20.9	-178.6	51.6	30.6	0	0	0	113.1	D1548 E1553	D1548-D1551 WeakPolarHBondContact CB-OD1 3.44Å; D1551-E1553 VanDerWaalsContact C-N 3.33Å; D1551-E1553 WeakPolarHBondContact OD1-CB 3.34Å; D1551-E1553 PolarHBondContact OD1-N 3.26Å
1552	G	89.5	Confident	94.9	Very high	47 Å²	47	39.2 Å²	39.2	49%	0.485	21%	0.205	S	C	.	.			trans	84.3	1.2	-175.3	0	0	0	0	0	114.3	D1548	D1548-G1552 VanDerWaalsContact O-CA 3.25Å; D1548-G1552 WeakPolarHBondContact O-CA 3.25Å; D1548-G1552 PolarHBondContact O-N 2.95Å
1553	E	94.4	Very high	94.5	Very high	98 Å²	98	41.6 Å²	41.6	46%	0.458	22%	0.218	S	C	.	.			trans	-57.3	148.4	174.9	-81.9	-155.9	172	0	0	110.5	W1490 T1547 D1548 D1551 R1555	W1490-E1553 HydrophobicContact CH2-CB 3.59Å; W1490-E1553 HydrophobicContact CZ2-CB 3.71Å; T1547-E1553 VanDerWaalsContact CA-O 3.27Å; T1547-E1553 WeakPolarHBondContact CA-O 3.02Å; D1548-E1553 PolarHBondContact N-O 3.11Å; D1551-E1553 VanDerWaalsContact C-N 3.33Å; D1551-E1553 WeakPolarHBondContact OD1-CB 3.34Å; D1551-E1553 PolarHBondContact OD1-N 3.26Å; E1553-R1555 IonicContact OE2-CZ 3.69Å; E1553-R1555 IonicContact OE2-NE 3.69Å; E1553-R1555 PolarHBondContact OE2-NE 2.93Å; E1553-R1555 IonicContact OE2-NH2 3.96Å; E1553-R1555 PolarHBondContact OE2-NH2 3.12Å
1554	S	94.5	Very high	93.8	Very high	58 Å²	58	44.3 Å²	44.3	41%	0.406	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137	131.8	179.2	-63	0	0	0	0	111	K1545 L1546 T1547	K1545-S1554 VanDerWaalsContact CE-OG 3.26Å; K1545-S1554 WeakPolarHBondContact CE-OG 3.47Å; L1546-S1554 CarbonylContact O-C 3.55Å; L1546-S1554 VanDerWaalsContact O-CA 3.31Å; L1546-S1554 WeakPolarHBondContact O-CA 3.42Å; T1547-S1554 PolarHBondContact OG1-OG 2.83Å
1555	R	94.6	Very high	93	Very high	52 Å²	52	45 Å²	45	20%	0.196	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	138.2	-177.8	-59.6	177.9	-168.1	174	3	110.3	W1490 L1546 E1553 I1557	W1490-R1555 HydrophobicContact CE3-CG 4.29Å; W1490-R1555 HydrophobicContact CH2-CG 3.87Å; W1490-R1555 HydrophobicContact CZ3-CB 3.94Å; W1490-R1555 VanDerWaalsContact CZ3-CD 3.45Å; W1490-R1555 HydrophobicContact CZ3-CG 3.54Å; W1490-R1555 PolarHBondContact O-NH1 2.81Å; W1490-R1555 VanDerWaalsContact O-NH1 3.07Å; L1546-R1555 PolarHBondContact N-O 3.46Å; L1546-R1555 PolarHBondContact O-N 2.92Å; E1553-R1555 IonicContact OE2-CZ 3.69Å; E1553-R1555 IonicContact OE2-NE 3.69Å; E1553-R1555 PolarHBondContact OE2-NE 2.93Å; E1553-R1555 IonicContact OE2-NH2 3.96Å; E1553-R1555 PolarHBondContact OE2-NH2 3.12Å; R1555-I1557 HydrophobicContact CB-CD1 4.21Å; R1555-I1557 PolarHBondContact O-N 3.04Å
1556	T	95.1	Very high	91.7	Very high	67 Å²	67	42.6 Å²	42.6	41%	0.411	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	110.3	174.9	-55.6	0	0	0	0	109.7	F1544 Y1593	F1544-T1556 CarbonylContact O-C 3.6Å; F1544-T1556 WeakPolarHBondContact O-CA 3.47Å; T1556-Y1593 PolarHBondContact O-OH 3.08Å
1557	I	96.5	Very high	89.9	Confident	2 Å²	2	47.8 Å²	47.8	1%	0.01	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	129.4	178.1	-48.6	-58.9	0	0	0	109.1	W1486 V1489 C1495 I1497 F1544 L1546 R1555	W1486-I1557 HydrophobicContact CZ3-CG2 4.31Å; V1489-I1557 HydrophobicContact CG1-CD1 3.95Å; V1489-I1557 HydrophobicContact CG1-CG1 4.16Å; V1489-I1557 HydrophobicContact CG1-CG2 4.07Å; C1495-I1557 WeakPolarHBondContact O-CA 3.15Å; I1497-I1557 HydrophobicContact CD1-CG2 3.61Å; I1497-I1557 HydrophobicContact CG1-CG2 4.04Å; F1544-I1557 HydrophobicContact CB-CB 4.5Å; F1544-I1557 PolarHBondContact N-O 2.65Å; F1544-I1557 PolarHBondContact O-N 3.12Å; L1546-I1557 HydrophobicContact CB-CD1 4.49Å; L1546-I1557 HydrophobicContact CB-CG1 3.65Å; L1546-I1557 HydrophobicContact CD2-CD1 4.05Å; L1546-I1557 HydrophobicContact CD2-CG1 3.72Å; L1546-I1557 HydrophobicContact CG-CG1 4.35Å; R1555-I1557 HydrophobicContact CB-CD1 4.21Å; R1555-I1557 PolarHBondContact O-N 3.04Å
1558	R	96.5	Very high	87.9	Confident	19 Å²	19	55.4 Å²	55.4	7%	0.072	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	128.3	179.7	-70.7	-177.8	165.1	97.4	9.5	110.6	C1495 L1496 I1497 L1541 R1542 E1543 Y1591 Y1593	C1495-R1558 PolarHBondContact O-N 3.45Å; L1496-R1558 CarbonylContact C-O 3.56Å; L1496-R1558 WeakPolarHBondContact CA-O 3.37Å; L1496-R1558 HydrophobicContact CD1-CB 3.74Å; I1497-R1558 PolarHBondContact N-O 2.83Å; L1541-R1558 HydrophobicContact CD1-CB 4.05Å; L1541-R1558 HydrophobicContact CD1-CG 4.39Å; R1542-R1558 CarbonylContact O-C 3.58Å; R1542-R1558 WeakPolarHBondContact O-CA 3.37Å; E1543-R1558 VanDerWaalsContact CD-NH2 3.34Å; E1543-R1558 HydrophobicContact CG-CG 4.29Å; E1543-R1558 IonicContact OE1-CZ 2.71Å; E1543-R1558 IonicContact OE1-NE 3.81Å; E1543-R1558 PolarHBondContact OE1-NE 3.32Å; E1543-R1558 IonicContact OE1-NH2 2.82Å; E1543-R1558 PolarHBondContact OE1-NH2 2.97Å; E1543-R1558 IonicContact OE2-NH2 3.44Å; E1543-R1558 PolarHBondContact OE2-NH2 2.82Å; R1558-Y1591 VanDerWaalsContact CZ-CZ 3.45Å; R1558-Y1591 VanDerWaalsContact NH1-CE1 3.35Å; R1558-Y1591 PolarHBondContact NH2-OH 3Å; R1558-Y1593 PolarHBondContact NH1-OH 3.39Å
1559	Q	97.2	Very high	86.7	Confident	0 Å²	0	57 Å²	57	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	120.1	175.5	-177.2	-155.6	36.4	0	0	109.7	I1497 Y1514 L1541 R1542 F1544	I1497-Q1559 HydrophobicContact CB-CB 4.37Å; I1497-Q1559 HydrophobicContact CB-CG 4.38Å; I1497-Q1559 HydrophobicContact CG2-CG 4.32Å; I1497-Q1559 CarbonylContact O-C 3.55Å; I1497-Q1559 VanDerWaalsContact O-CA 3.3Å; I1497-Q1559 WeakPolarHBondContact O-CA 3.35Å; Y1514-Q1559 PolarHBondContact OH-NE2 2.86Å; L1541-Q1559 CarbonylContact C-O 3.49Å; L1541-Q1559 WeakPolarHBondContact CA-O 3.1Å; R1542-Q1559 HydrophobicContact CB-CB 4.39Å; R1542-Q1559 PolarHBondContact N-O 2.85Å; R1542-Q1559 PolarHBondContact O-N 2.83Å; F1544-Q1559 HydrophobicContact CD2-CB 4.47Å; F1544-Q1559 HydrophobicContact CE2-CB 3.81Å
1560	L	96.7	Very high	86.1	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	109.8	169.9	-70.4	81.3	0	0	0	109	L1496 I1497 V1498 M1499 I1540 L1541 L1580 H1583 V1584 I1587	L1496-L1560 HydrophobicContact CD1-CD1 3.51Å; I1497-L1560 PolarHBondContact O-N 3.19Å; V1498-L1560 WeakPolarHBondContact CA-O 3.46Å; M1499-L1560 PolarHBondContact N-O 3.22Å; I1540-L1560 CarbonylContact O-C 3.57Å; I1540-L1560 WeakPolarHBondContact O-CA 3.23Å; L1541-L1560 HydrophobicContact CD1-CD1 3.79Å; L1541-L1560 HydrophobicContact CD1-CG 4.05Å; L1560-L1580 HydrophobicContact CB-CD1 3.98Å; L1560-L1580 HydrophobicContact CD2-CD1 3.81Å; L1560-H1583 HydrophobicContact CD2-CB 4.27Å; L1560-V1584 HydrophobicContact CD2-CG2 3.97Å; L1560-I1587 HydrophobicContact CD1-CD1 3.97Å; L1560-I1587 HydrophobicContact CD2-CD1 4.08Å
1561	Q	95.6	Very high	85.7	Confident	14 Å²	14	49.2 Å²	49.2	7%	0.065	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	113.6	173.8	-178.1	177.1	12	0	0	110.2	M1499 C1501 H1539 I1540	M1499-Q1561 HydrophobicContact CB-CB 4.24Å; M1499-Q1561 HydrophobicContact CB-CG 4.3Å; M1499-Q1561 HydrophobicContact CG-CB 4.49Å; M1499-Q1561 HydrophobicContact CG-CG 4.04Å; M1499-Q1561 WeakPolarHBondContact O-CA 3.5Å; M1499-Q1561 HydrophobicContact SD-CG 4.24Å; C1501-Q1561 PolarHBondContact O-NE2 2.97Å; H1539-Q1561 CarbonylContact C-O 3.47Å; H1539-Q1561 WeakPolarHBondContact CA-O 2.84Å; H1539-Q1561 VanDerWaalsContact CB-O 3.28Å; H1539-Q1561 WeakPolarHBondContact CB-O 3.09Å; I1540-Q1561 HydrophobicContact CB-CB 4.49Å; I1540-Q1561 PolarHBondContact N-O 3.49Å; I1540-Q1561 PolarHBondContact O-N 3.25Å
1562	Y	93.7	Very high	85	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.008	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	132.8	177.1	-177.1	-115.4	0	0	0	111.4	M1499 S1538 H1564 W1565 P1571 S1576 L1580	M1499-Y1562 PolarHBondContact O-N 3.39Å; S1538-Y1562 WeakPolarHBondContact O-CD2 3.23Å; Y1562-H1564 HydrophobicContact CE1-CB 4.33Å; Y1562-H1564 HydrophobicContact CE2-CB 4.2Å; Y1562-W1565 HydrophobicContact CD1-CB 3.97Å; Y1562-W1565 AromaticContact CD1-CE3 3.9Å; Y1562-W1565 HydrophobicContact CD1-CE3 3.9Å; Y1562-W1565 HydrophobicContact CE1-CB 3.89Å; Y1562-W1565 HydrophobicContact CE1-CD2 4.34Å; Y1562-W1565 AromaticContact CE1-CE3 3.76Å; Y1562-W1565 HydrophobicContact CE1-CE3 3.76Å; Y1562-W1565 HydrophobicContact CE1-CG 4.46Å; Y1562-P1571 HydrophobicContact CE1-CG 3.96Å; Y1562-P1571 WeakPolarHBondContact OH-CB 3.48Å; Y1562-P1571 VanDerWaalsContact OH-CG 3.26Å; Y1562-P1571 WeakPolarHBondContact OH-CG 3.36Å; Y1562-S1576 WeakPolarHBondContact CE2-O 3.37Å; Y1562-S1576 PolarHBondContact OH-OG 3.21Å; Y1562-L1580 HydrophobicContact CD2-CB 4.39Å; Y1562-L1580 HydrophobicContact CD2-CD2 3.73Å; Y1562-L1580 HydrophobicContact CG-CD2 3.94Å
1563	I	88	Confident	84.5	Confident	65 Å²	65	53.5 Å²	53.5	33%	0.333	27%	0.274	S	S	.	.			trans	-106.8	-20.1	-171.9	59.8	172	0	0	0	114.9	S1538 I1540 W1565	S1538-I1563 WeakPolarHBondContact O-CG1 3.47Å; S1538-I1563 PolarHBondContact O-N 2.95Å; I1540-I1563 HydrophobicContact CD1-CG2 4.03Å; I1540-I1563 HydrophobicContact CG1-CG2 4.01Å; I1563-W1565 VanDerWaalsContact C-N 3.32Å; I1563-W1565 PolarHBondContact O-N 3.17Å
1564	H	80.4	Confident	84.1	Confident	87 Å²	87	48.9 Å²	48.9	40%	0.403	25%	0.253	S	S	.	.			trans	-89.3	13.4	-173.7	-68.2	-47.4	0	0	0	115.3	S1537 Y1562 N1566	S1537-H1564 PolarHBondContact O-NE2 3.07Å; Y1562-H1564 HydrophobicContact CE1-CB 4.33Å; Y1562-H1564 HydrophobicContact CE2-CB 4.2Å; H1564-N1566 PolarHBondContact O-N 2.92Å
1565	W	80.8	Confident	83.8	Confident	16 Å²	16	52.3 Å²	52.3	6%	0.061	26%	0.263	C	S	.	.			trans	-82.3	98.8	170.9	-143.6	-54.2	0	0	0	110	Y1562 I1563 G1569 L1570 P1571 R1607 L1610	Y1562-W1565 HydrophobicContact CD1-CB 3.97Å; Y1562-W1565 AromaticContact CD1-CE3 3.9Å; Y1562-W1565 HydrophobicContact CD1-CE3 3.9Å; Y1562-W1565 HydrophobicContact CE1-CB 3.89Å; Y1562-W1565 HydrophobicContact CE1-CD2 4.34Å; Y1562-W1565 AromaticContact CE1-CE3 3.76Å; Y1562-W1565 HydrophobicContact CE1-CE3 3.76Å; Y1562-W1565 HydrophobicContact CE1-CG 4.46Å; I1563-W1565 VanDerWaalsContact C-N 3.32Å; I1563-W1565 PolarHBondContact O-N 3.17Å; W1565-G1569 PolarHBondContact NE1-O 2.75Å; W1565-L1570 HydrophobicContact CZ2-CD2 3.88Å; W1565-P1571 HydrophobicContact CD2-CG 4.2Å; W1565-P1571 HydrophobicContact CE3-CG 4.27Å; W1565-R1607 VanDerWaalsContact CD1-CZ 3.5Å; W1565-R1607 HydrophobicContact CD2-CG 3.99Å; W1565-R1607 VanDerWaalsContact CE2-CD 3.5Å; W1565-R1607 VanDerWaalsContact CE2-NE 3.3Å; W1565-R1607 HydrophobicContact CE3-CB 4.22Å; W1565-R1607 HydrophobicContact CE3-CG 4.13Å; W1565-R1607 VanDerWaalsContact CG-NE 3.31Å; W1565-R1607 HydrophobicContact CH2-CB 3.62Å; W1565-R1607 HydrophobicContact CH2-CG 3.64Å; W1565-R1607 HydrophobicContact CZ2-CB 4.05Å; W1565-R1607 HydrophobicContact CZ2-CG 3.49Å; W1565-R1607 VanDerWaalsContact CZ2-CG 3.49Å; W1565-R1607 HydrophobicContact CZ3-CB 3.73Å; W1565-R1607 HydrophobicContact CZ3-CG 3.97Å; W1565-R1607 VanDerWaalsContact NE1-NE 3.18Å; W1565-L1610 HydrophobicContact CH2-CB 4.26Å; W1565-L1610 HydrophobicContact CH2-CD1 3.88Å; W1565-L1610 HydrophobicContact CH2-CD2 3.94Å; W1565-L1610 HydrophobicContact CH2-CG 4.24Å; W1565-L1610 HydrophobicContact CZ2-CD1 4.22Å; W1565-L1610 HydrophobicContact CZ3-CD2 4.47Å
1566	N	68.2	Low	83.5	Confident	43 Å²	43	50.8 Å²	50.8	23%	0.23	26%	0.26	C	S	.	.			trans	-59.5	154	177.6	60	33.5	0	0	0	112	H1564 Q1568 G1569 L1570 H1572	H1564-N1566 PolarHBondContact O-N 2.92Å; N1566-Q1568 PolarHBondContact O-N 2.87Å; N1566-G1569 WeakPolarHBondContact OD1-CA 3.44Å; N1566-G1569 PolarHBondContact OD1-N 2.99Å; N1566-L1570 VanDerWaalsContact CG-O 3.3Å; N1566-L1570 PolarHBondContact ND2-O 3.01Å; N1566-L1570 PolarHBondContact OD1-N 2.97Å; N1566-L1570 PolarHBondContact OD1-O 2.83Å; N1566-H1572 PolarHBondContact ND2-CE1 3.03Å; N1566-H1572 PolarHBondContact ND2-NE2 2.88Å; N1566-H1572 VanDerWaalsContact ND2-NE2 3.13Å
1567	E	60.2	Low	83.3	Confident	108 Å²	108	47.6 Å²	47.6	51%	0.505	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-21.8	-177.2	-56.1	-159.7	144.6	0	0	113.5	E1505 S1506	E1505-E1567 VanDerWaalsContact CA-OE1 3.28Å; E1505-E1567 WeakPolarHBondContact CA-OE1 3.49Å; E1505-E1567 HydrophobicContact CB-CG 4.22Å; S1506-E1567 WeakPolarHBondContact CA-OE2 3.5Å; S1506-E1567 WeakPolarHBondContact CB-OE2 3.17Å; S1506-E1567 PolarHBondContact N-OE1 2.87Å; S1506-E1567 PolarHBondContact N-OE2 2.9Å; S1506-E1567 WeakPolarHBondContact OG-CB 3.49Å; S1506-E1567 PolarHBondContact OG-OE2 3.06Å
1568	Q	54.6	Low	83	Confident	191 Å²	191	49.1 Å²	49.1	89%	0.893	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.5	-11.4	-167.5	-65.7	-174.3	-6.7	0	0	114.9	N1566	N1566-Q1568 PolarHBondContact O-N 2.87Å
1569	G	69.2	Low	82.7	Confident	33 Å²	33	50.7 Å²	50.7	34%	0.34	26%	0.258	S	S	.	.	S	Bend	trans	-175.3	-102.5	-176.9	0	0	0	0	0	115.8	W1565 N1566	W1565-G1569 PolarHBondContact NE1-O 2.75Å; N1566-G1569 WeakPolarHBondContact OD1-CA 3.44Å; N1566-G1569 PolarHBondContact OD1-N 2.99Å
1570	L	82	Confident	82.4	Confident	32 Å²	32	50.7 Å²	50.7	17%	0.168	26%	0.258	C	S	.	.	S	Bend	trans	-131.5	158.4	-170.1	-75.6	159.5	0	0	0	110.4	W1565 N1566 L1610 E1648 Q1649 F1652	W1565-L1570 HydrophobicContact CZ2-CD2 3.88Å; N1566-L1570 VanDerWaalsContact CG-O 3.3Å; N1566-L1570 PolarHBondContact ND2-O 3.01Å; N1566-L1570 PolarHBondContact OD1-N 2.97Å; N1566-L1570 PolarHBondContact OD1-O 2.83Å; L1570-L1610 HydrophobicContact CD2-CD1 3.77Å; L1570-E1648 HydrophobicContact CD1-CB 3.78Å; L1570-Q1649 HydrophobicContact CD2-CG 3.96Å; L1570-F1652 HydrophobicContact CB-CD2 4.21Å; L1570-F1652 HydrophobicContact CB-CE2 4.48Å; L1570-F1652 HydrophobicContact CD1-CB 3.89Å; L1570-F1652 HydrophobicContact CD1-CD2 4.21Å; L1570-F1652 HydrophobicContact CD1-CG 4.23Å; L1570-F1652 HydrophobicContact CD2-CB 4.02Å; L1570-F1652 HydrophobicContact CD2-CD1 4.22Å; L1570-F1652 HydrophobicContact CD2-CD2 4.35Å; L1570-F1652 HydrophobicContact CD2-CG 3.93Å
1571	P	82.2	Confident	82.2	Confident	5 Å²	5	51.2 Å²	51.2	3%	0.032	26%	0.261	C	S	.	.			trans	-54.6	148.8	168.7	-21.7	34	0	0	0	111.7	Y1562 W1565 F1652	Y1562-P1571 HydrophobicContact CE1-CG 3.96Å; Y1562-P1571 WeakPolarHBondContact OH-CB 3.48Å; Y1562-P1571 VanDerWaalsContact OH-CG 3.26Å; Y1562-P1571 WeakPolarHBondContact OH-CG 3.36Å; W1565-P1571 HydrophobicContact CD2-CG 4.2Å; W1565-P1571 HydrophobicContact CE3-CG 4.27Å; P1571-F1652 HydrophobicContact CB-CZ 3.96Å; P1571-F1652 HydrophobicContact CG-CE1 4.48Å; P1571-F1652 HydrophobicContact CG-CZ 4.14Å; P1571-F1652 WeakPolarHBondContact O-CE2 3.33Å
1572	H	74.2	Confident	82	Confident	169 Å²	169	52.4 Å²	52.4	78%	0.782	28%	0.277	S	S	*	.	S	Bend	trans	-75	-30.1	-176.6	-66.6	-74.2	0	0	0	113.6	N1566	N1566-H1572 PolarHBondContact ND2-CE1 3.03Å; N1566-H1572 PolarHBondContact ND2-NE2 2.88Å; N1566-H1572 VanDerWaalsContact ND2-NE2 3.13Å
1573	T	81	Confident	81.9	Confident	63 Å²	63	54.5 Å²	54.5	39%	0.387	29%	0.286	S	S	.	.			trans	-133	150.3	171.9	68	0	0	0	0	110.6	E1575	T1573-E1575 WeakPolarHBondContact CB-OE2 3.47Å; T1573-E1575 PolarHBondContact O-N 2.87Å; T1573-E1575 PolarHBondContact OG1-OE2 3.39Å
1574	G	84.9	Confident	82.1	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.01	27%	0.27	C	S	.	.	S	Bend	trans	-66.6	-24.2	176.2	0	0	0	0	0	113.7	S1576 L1577 I1578	G1574-S1576 PolarHBondContact O-N 2.67Å; G1574-L1577 WeakPolarHBondContact O-CB 3.27Å; G1574-L1577 PolarHBondContact O-N 2.81Å; G1574-I1578 WeakPolarHBondContact O-CG1 3.46Å; G1574-I1578 PolarHBondContact O-N 3.13Å
1575	E	87.4	Confident	82.5	Confident	130 Å²	130	48.4 Å²	48.4	61%	0.607	26%	0.256	S	S	*	.	H	α-helix	trans	-53.2	-47.1	-174.4	-57.8	166	130.3	0	0	113.1	T1573 L1577 I1578 D1579	T1573-E1575 WeakPolarHBondContact CB-OE2 3.47Å; T1573-E1575 PolarHBondContact O-N 2.87Å; T1573-E1575 PolarHBondContact OG1-OE2 3.39Å; E1575-L1577 PolarHBondContact O-N 2.02Å; E1575-I1578 WeakPolarHBondContact O-CB 3.47Å; E1575-I1578 PolarHBondContact O-N 2.68Å; E1575-D1579 WeakPolarHBondContact O-CB 2.99Å; E1575-D1579 PolarHBondContact O-N 2.81Å
1576	S	88.6	Confident	83	Confident	20 Å²	20	52.4 Å²	52.4	14%	0.14	27%	0.274	C	S	.	.	H	α-helix	trans	-66.7	-24.6	-179.2	66.2	0	0	0	0	113.6	Y1562 G1574 L1580	Y1562-S1576 WeakPolarHBondContact CE2-O 3.37Å; Y1562-S1576 PolarHBondContact OH-OG 3.21Å; G1574-S1576 PolarHBondContact O-N 2.67Å; S1576-L1580 PolarHBondContact O-N 2.84Å
1577	L	90.6	Very high	84.1	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-83.2	-38.2	174.2	-176.8	66.3	0	0	0	110.9	G1574 E1575 D1579 L1580 I1581 L1610 F1611 M1614 F1652	G1574-L1577 WeakPolarHBondContact O-CB 3.27Å; G1574-L1577 PolarHBondContact O-N 2.81Å; E1575-L1577 PolarHBondContact O-N 2.02Å; L1577-D1579 VanDerWaalsContact C-N 3.34Å; L1577-L1580 HydrophobicContact CD1-CD2 4.43Å; L1577-L1580 PolarHBondContact O-N 2.9Å; L1577-I1581 HydrophobicContact CG-CD1 4.15Å; L1577-I1581 VanDerWaalsContact O-CG1 3.26Å; L1577-I1581 WeakPolarHBondContact O-CG1 3.2Å; L1577-I1581 PolarHBondContact O-N 3.25Å; L1577-L1610 HydrophobicContact CD2-CD2 3.42Å; L1577-L1610 VanDerWaalsContact CD2-CD2 3.42Å; L1577-F1611 HydrophobicContact CD1-CD2 3.89Å; L1577-F1611 HydrophobicContact CD1-CE2 4.49Å; L1577-M1614 HydrophobicContact CD2-CG 3.99Å; L1577-F1652 HydrophobicContact CD2-CE1 4.02Å
1578	I	90.9	Very high	85.4	Confident	33 Å²	33	47.9 Å²	47.9	17%	0.169	25%	0.252	C	S	.	.	H	α-helix	trans	-60.6	-43.5	172.3	-68.8	161.7	0	0	0	110.5	G1574 E1575 I1581 G1582 L1618 T1656 Y1660	G1574-I1578 WeakPolarHBondContact O-CG1 3.46Å; G1574-I1578 PolarHBondContact O-N 3.13Å; E1575-I1578 WeakPolarHBondContact O-CB 3.47Å; E1575-I1578 PolarHBondContact O-N 2.68Å; I1578-I1581 PolarHBondContact O-N 3Å; I1578-G1582 PolarHBondContact O-N 3.23Å; I1578-L1618 HydrophobicContact CG1-CD1 4.44Å; I1578-T1656 HydrophobicContact CD1-CG2 3.87Å; I1578-T1656 HydrophobicContact CG1-CG2 3.81Å; I1578-Y1660 HydrophobicContact CD1-CD2 4.15Å; I1578-Y1660 HydrophobicContact CG1-CD2 4.24Å; I1578-Y1660 HydrophobicContact CG2-CD2 3.65Å; I1578-Y1660 HydrophobicContact CG2-CE2 3.97Å
1579	D	89.8	Confident	87	Confident	53 Å²	53	44.4 Å²	44.4	28%	0.283	24%	0.235	S	C	.	.	H	α-helix	trans	-60.2	-47.9	175.4	176.9	59.3	0	0	0	111.9	S1538 E1575 L1577 I1581 G1582 H1583	S1538-D1579 VanDerWaalsContact CB-OD2 3.31Å; S1538-D1579 WeakPolarHBondContact CB-OD2 3.41Å; S1538-D1579 PolarHBondContact OG-OD2 3.23Å; E1575-D1579 WeakPolarHBondContact O-CB 2.99Å; E1575-D1579 PolarHBondContact O-N 2.81Å; L1577-D1579 VanDerWaalsContact C-N 3.34Å; D1579-I1581 PolarHBondContact O-N 2.84Å; D1579-G1582 PolarHBondContact O-N 3.39Å; D1579-H1583 PolarHBondContact O-N 3.06Å
1580	L	92.2	Very high	88	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-58.3	-46.3	172.7	174.9	67.1	0	0	0	112.1	V1498 L1500 H1539 L1560 Y1562 S1576 L1577 G1582 H1583 V1584 F1611	V1498-L1580 HydrophobicContact CG1-CD2 4.3Å; L1500-L1580 HydrophobicContact CD2-CD2 4Å; H1539-L1580 HydrophobicContact CB-CD1 3.97Å; L1560-L1580 HydrophobicContact CB-CD1 3.98Å; L1560-L1580 HydrophobicContact CD2-CD1 3.81Å; Y1562-L1580 HydrophobicContact CD2-CB 4.39Å; Y1562-L1580 HydrophobicContact CD2-CD2 3.73Å; Y1562-L1580 HydrophobicContact CG-CD2 3.94Å; S1576-L1580 PolarHBondContact O-N 2.84Å; L1577-L1580 HydrophobicContact CD1-CD2 4.43Å; L1577-L1580 PolarHBondContact O-N 2.9Å; L1580-G1582 VanDerWaalsContact C-N 3.35Å; L1580-H1583 PolarHBondContact O-N 3.22Å; L1580-V1584 HydrophobicContact CD1-CG2 4.2Å; L1580-V1584 HydrophobicContact CG-CG2 4.44Å; L1580-V1584 WeakPolarHBondContact O-CB 3.44Å; L1580-V1584 WeakPolarHBondContact O-CG2 3.41Å; L1580-V1584 PolarHBondContact O-N 2.72Å; L1580-F1611 HydrophobicContact CD2-CD2 4.19Å; L1580-F1611 HydrophobicContact CD2-CE2 3.7Å; L1580-F1611 HydrophobicContact CG-CE2 3.97Å
1581	I	92.4	Very high	88.2	Confident	11 Å²	11	50.9 Å²	50.9	6%	0.056	25%	0.253	C	S	.	.	H	α-helix	trans	-61.5	-45.4	178	-71	166.5	0	0	0	110	L1577 I1578 D1579 H1583 V1584 H1585 F1611 M1614 L1618	L1577-I1581 HydrophobicContact CG-CD1 4.15Å; L1577-I1581 VanDerWaalsContact O-CG1 3.26Å; L1577-I1581 WeakPolarHBondContact O-CG1 3.2Å; L1577-I1581 PolarHBondContact O-N 3.25Å; I1578-I1581 PolarHBondContact O-N 3Å; D1579-I1581 PolarHBondContact O-N 2.84Å; I1581-H1583 VanDerWaalsContact C-N 3.33Å; I1581-H1583 PolarHBondContact O-N 3.31Å; I1581-V1584 PolarHBondContact O-N 3.14Å; I1581-H1585 PolarHBondContact O-CD2 2.83Å; I1581-H1585 VanDerWaalsContact O-CD2 3.29Å; I1581-H1585 PolarHBondContact O-N 3.21Å; I1581-F1611 HydrophobicContact CD1-CE2 4.44Å; I1581-F1611 HydrophobicContact CG1-CD2 4.15Å; I1581-F1611 HydrophobicContact CG1-CE2 3.56Å; I1581-F1611 HydrophobicContact CG1-CZ 3.85Å; I1581-M1614 HydrophobicContact CD1-CB 3.49Å; I1581-M1614 VanDerWaalsContact CD1-CB 3.49Å; I1581-M1614 HydrophobicContact CD1-CG 4.48Å; I1581-L1618 HydrophobicContact CD1-CD1 4.11Å
1582	G	90.5	Very high	88.4	Confident	39 Å²	39	58 Å²	58	40%	0.402	29%	0.285	S	S	.	.	H	α-helix	trans	-56.9	-43.6	174.6	0	0	0	0	0	112.6	I1578 D1579 L1580 K1586	I1578-G1582 PolarHBondContact O-N 3.23Å; D1579-G1582 PolarHBondContact O-N 3.39Å; L1580-G1582 VanDerWaalsContact C-N 3.35Å; G1582-K1586 WeakPolarHBondContact O-CB 3.16Å; G1582-K1586 PolarHBondContact O-N 3.03Å
1583	H	91.8	Very high	89	Confident	45 Å²	45	51.3 Å²	51.3	21%	0.208	25%	0.253	C	S	.	.	H	α-helix	trans	-67.3	-39	174.6	-84	-156.1	0	0	0	113.3	H1539 L1560 D1579 L1580 I1581 I1587	H1539-H1583 AromaticContact CE1-CE1 3.98Å; H1539-H1583 AromaticContact CE1-CG 3.68Å; H1539-H1583 AromaticContact CE1-ND1 3.1Å; H1539-H1583 PolarHBondContact CE1-ND1 3.29Å; H1539-H1583 AromaticContact NE2-CG 3.85Å; H1539-H1583 AromaticContact NE2-ND1 3.06Å; H1539-H1583 PolarHBondContact NE2-ND1 3.43Å; L1560-H1583 HydrophobicContact CD2-CB 4.27Å; D1579-H1583 PolarHBondContact O-N 3.06Å; L1580-H1583 PolarHBondContact O-N 3.22Å; I1581-H1583 VanDerWaalsContact C-N 3.33Å; I1581-H1583 PolarHBondContact O-N 3.31Å; H1583-I1587 WeakPolarHBondContact O-CB 2.99Å; H1583-I1587 VanDerWaalsContact O-CG1 3.23Å; H1583-I1587 WeakPolarHBondContact O-CG1 3.47Å; H1583-I1587 PolarHBondContact O-N 2.94Å
1584	V	92.9	Very high	89.1	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-63.2	-49.4	176.5	165.8	0	0	0	0	111.3	L1496 V1498 L1560 L1580 I1581 I1587 K1588 I1597 F1611	L1496-V1584 HydrophobicContact CD2-CG1 4.01Å; V1498-V1584 HydrophobicContact CG2-CG1 4.37Å; V1498-V1584 HydrophobicContact CG2-CG2 3.72Å; L1560-V1584 HydrophobicContact CD2-CG2 3.97Å; L1580-V1584 HydrophobicContact CD1-CG2 4.2Å; L1580-V1584 HydrophobicContact CG-CG2 4.44Å; L1580-V1584 WeakPolarHBondContact O-CB 3.44Å; L1580-V1584 WeakPolarHBondContact O-CG2 3.41Å; L1580-V1584 PolarHBondContact O-N 2.72Å; I1581-V1584 PolarHBondContact O-N 3.14Å; V1584-I1587 PolarHBondContact O-N 2.88Å; V1584-K1588 PolarHBondContact O-N 3.44Å; V1584-I1597 HydrophobicContact CG1-CD1 3.82Å; V1584-I1597 HydrophobicContact CG1-CG2 4.42Å; V1584-F1611 HydrophobicContact CB-CZ 4.43Å; V1584-F1611 HydrophobicContact CG1-CZ 4.38Å; V1584-F1611 HydrophobicContact CG2-CZ 4.14Å
1585	H	87.5	Confident	89.2	Confident	24 Å²	24	56.5 Å²	56.5	11%	0.111	28%	0.282	C	S	.	.	H	α-helix	trans	-65.1	-44.5	176.4	-76.9	-100.1	0	0	0	111.3	I1581 I1587 K1588 E1589 E1619	I1581-H1585 PolarHBondContact O-CD2 2.83Å; I1581-H1585 VanDerWaalsContact O-CD2 3.29Å; I1581-H1585 PolarHBondContact O-N 3.21Å; H1585-I1587 VanDerWaalsContact C-N 3.28Å; H1585-I1587 PolarHBondContact O-N 3.02Å; H1585-K1588 PolarHBondContact O-N 2.99Å; H1585-K1588 VanDerWaalsContact O-N 3.1Å; H1585-E1589 WeakPolarHBondContact O-CB 3.19Å; H1585-E1589 WeakPolarHBondContact O-CG 3.42Å; H1585-E1589 PolarHBondContact O-N 3.26Å; H1585-E1619 IonicContact CE1-OE1 3.48Å; H1585-E1619 PolarHBondContact CE1-OE1 2.75Å; H1585-E1619 IonicContact ND1-OE1 2.74Å
1586	K	90.9	Very high	89.6	Confident	101 Å²	101	51.2 Å²	51.2	44%	0.439	26%	0.259	S	S	.	.	H	α-helix	trans	-57.2	-38.3	175.1	-179.5	-178.5	175.6	-173.8	0	112.7	G1582 Q1590	G1582-K1586 WeakPolarHBondContact O-CB 3.16Å; G1582-K1586 PolarHBondContact O-N 3.03Å; K1586-Q1590 WeakPolarHBondContact O-CB 3.44Å; K1586-Q1590 PolarHBondContact O-N 3.3Å
1587	I	91.3	Very high	90	Very high	17 Å²	17	50.5 Å²	50.5	9%	0.087	25%	0.254	C	S	.	.	H	α-helix	trans	-71.1	-40.8	176.2	-72.4	167.7	0	0	0	111	L1496 L1560 H1583 V1584 H1585 E1589 Y1591 Y1593	L1496-I1587 HydrophobicContact CD1-CG2 3.67Å; L1496-I1587 HydrophobicContact CD2-CB 4.44Å; L1496-I1587 HydrophobicContact CD2-CG2 4.09Å; L1560-I1587 HydrophobicContact CD1-CD1 3.97Å; L1560-I1587 HydrophobicContact CD2-CD1 4.08Å; H1583-I1587 WeakPolarHBondContact O-CB 2.99Å; H1583-I1587 VanDerWaalsContact O-CG1 3.23Å; H1583-I1587 WeakPolarHBondContact O-CG1 3.47Å; H1583-I1587 PolarHBondContact O-N 2.94Å; V1584-I1587 PolarHBondContact O-N 2.88Å; H1585-I1587 VanDerWaalsContact C-N 3.28Å; H1585-I1587 PolarHBondContact O-N 3.02Å; I1587-E1589 PolarHBondContact O-N 3.31Å; I1587-Y1591 HydrophobicContact CG2-CD2 4.01Å; I1587-Y1591 HydrophobicContact CG2-CE2 4.46Å; I1587-Y1591 WeakPolarHBondContact O-CD2 3.12Å; I1587-Y1591 PolarHBondContact O-N 3.06Å; I1587-Y1593 HydrophobicContact CG2-CD2 4.27Å; I1587-Y1593 HydrophobicContact CG2-CE2 3.81Å
1588	K	88.6	Confident	90.4	Very high	39 Å²	39	50.5 Å²	50.5	17%	0.17	25%	0.254	C	S	.	.	H	α-helix	trans	-59.3	-46.8	173.8	-164.4	-161.6	-178.9	-173.6	0	111.3	E1467 V1584 H1585 H1592 Y1593 I1597	E1467-K1588 IonicContact OE1-NZ 3.16Å; E1467-K1588 PolarHBondContact OE1-NZ 2.82Å; E1467-K1588 IonicContact OE2-NZ 3.52Å; E1467-K1588 PolarHBondContact OE2-NZ 3.24Å; V1584-K1588 PolarHBondContact O-N 3.44Å; H1585-K1588 PolarHBondContact O-N 2.99Å; H1585-K1588 VanDerWaalsContact O-N 3.1Å; K1588-H1592 WeakPolarHBondContact O-CA 3.19Å; K1588-H1592 PolarHBondContact O-N 3.11Å; K1588-H1592 VanDerWaalsContact O-N 3.1Å; K1588-Y1593 WeakPolarHBondContact CE-O 3.41Å; K1588-Y1593 WeakPolarHBondContact CG-O 3.39Å; K1588-Y1593 PolarHBondContact O-N 2.92Å; K1588-I1597 HydrophobicContact CD-CD1 4.4Å
1589	E	87.2	Confident	90.7	Very high	117 Å²	117	49 Å²	49	55%	0.547	25%	0.245	S	C	.	.	H	α-helix	trans	-65.3	-49.7	178.6	-70.4	169.8	-161.6	0	0	112.2	H1585 I1587 Y1591 H1592	H1585-E1589 WeakPolarHBondContact O-CB 3.19Å; H1585-E1589 WeakPolarHBondContact O-CG 3.42Å; H1585-E1589 PolarHBondContact O-N 3.26Å; I1587-E1589 PolarHBondContact O-N 3.31Å; E1589-Y1591 PolarHBondContact O-N 2.96Å; E1589-H1592 PolarHBondContact O-CE1 3.47Å; E1589-H1592 PolarHBondContact O-N 2.98Å; E1589-H1592 PolarHBondContact O-ND1 2.91Å
1590	Q	90.1	Very high	91.1	Very high	107 Å²	107	46.4 Å²	46.4	50%	0.5	23%	0.232	S	C	.	.	H	α-helix	trans	-67.6	-30.6	-174	-179.4	-179.5	-43.7	0	0	113.7	K1586	K1586-Q1590 WeakPolarHBondContact O-CB 3.44Å; K1586-Q1590 PolarHBondContact O-N 3.3Å
1591	Y	87.9	Confident	91.1	Very high	95 Å²	95	46.6 Å²	46.6	37%	0.373	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-107.9	6	-179.6	-64.6	-78.8	0	0	0	113.5	R1558 I1587 E1589 Y1593	R1558-Y1591 VanDerWaalsContact CZ-CZ 3.45Å; R1558-Y1591 VanDerWaalsContact NH1-CE1 3.35Å; R1558-Y1591 PolarHBondContact NH2-OH 3Å; I1587-Y1591 HydrophobicContact CG2-CD2 4.01Å; I1587-Y1591 HydrophobicContact CG2-CE2 4.46Å; I1587-Y1591 WeakPolarHBondContact O-CD2 3.12Å; I1587-Y1591 PolarHBondContact O-N 3.06Å; E1589-Y1591 PolarHBondContact O-N 2.96Å; Y1591-Y1593 PolarHBondContact O-N 2.76Å
1592	H	85.3	Confident	91.2	Very high	154 Å²	154	47.4 Å²	47.4	71%	0.713	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	47.2	56.9	-178.1	-58.8	-64	0	0	0	112.6	K1588 E1589 D1594	K1588-H1592 WeakPolarHBondContact O-CA 3.19Å; K1588-H1592 PolarHBondContact O-N 3.11Å; K1588-H1592 VanDerWaalsContact O-N 3.1Å; E1589-H1592 PolarHBondContact O-CE1 3.47Å; E1589-H1592 PolarHBondContact O-N 2.98Å; E1589-H1592 PolarHBondContact O-ND1 2.91Å; H1592-D1594 PolarHBondContact O-N 2.91Å
1593	Y	86.3	Confident	91.2	Very high	28 Å²	28	46.1 Å²	46.1	11%	0.11	23%	0.225	C	C	.	.			trans	-82.9	98.5	178.8	-69.6	-30.6	0	0	0	111.4	C1495 L1496 T1556 R1558 I1587 K1588 Y1591 G1595	C1495-Y1593 HydrophobicContact CB-CD1 3.64Å; C1495-Y1593 HydrophobicContact CB-CD2 4.21Å; C1495-Y1593 HydrophobicContact CB-CE1 3.42Å; C1495-Y1593 VanDerWaalsContact CB-CE1 3.42Å; C1495-Y1593 HydrophobicContact CB-CE2 4.03Å; C1495-Y1593 HydrophobicContact CB-CG 4.01Å; L1496-Y1593 HydrophobicContact CB-CD2 4.21Å; L1496-Y1593 HydrophobicContact CB-CE2 4.37Å; T1556-Y1593 PolarHBondContact O-OH 3.08Å; R1558-Y1593 PolarHBondContact NH1-OH 3.39Å; I1587-Y1593 HydrophobicContact CG2-CD2 4.27Å; I1587-Y1593 HydrophobicContact CG2-CE2 3.81Å; K1588-Y1593 WeakPolarHBondContact CE-O 3.41Å; K1588-Y1593 WeakPolarHBondContact CG-O 3.39Å; K1588-Y1593 PolarHBondContact O-N 2.92Å; Y1591-Y1593 PolarHBondContact O-N 2.76Å; Y1593-G1595 PolarHBondContact O-N 2.92Å
1594	D	83.1	Confident	91.3	Very high	158 Å²	158	44 Å²	44	85%	0.845	22%	0.215	S	C	*	.			trans	-70.7	-18.6	173.9	-57.5	-32	0	0	0	113.4	H1592	H1592-D1594 PolarHBondContact O-N 2.91Å
1595	G	88.9	Confident	91.3	Very high	15 Å²	15	44 Å²	44	16%	0.155	22%	0.215	C	C	.	.	S	Bend	trans	-77.2	154.4	-179	0	0	0	0	0	113.8	Y1593	Y1593-G1595 PolarHBondContact O-N 2.92Å
1596	P	95.5	Very high	91.5	Very high	20 Å²	20	43 Å²	43	13%	0.13	21%	0.211	C	C	.	.	P	Polyproline II helix	trans	-64.2	148.5	179.2	30.1	-37.4	0	0	0	111.9	F1461 N1469 A1470 I1472 K1492 S1494	F1461-P1596 HydrophobicContact CE1-CG 4.41Å; N1469-P1596 WeakPolarHBondContact O-CB 3.38Å; A1470-P1596 WeakPolarHBondContact O-CA 3.48Å; I1472-P1596 HydrophobicContact CD1-CB 4.23Å; I1472-P1596 HydrophobicContact CD1-CG 3.69Å; I1472-P1596 HydrophobicContact CG1-CB 4.07Å; I1472-P1596 HydrophobicContact CG1-CG 4.07Å; K1492-P1596 VanDerWaalsContact O-CD 3.24Å; K1492-P1596 WeakPolarHBondContact O-CD 3.3Å; S1494-P1596 WeakPolarHBondContact CA-O 3.44Å; S1494-P1596 WeakPolarHBondContact CB-O 3.29Å; S1494-P1596 PolarHBondContact OG-O 3.09Å
1597	I	97	Very high	91.6	Very high	5 Å²	5	39.6 Å²	39.6	3%	0.026	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	118.1	176.6	-55.6	169.8	0	0	0	108.5	A1470 Y1471 I1472 L1496 V1498 V1584 K1588 I1599	A1470-I1597 PolarHBondContact O-N 3.35Å; Y1471-I1597 WeakPolarHBondContact CA-O 3.37Å; Y1471-I1597 HydrophobicContact CD1-CB 4.03Å; Y1471-I1597 HydrophobicContact CE1-CB 4.4Å; Y1471-I1597 HydrophobicContact CE1-CD1 4.16Å; I1472-I1597 PolarHBondContact N-O 3.44Å; L1496-I1597 HydrophobicContact CB-CG1 4.33Å; L1496-I1597 HydrophobicContact CB-CG2 4.27Å; L1496-I1597 HydrophobicContact CD2-CD1 4.09Å; L1496-I1597 HydrophobicContact CD2-CG1 4.11Å; L1496-I1597 HydrophobicContact CD2-CG2 4.23Å; L1496-I1597 HydrophobicContact CG-CG2 4.14Å; V1498-I1597 HydrophobicContact CG2-CG2 3.82Å; V1584-I1597 HydrophobicContact CG1-CD1 3.82Å; V1584-I1597 HydrophobicContact CG1-CG2 4.42Å; K1588-I1597 HydrophobicContact CD-CD1 4.4Å; I1597-I1599 HydrophobicContact CG2-CD1 4.47Å; I1597-I1599 HydrophobicContact CG2-CG1 4.02Å; I1597-I1599 PolarHBondContact O-N 3.15Å
1598	T	97.9	Very high	91.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	112.9	178.6	-70.2	0	0	0	0	110.6	I1472 F1485 M1488 S1494 L1496 I1497 V1498	I1472-T1598 CarbonylContact O-C 3.59Å; F1485-T1598 HydrophobicContact CE2-CG2 3.75Å; F1485-T1598 HydrophobicContact CZ-CG2 4.06Å; M1488-T1598 HydrophobicContact CE-CG2 3.69Å; S1494-T1598 WeakPolarHBondContact CB-OG1 3.31Å; S1494-T1598 WeakPolarHBondContact OG-CB 3.1Å; S1494-T1598 PolarHBondContact OG-N 3.22Å; S1494-T1598 PolarHBondContact OG-OG1 3.41Å; L1496-T1598 PolarHBondContact O-N 3.18Å; I1497-T1598 CarbonylContact C-O 3.58Å; I1497-T1598 VanDerWaalsContact CA-O 3.25Å; I1497-T1598 WeakPolarHBondContact CA-O 3.27Å; I1497-T1598 HydrophobicContact CG2-CG2 4.44Å; V1498-T1598 PolarHBondContact N-O 2.96Å
1599	I	97.9	Very high	92.1	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	122	-175.6	-55.3	165.3	0	0	0	109.7	Y1471 I1472 C1474 V1498 L1500 I1597 T1608 F1611 I1612	Y1471-I1599 HydrophobicContact CD1-CD1 3.31Å; Y1471-I1599 HydrophobicContact CD1-CG1 4.37Å; Y1471-I1599 HydrophobicContact CE1-CD1 3.91Å; Y1471-I1599 HydrophobicContact CG-CD1 3.89Å; I1472-I1599 PolarHBondContact O-N 3.47Å; C1474-I1599 PolarHBondContact N-O 3.27Å; V1498-I1599 HydrophobicContact CB-CG1 4.12Å; V1498-I1599 HydrophobicContact CB-CG2 4.34Å; V1498-I1599 HydrophobicContact CG2-CG1 4.31Å; V1498-I1599 WeakPolarHBondContact O-CA 3.28Å; L1500-I1599 HydrophobicContact CD1-CG2 3.64Å; L1500-I1599 HydrophobicContact CG-CG2 4.37Å; I1597-I1599 HydrophobicContact CG2-CD1 4.47Å; I1597-I1599 HydrophobicContact CG2-CG1 4.02Å; I1597-I1599 PolarHBondContact O-N 3.15Å; I1599-T1608 HydrophobicContact CB-CG2 4.2Å; I1599-T1608 HydrophobicContact CG2-CG2 3.89Å; I1599-T1608 WeakPolarHBondContact O-CG2 3.5Å; I1599-F1611 HydrophobicContact CD1-CD1 3.68Å; I1599-F1611 HydrophobicContact CD1-CE1 3.71Å; I1599-F1611 HydrophobicContact CG1-CD1 4.45Å; I1599-F1611 HydrophobicContact CG1-CE1 4.4Å; I1599-F1611 HydrophobicContact CG2-CD1 4.2Å; I1599-I1612 HydrophobicContact CD1-CD1 3.9Å; I1599-I1612 HydrophobicContact CD1-CG1 3.55Å
1600	H	97.5	Very high	92.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	158.9	177.4	72.8	87.4	0	0	0	113.7	C1474 V1498 M1499 L1500 Y1514	C1474-H1600 WeakPolarHBondContact O-CA 3.45Å; C1474-H1600 VanDerWaalsContact O-CB 3.25Å; C1474-H1600 WeakPolarHBondContact O-CB 3.37Å; V1498-H1600 PolarHBondContact O-N 2.96Å; M1499-H1600 WeakPolarHBondContact CG-CE1 3.39Å; L1500-H1600 WeakPolarHBondContact CB-O 3.26Å; L1500-H1600 PolarHBondContact N-O 3.09Å; Y1514-H1600 AromaticContact CE1-CE1 3.7Å; Y1514-H1600 AromaticContact CE1-NE2 3.46Å; Y1514-H1600 WeakPolarHBondContact CE1-NE2 3.28Å; Y1514-H1600 AromaticContact CZ-NE2 3.57Å; Y1514-H1600 PolarHBondContact OH-NE2 3.21Å
1601	C	93.3	Very high	92.8	Very high	3 Å²	3	26.2 Å²	26.2	2%	0.02	13%	0.133	C	C	.	.			trans	-137.4	-140	165.6	60.2	0	0	0	0	106.3	G1476 L1500 G1604 R1607 T1608	G1476-C1601 WeakPolarHBondContact CA-O 3.41Å; G1476-C1601 PolarHBondContact N-O 2.82Å; L1500-C1601 HydrophobicContact CB-CB 4.13Å; C1601-G1604 PolarHBondContact SG-N 2.85Å; C1601-G1604 VanDerWaalsContact SG-N 3.37Å; C1601-R1607 HydrophobicContact CB-CB 3.8Å; C1601-R1607 HydrophobicContact CB-CG 4.31Å; C1601-T1608 PolarHBondContact N-OG1 2.96Å; C1601-T1608 PolarHBondContact SG-OG1 2.74Å
1602	S	93.3	Very high	93.2	Very high	29 Å²	29	21.7 Å²	21.7	20%	0.203	12%	0.115	C	C	.	.	S	Bend	trans	-76.4	-58.5	170.6	-159.3	0	0	0	0	112.5	R1431 G1476 K1510	R1431-S1602 WeakPolarHBondContact CD-O 3.38Å; G1476-S1602 PolarHBondContact N-O 3.04Å; G1476-S1602 VanDerWaalsContact N-O 3.13Å; K1510-S1602 WeakPolarHBondContact CA-OG 3.14Å; K1510-S1602 WeakPolarHBondContact O-CA 3.49Å; K1510-S1602 PolarHBondContact O-OG 2.95Å
1603	S	92	Very high	93.7	Very high	12 Å²	12	14.4 Å²	14.4	8%	0.084	8%	0.081	C	C	.	.	S	Bend	trans	-83	-20.2	-177.3	56.2	0	0	0	0	114.7	I1435 S1605 G1606 R1640 Q1645	I1435-S1603 WeakPolarHBondContact CG2-O 3.46Å; S1603-S1605 VanDerWaalsContact C-N 3.26Å; S1603-S1605 PolarHBondContact O-N 2.84Å; S1603-S1605 PolarHBondContact OG-N 2.97Å; S1603-G1606 PolarHBondContact OG-N 2.86Å; S1603-R1640 PolarHBondContact O-NH2 3.18Å; S1603-Q1645 PolarHBondContact OG-OE1 2.8Å
1604	G	92.9	Very high	94.2	Very high	0 Å²	0	13 Å²	13	0%	0	8%	0.076	C	C	.	.	S	Bend	trans	72.4	14.4	-167.7	0	0	0	0	0	114.6	C1474 C1601 T1608 R1640	C1474-G1604 WeakPolarHBondContact O-CA 3.29Å; C1601-G1604 PolarHBondContact SG-N 2.85Å; C1601-G1604 VanDerWaalsContact SG-N 3.37Å; G1604-T1608 WeakPolarHBondContact O-CB 3.26Å; G1604-R1640 WeakPolarHBondContact O-CD 3.42Å; G1604-R1640 PolarHBondContact O-NE 2.93Å
1605	S	92.3	Very high	94.7	Very high	0 Å²	0	5.6 Å²	5.6	0%	0	4%	0.036	C	C	.	.	S	Bend	trans	-129	-40.6	-178.7	-59.8	0	0	0	0	115	I1435 S1603 G1609 R1640 V1641 W1642 M1643 I1644	I1435-S1605 VanDerWaalsContact CG2-OG 3.25Å; I1435-S1605 WeakPolarHBondContact CG2-OG 3.42Å; S1603-S1605 VanDerWaalsContact C-N 3.26Å; S1603-S1605 PolarHBondContact O-N 2.84Å; S1603-S1605 PolarHBondContact OG-N 2.97Å; S1605-G1609 VanDerWaalsContact O-CA 3.28Å; S1605-G1609 WeakPolarHBondContact O-CA 3.32Å; S1605-G1609 PolarHBondContact O-N 2.89Å; S1605-R1640 PolarHBondContact OG-NE 3.47Å; S1605-V1641 WeakPolarHBondContact CB-O 3.3Å; S1605-V1641 PolarHBondContact OG-O 3.22Å; S1605-W1642 WeakPolarHBondContact CB-O 3.38Å; S1605-M1643 WeakPolarHBondContact O-CA 3.39Å; S1605-I1644 PolarHBondContact O-N 2.7Å; S1605-I1644 VanDerWaalsContact O-N 3.12Å
1606	G	92.1	Very high	94.9	Very high	2 Å²	2	5.6 Å²	5.6	2%	0.021	3%	0.033	C	C	.	.	H	α-helix	trans	-69.8	-80.3	-178	0	0	0	0	0	112.9	S1603 T1608 G1609 L1610 Q1645	S1603-G1606 PolarHBondContact OG-N 2.86Å; G1606-T1608 VanDerWaalsContact C-N 3.34Å; G1606-T1608 PolarHBondContact O-N 2.91Å; G1606-G1609 PolarHBondContact O-N 3.03Å; G1606-L1610 PolarHBondContact O-N 3.42Å; G1606-Q1645 VanDerWaalsContact CA-OE1 3.25Å
1607	R	93.8	Very high	94.9	Very high	30 Å²	30	4.7 Å²	4.7	11%	0.113	3%	0.027	C	C	.	.	H	α-helix	trans	-65.2	-37.3	179.6	-53.3	-174.3	173.7	148	3.7	112.3	L1500 C1501 E1505 W1565 C1601 L1610 F1611	L1500-R1607 HydrophobicContact CB-CB 4.05Å; L1500-R1607 HydrophobicContact CD1-CB 4.33Å; L1500-R1607 WeakPolarHBondContact CD1-O 3.34Å; L1500-R1607 WeakPolarHBondContact O-CD 3.31Å; L1500-R1607 PolarHBondContact O-NH1 2.92Å; C1501-R1607 VanDerWaalsContact CB-NH1 3.32Å; E1505-R1607 IonicContact OE1-CZ 3.29Å; E1505-R1607 IonicContact OE1-NH1 2.76Å; E1505-R1607 PolarHBondContact OE1-NH1 3.26Å; E1505-R1607 IonicContact OE1-NH2 3.54Å; E1505-R1607 PolarHBondContact OE1-NH2 3.19Å; E1505-R1607 IonicContact OE2-CZ 3.41Å; E1505-R1607 IonicContact OE2-NH1 3.23Å; E1505-R1607 PolarHBondContact OE2-NH1 3.22Å; E1505-R1607 IonicContact OE2-NH2 3.84Å; E1505-R1607 PolarHBondContact OE2-NH2 2.78Å; W1565-R1607 VanDerWaalsContact CD1-CZ 3.5Å; W1565-R1607 HydrophobicContact CD2-CG 3.99Å; W1565-R1607 VanDerWaalsContact CE2-CD 3.5Å; W1565-R1607 VanDerWaalsContact CE2-NE 3.3Å; W1565-R1607 HydrophobicContact CE3-CB 4.22Å; W1565-R1607 HydrophobicContact CE3-CG 4.13Å; W1565-R1607 VanDerWaalsContact CG-NE 3.31Å; W1565-R1607 HydrophobicContact CH2-CB 3.62Å; W1565-R1607 HydrophobicContact CH2-CG 3.64Å; W1565-R1607 HydrophobicContact CZ2-CB 4.05Å; W1565-R1607 HydrophobicContact CZ2-CG 3.49Å; W1565-R1607 VanDerWaalsContact CZ2-CG 3.49Å; W1565-R1607 HydrophobicContact CZ3-CB 3.73Å; W1565-R1607 HydrophobicContact CZ3-CG 3.97Å; W1565-R1607 VanDerWaalsContact NE1-NE 3.18Å; C1601-R1607 HydrophobicContact CB-CB 3.8Å; C1601-R1607 HydrophobicContact CB-CG 4.31Å; R1607-L1610 PolarHBondContact O-N 3.13Å; R1607-F1611 WeakPolarHBondContact O-CB 3.43Å; R1607-F1611 PolarHBondContact O-N 2.97Å
1608	T	96	Very high	94.7	Very high	0 Å²	0	4.8 Å²	4.8	0%	0	3%	0.027	C	C	.	.	H	α-helix	trans	-58.4	-45.8	172.4	-58.3	0	0	0	0	111.7	A1473 I1599 C1601 G1604 G1606 F1611 I1612	A1473-T1608 HydrophobicContact CB-CG2 3.63Å; I1599-T1608 HydrophobicContact CB-CG2 4.2Å; I1599-T1608 HydrophobicContact CG2-CG2 3.89Å; I1599-T1608 WeakPolarHBondContact O-CG2 3.5Å; C1601-T1608 PolarHBondContact N-OG1 2.96Å; C1601-T1608 PolarHBondContact SG-OG1 2.74Å; G1604-T1608 WeakPolarHBondContact O-CB 3.26Å; G1606-T1608 VanDerWaalsContact C-N 3.34Å; G1606-T1608 PolarHBondContact O-N 2.91Å; T1608-F1611 PolarHBondContact O-N 2.75Å; T1608-I1612 HydrophobicContact CG2-CD1 3.94Å; T1608-I1612 WeakPolarHBondContact O-CG1 3.26Å; T1608-I1612 PolarHBondContact O-N 3.18Å
1609	G	94.7	Very high	94.3	Very high	0 Å²	0	6 Å²	6	0%	0	3%	0.033	C	C	.	.	H	α-helix	trans	-65.3	-40.1	175.8	0	0	0	0	0	112.6	S1605 G1606 T1613	S1605-G1609 VanDerWaalsContact O-CA 3.28Å; S1605-G1609 WeakPolarHBondContact O-CA 3.32Å; S1605-G1609 PolarHBondContact O-N 2.89Å; G1606-G1609 PolarHBondContact O-N 3.03Å; G1609-T1613 VanDerWaalsContact O-CB 3.26Å; G1609-T1613 WeakPolarHBondContact O-CB 3.37Å; G1609-T1613 PolarHBondContact O-N 2.91Å; G1609-T1613 PolarHBondContact O-OG1 3Å
1610	L	95.3	Very high	93.9	Very high	0 Å²	0	6.2 Å²	6.2	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-61	-50	174.5	-171.8	154.1	0	0	0	111.2	W1565 L1570 L1577 G1606 R1607 T1613 M1614 I1644 Q1649 F1652	W1565-L1610 HydrophobicContact CH2-CB 4.26Å; W1565-L1610 HydrophobicContact CH2-CD1 3.88Å; W1565-L1610 HydrophobicContact CH2-CD2 3.94Å; W1565-L1610 HydrophobicContact CH2-CG 4.24Å; W1565-L1610 HydrophobicContact CZ2-CD1 4.22Å; W1565-L1610 HydrophobicContact CZ3-CD2 4.47Å; L1570-L1610 HydrophobicContact CD2-CD1 3.77Å; L1577-L1610 HydrophobicContact CD2-CD2 3.42Å; L1577-L1610 VanDerWaalsContact CD2-CD2 3.42Å; G1606-L1610 PolarHBondContact O-N 3.42Å; R1607-L1610 PolarHBondContact O-N 3.13Å; L1610-T1613 WeakPolarHBondContact O-CB 3.28Å; L1610-T1613 PolarHBondContact O-N 2.73Å; L1610-M1614 HydrophobicContact CD2-CG 4.11Å; L1610-M1614 WeakPolarHBondContact O-CG 3.36Å; L1610-M1614 PolarHBondContact O-N 3.29Å; L1610-I1644 HydrophobicContact CB-CD1 4.49Å; L1610-I1644 HydrophobicContact CB-CG1 4.37Å; L1610-Q1649 HydrophobicContact CD1-CB 3.83Å; L1610-Q1649 HydrophobicContact CD1-CG 3.88Å; L1610-F1652 HydrophobicContact CD1-CD1 3.95Å; L1610-F1652 HydrophobicContact CD2-CD1 4.21Å; L1610-F1652 HydrophobicContact CD2-CE1 4.44Å
1611	F	95.6	Very high	93.6	Very high	0 Å²	0	6.7 Å²	6.7	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-60.1	-48.6	179.3	-178.1	-81.5	0	0	0	112.2	V1498 L1500 L1577 L1580 I1581 V1584 I1599 R1607 T1608 T1613 M1614 C1615	V1498-F1611 HydrophobicContact CG1-CE2 4.16Å; V1498-F1611 HydrophobicContact CG1-CZ 4.21Å; V1498-F1611 HydrophobicContact CG2-CZ 4.46Å; L1500-F1611 HydrophobicContact CD1-CB 3.52Å; L1500-F1611 HydrophobicContact CD1-CD2 4.28Å; L1500-F1611 HydrophobicContact CD1-CG 3.97Å; L1500-F1611 HydrophobicContact CD2-CD2 3.84Å; L1500-F1611 HydrophobicContact CD2-CE2 4.47Å; L1500-F1611 HydrophobicContact CD2-CG 4.37Å; L1577-F1611 HydrophobicContact CD1-CD2 3.89Å; L1577-F1611 HydrophobicContact CD1-CE2 4.49Å; L1580-F1611 HydrophobicContact CD2-CD2 4.19Å; L1580-F1611 HydrophobicContact CD2-CE2 3.7Å; L1580-F1611 HydrophobicContact CG-CE2 3.97Å; I1581-F1611 HydrophobicContact CD1-CE2 4.44Å; I1581-F1611 HydrophobicContact CG1-CD2 4.15Å; I1581-F1611 HydrophobicContact CG1-CE2 3.56Å; I1581-F1611 HydrophobicContact CG1-CZ 3.85Å; V1584-F1611 HydrophobicContact CB-CZ 4.43Å; V1584-F1611 HydrophobicContact CG1-CZ 4.38Å; V1584-F1611 HydrophobicContact CG2-CZ 4.14Å; I1599-F1611 HydrophobicContact CD1-CD1 3.68Å; I1599-F1611 HydrophobicContact CD1-CE1 3.71Å; I1599-F1611 HydrophobicContact CG1-CD1 4.45Å; I1599-F1611 HydrophobicContact CG1-CE1 4.4Å; I1599-F1611 HydrophobicContact CG2-CD1 4.2Å; R1607-F1611 WeakPolarHBondContact O-CB 3.43Å; R1607-F1611 PolarHBondContact O-N 2.97Å; T1608-F1611 PolarHBondContact O-N 2.75Å; F1611-T1613 VanDerWaalsContact C-N 3.33Å; F1611-T1613 PolarHBondContact O-N 3.12Å; F1611-M1614 PolarHBondContact O-N 2.83Å; F1611-M1614 VanDerWaalsContact O-N 3.13Å; F1611-C1615 VanDerWaalsContact CE1-SG 3.51Å; F1611-C1615 PolarHBondContact O-N 3.25Å
1612	I	96.6	Very high	93.2	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-67.1	-35.5	179.1	-64.6	171.7	0	0	0	111.2	I1462 Y1471 A1473 I1599 T1608 M1614 C1615 N1616 L1636 M1643	I1462-I1612 HydrophobicContact CB-CD1 4.47Å; I1462-I1612 HydrophobicContact CG2-CD1 4.32Å; I1462-I1612 HydrophobicContact CG2-CG2 4.02Å; Y1471-I1612 HydrophobicContact CD2-CD1 4.33Å; Y1471-I1612 HydrophobicContact CD2-CG1 4.16Å; Y1471-I1612 HydrophobicContact CD2-CG2 3.71Å; Y1471-I1612 HydrophobicContact CE2-CG2 3.93Å; Y1471-I1612 HydrophobicContact CG-CD1 4.11Å; Y1471-I1612 HydrophobicContact CG-CG1 4.13Å; Y1471-I1612 HydrophobicContact CG-CG2 4.49Å; A1473-I1612 HydrophobicContact CB-CD1 4.22Å; I1599-I1612 HydrophobicContact CD1-CD1 3.9Å; I1599-I1612 HydrophobicContact CD1-CG1 3.55Å; T1608-I1612 HydrophobicContact CG2-CD1 3.94Å; T1608-I1612 WeakPolarHBondContact O-CG1 3.26Å; T1608-I1612 PolarHBondContact O-N 3.18Å; I1612-M1614 VanDerWaalsContact C-N 3.32Å; I1612-M1614 PolarHBondContact O-N 3.17Å; I1612-C1615 PolarHBondContact O-N 3.49Å; I1612-N1616 WeakPolarHBondContact O-CB 3.46Å; I1612-N1616 PolarHBondContact O-N 3.22Å; I1612-L1636 HydrophobicContact CB-CD1 4.5Å; I1612-L1636 HydrophobicContact CG2-CD1 4.15Å; I1612-L1636 HydrophobicContact CG2-CD2 3.62Å; I1612-M1643 HydrophobicContact CD1-CE 4.11Å
1613	T	96.5	Very high	92.6	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-59.9	-44.4	171.2	-57.4	0	0	0	0	110.5	G1609 L1610 F1611 N1616 V1617 M1629 T1632 V1633 L1636 I1644 C1653	G1609-T1613 VanDerWaalsContact O-CB 3.26Å; G1609-T1613 WeakPolarHBondContact O-CB 3.37Å; G1609-T1613 PolarHBondContact O-N 2.91Å; G1609-T1613 PolarHBondContact O-OG1 3Å; L1610-T1613 WeakPolarHBondContact O-CB 3.28Å; L1610-T1613 PolarHBondContact O-N 2.73Å; F1611-T1613 VanDerWaalsContact C-N 3.33Å; F1611-T1613 PolarHBondContact O-N 3.12Å; T1613-N1616 PolarHBondContact O-N 2.84Å; T1613-V1617 HydrophobicContact CG2-CG2 4.12Å; T1613-V1617 VanDerWaalsContact O-CB 3.28Å; T1613-V1617 WeakPolarHBondContact O-CB 3.5Å; T1613-V1617 VanDerWaalsContact O-CG2 3.27Å; T1613-V1617 WeakPolarHBondContact O-CG2 3.49Å; T1613-V1617 PolarHBondContact O-N 3.14Å; T1613-M1629 HydrophobicContact CG2-SD 3.5Å; T1613-M1629 WeakPolarHBondContact CG2-SD 3.5Å; T1613-T1632 HydrophobicContact CG2-CG2 4.25Å; T1613-V1633 HydrophobicContact CG2-CG2 3.67Å; T1613-L1636 WeakPolarHBondContact OG1-CD1 3.26Å; T1613-I1644 HydrophobicContact CG2-CD1 4.14Å; T1613-I1644 WeakPolarHBondContact OG1-CD1 3.25Å; T1613-C1653 HydrophobicContact CG2-CB 4.47Å
1614	M	95	Very high	92.1	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-64.4	-46.5	176.6	-66.8	-47.2	-51.8	0	0	112	L1577 I1581 L1610 F1611 I1612 N1616 V1617 L1618 C1653 T1656 T1657	L1577-M1614 HydrophobicContact CD2-CG 3.99Å; I1581-M1614 HydrophobicContact CD1-CB 3.49Å; I1581-M1614 VanDerWaalsContact CD1-CB 3.49Å; I1581-M1614 HydrophobicContact CD1-CG 4.48Å; L1610-M1614 HydrophobicContact CD2-CG 4.11Å; L1610-M1614 WeakPolarHBondContact O-CG 3.36Å; L1610-M1614 PolarHBondContact O-N 3.29Å; F1611-M1614 PolarHBondContact O-N 2.83Å; F1611-M1614 VanDerWaalsContact O-N 3.13Å; I1612-M1614 VanDerWaalsContact C-N 3.32Å; I1612-M1614 PolarHBondContact O-N 3.17Å; M1614-N1616 PolarHBondContact O-N 2.82Å; M1614-V1617 PolarHBondContact O-N 2.8Å; M1614-L1618 HydrophobicContact CB-CD1 4.34Å; M1614-L1618 HydrophobicContact CE-CD1 3.9Å; M1614-L1618 HydrophobicContact CE-CD2 3.83Å; M1614-L1618 HydrophobicContact CE-CG 3.81Å; M1614-L1618 VanDerWaalsContact O-CB 3.23Å; M1614-L1618 WeakPolarHBondContact O-CB 3.42Å; M1614-L1618 WeakPolarHBondContact O-CG 2.96Å; M1614-L1618 PolarHBondContact O-N 2.83Å; M1614-C1653 VanDerWaalsContact SD-CA 3.51Å; M1614-C1653 HydrophobicContact SD-CB 3.68Å; M1614-T1656 HydrophobicContact CE-CG2 3.48Å; M1614-T1656 VanDerWaalsContact CE-CG2 3.48Å; M1614-T1656 HydrophobicContact SD-CG2 4.21Å; M1614-T1657 WeakPolarHBondContact CE-OG1 3.41Å
1615	C	94.8	Very high	91.7	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.007	10%	0.096	C	C	.	.	H	α-helix	trans	-53.1	-54.8	173.4	-76.1	0	0	0	0	111.6	Y1471 F1611 I1612 V1617 L1618 E1619	Y1471-C1615 VanDerWaalsContact OH-CB 3.23Å; Y1471-C1615 WeakPolarHBondContact OH-CB 3.48Å; F1611-C1615 VanDerWaalsContact CE1-SG 3.51Å; F1611-C1615 PolarHBondContact O-N 3.25Å; I1612-C1615 PolarHBondContact O-N 3.49Å; C1615-V1617 PolarHBondContact O-N 2.93Å; C1615-L1618 PolarHBondContact O-N 3.4Å; C1615-E1619 WeakPolarHBondContact O-CB 3.43Å; C1615-E1619 PolarHBondContact O-N 2.99Å
1616	N	93.7	Very high	91.5	Very high	15 Å²	15	21 Å²	21	8%	0.08	10%	0.101	C	C	.	.	H	α-helix	trans	-65.2	-37.8	-176.4	-71.2	0.8	0	0	0	112.7	D1463 G1464 Y1465 I1612 T1613 M1614 R1620 T1632	D1463-N1616 PolarHBondContact O-ND2 3.18Å; D1463-N1616 VanDerWaalsContact O-ND2 3.13Å; G1464-N1616 WeakPolarHBondContact CA-OD1 3.2Å; Y1465-N1616 PolarHBondContact N-OD1 3.11Å; I1612-N1616 WeakPolarHBondContact O-CB 3.46Å; I1612-N1616 PolarHBondContact O-N 3.22Å; T1613-N1616 PolarHBondContact O-N 2.84Å; M1614-N1616 PolarHBondContact O-N 2.82Å; N1616-R1620 WeakPolarHBondContact O-CB 3.42Å; N1616-R1620 PolarHBondContact O-N 2.76Å; N1616-T1632 HydrophobicContact CB-CG2 3.96Å
1617	V	94.3	Very high	91.4	Very high	1 Å²	1	21 Å²	21	1%	0.006	10%	0.101	C	C	.	.	H	α-helix	trans	-73.7	-41.8	178.1	170.1	0	0	0	0	112.1	T1613 M1614 C1615 R1620 L1621 I1627 M1629 T1632 T1657	T1613-V1617 HydrophobicContact CG2-CG2 4.12Å; T1613-V1617 VanDerWaalsContact O-CB 3.28Å; T1613-V1617 WeakPolarHBondContact O-CB 3.5Å; T1613-V1617 VanDerWaalsContact O-CG2 3.27Å; T1613-V1617 WeakPolarHBondContact O-CG2 3.49Å; T1613-V1617 PolarHBondContact O-N 3.14Å; M1614-V1617 PolarHBondContact O-N 2.8Å; C1615-V1617 PolarHBondContact O-N 2.93Å; V1617-R1620 PolarHBondContact O-N 3.02Å; V1617-L1621 WeakPolarHBondContact O-CB 3.45Å; V1617-L1621 PolarHBondContact O-N 2.9Å; V1617-I1627 HydrophobicContact CG1-CG1 4.45Å; V1617-I1627 HydrophobicContact CG1-CG2 3.99Å; V1617-M1629 HydrophobicContact CG1-CE 4.09Å; V1617-M1629 HydrophobicContact CG2-CE 4.21Å; V1617-M1629 HydrophobicContact CG2-SD 3.85Å; V1617-T1632 HydrophobicContact CG2-CG2 4.08Å; V1617-T1657 HydrophobicContact CG1-CG2 3.81Å
1618	L	92.5	Very high	91.3	Very high	7 Å²	7	19.6 Å²	19.6	4%	0.037	10%	0.096	C	C	.	.	H	α-helix	trans	-70.9	-35.9	179.7	-60.8	175.5	0	0	0	111.1	I1578 I1581 M1614 C1615 L1621 R1622 T1657 Y1660	I1578-L1618 HydrophobicContact CG1-CD1 4.44Å; I1581-L1618 HydrophobicContact CD1-CD1 4.11Å; M1614-L1618 HydrophobicContact CB-CD1 4.34Å; M1614-L1618 HydrophobicContact CE-CD1 3.9Å; M1614-L1618 HydrophobicContact CE-CD2 3.83Å; M1614-L1618 HydrophobicContact CE-CG 3.81Å; M1614-L1618 VanDerWaalsContact O-CB 3.23Å; M1614-L1618 WeakPolarHBondContact O-CB 3.42Å; M1614-L1618 WeakPolarHBondContact O-CG 2.96Å; M1614-L1618 PolarHBondContact O-N 2.83Å; C1615-L1618 PolarHBondContact O-N 3.4Å; L1618-L1621 PolarHBondContact O-N 2.9Å; L1618-R1622 WeakPolarHBondContact O-CG 3.47Å; L1618-R1622 PolarHBondContact O-N 2.87Å; L1618-T1657 HydrophobicContact CD2-CG2 4.4Å; L1618-Y1660 HydrophobicContact CB-CE1 4.31Å; L1618-Y1660 HydrophobicContact CD2-CD1 3.44Å; L1618-Y1660 VanDerWaalsContact CD2-CD1 3.44Å; L1618-Y1660 HydrophobicContact CD2-CD2 4.21Å; L1618-Y1660 HydrophobicContact CD2-CE1 3.93Å; L1618-Y1660 HydrophobicContact CD2-CG 3.55Å
1619	E	89.8	Confident	91.2	Very high	27 Å²	27	19.6 Å²	19.6	13%	0.126	10%	0.096	C	C	.	.	H	α-helix	trans	-67.9	-45.7	172.6	-162.7	168.5	-105.7	0	0	111.3	Y1465 L1466 H1585 C1615 L1621 R1622 Q1623	Y1465-E1619 WeakPolarHBondContact CB-OE2 3.44Å; Y1465-E1619 HydrophobicContact CD1-CB 4.21Å; Y1465-E1619 HydrophobicContact CD1-CG 3.94Å; L1466-E1619 HydrophobicContact CD1-CG 4.18Å; L1466-E1619 HydrophobicContact CG-CG 4.14Å; L1466-E1619 WeakPolarHBondContact CG-OE2 3.28Å; L1466-E1619 PolarHBondContact N-OE2 2.77Å; H1585-E1619 IonicContact CE1-OE1 3.48Å; H1585-E1619 PolarHBondContact CE1-OE1 2.75Å; H1585-E1619 IonicContact ND1-OE1 2.74Å; C1615-E1619 WeakPolarHBondContact O-CB 3.43Å; C1615-E1619 PolarHBondContact O-N 2.99Å; E1619-L1621 VanDerWaalsContact C-N 3.3Å; E1619-L1621 PolarHBondContact O-N 3.34Å; E1619-R1622 PolarHBondContact O-N 2.78Å; E1619-Q1623 WeakPolarHBondContact O-CB 3.41Å; E1619-Q1623 VanDerWaalsContact O-CG 3.25Å; E1619-Q1623 WeakPolarHBondContact O-CG 3.2Å; E1619-Q1623 PolarHBondContact O-N 2.77Å; E1619-Q1623 VanDerWaalsContact O-N 3.08Å
1620	R	90	Very high	91.1	Very high	4 Å²	4	19.7 Å²	19.7	2%	0.015	10%	0.096	C	C	.	.	H	α-helix	trans	-58.7	-41	172.2	-174.7	166.8	-161.9	-140.8	-6.8	112.6	E1303 Y1465 N1616 V1617 Q1623 E1624	E1303-R1620 IonicContact OE2-CZ 2.78Å; E1303-R1620 VanDerWaalsContact OE2-CZ 3.26Å; E1303-R1620 IonicContact OE2-NH1 3.45Å; E1303-R1620 PolarHBondContact OE2-NH1 3.16Å; E1303-R1620 IonicContact OE2-NH2 2.72Å; E1303-R1620 PolarHBondContact OE2-NH2 2.75Å; Y1465-R1620 HydrophobicContact CD1-CB 4.4Å; Y1465-R1620 HydrophobicContact CD2-CB 3.72Å; Y1465-R1620 HydrophobicContact CD2-CG 4.13Å; Y1465-R1620 HydrophobicContact CE1-CB 4.22Å; Y1465-R1620 HydrophobicContact CE2-CB 3.52Å; Y1465-R1620 HydrophobicContact CE2-CG 3.46Å; Y1465-R1620 VanDerWaalsContact CE2-CG 3.46Å; Y1465-R1620 HydrophobicContact CG-CB 4.15Å; N1616-R1620 WeakPolarHBondContact O-CB 3.42Å; N1616-R1620 PolarHBondContact O-N 2.76Å; V1617-R1620 PolarHBondContact O-N 3.02Å; R1620-Q1623 PolarHBondContact O-N 2.72Å; R1620-E1624 IonicContact CZ-OE2 3.85Å; R1620-E1624 IonicContact NE-OE2 2.67Å; R1620-E1624 PolarHBondContact NE-OE2 2.98Å; R1620-E1624 IonicContact NH2-OE2 3.2Å; R1620-E1624 PolarHBondContact NH2-OE2 3.27Å; R1620-E1624 PolarHBondContact O-N 2.78Å
1621	L	90.3	Very high	90.9	Very high	10 Å²	10	19.8 Å²	19.8	5%	0.052	10%	0.096	C	C	.	.	H	α-helix	trans	-63	-43.9	179	178.7	56.9	0	0	0	111.8	A1306 V1617 L1618 E1619 Q1623 S1625 I1627 T1657 Y1660 L1661	A1306-L1621 HydrophobicContact CB-CD1 3.67Å; V1617-L1621 WeakPolarHBondContact O-CB 3.45Å; V1617-L1621 PolarHBondContact O-N 2.9Å; L1618-L1621 PolarHBondContact O-N 2.9Å; E1619-L1621 VanDerWaalsContact C-N 3.3Å; E1619-L1621 PolarHBondContact O-N 3.34Å; L1621-Q1623 VanDerWaalsContact C-N 3.32Å; L1621-Q1623 PolarHBondContact O-N 2.86Å; L1621-S1625 WeakPolarHBondContact O-CA 3.25Å; L1621-S1625 PolarHBondContact O-N 2.96Å; L1621-I1627 HydrophobicContact CD1-CD1 3.96Å; L1621-I1627 HydrophobicContact CD1-CG1 3.92Å; L1621-I1627 HydrophobicContact CD2-CD1 4.31Å; L1621-T1657 HydrophobicContact CD2-CG2 3.74Å; L1621-Y1660 HydrophobicContact CD2-CD1 3.88Å; L1621-Y1660 HydrophobicContact CD2-CE1 4.34Å; L1621-L1661 HydrophobicContact CD1-CD2 4.07Å; L1621-L1661 HydrophobicContact CD2-CD2 3.89Å; L1621-L1661 HydrophobicContact CD2-CG 3.89Å; L1621-L1661 HydrophobicContact CG-CD2 4.3Å
1622	R	85.9	Confident	90.7	Very high	150 Å²	150	20.3 Å²	20.3	57%	0.566	10%	0.1	S	C	*	.	H	α-helix	trans	-61.5	-37.6	173.6	-71.5	169.8	73.3	-176.6	0.7	112.5	L1618 E1619 Y1660	L1618-R1622 WeakPolarHBondContact O-CG 3.47Å; L1618-R1622 PolarHBondContact O-N 2.87Å; E1619-R1622 PolarHBondContact O-N 2.78Å; R1622-Y1660 WeakPolarHBondContact CD-OH 3.39Å; R1622-Y1660 HydrophobicContact CG-CE1 4.49Å
1623	Q	80.5	Confident	90.6	Very high	86 Å²	86	20.3 Å²	20.3	40%	0.402	10%	0.1	S	C	.	.	H	α-helix	trans	-91.4	-35.2	-171	-65.2	-71.2	3.7	0	0	114.7	Y1465 E1619 R1620 L1621	Y1465-Q1623 HydrophobicContact CE1-CB 3.85Å; Y1465-Q1623 HydrophobicContact CE1-CG 4Å; E1619-Q1623 WeakPolarHBondContact O-CB 3.41Å; E1619-Q1623 VanDerWaalsContact O-CG 3.25Å; E1619-Q1623 WeakPolarHBondContact O-CG 3.2Å; E1619-Q1623 PolarHBondContact O-N 2.77Å; E1619-Q1623 VanDerWaalsContact O-N 3.08Å; R1620-Q1623 PolarHBondContact O-N 2.72Å; L1621-Q1623 VanDerWaalsContact C-N 3.32Å; L1621-Q1623 PolarHBondContact O-N 2.86Å
1624	E	80.4	Confident	90.3	Very high	17 Å²	17	20.6 Å²	20.6	8%	0.079	10%	0.101	C	C	.	.	H	α-helix	trans	-120.3	-9.3	-175.4	-70.2	-171.1	147.4	0	0	114.5	R1245 Y1465 R1620 V1626	R1245-E1624 WeakPolarHBondContact CD-OE1 3.5Å; R1245-E1624 IonicContact CZ-OE1 3.11Å; R1245-E1624 IonicContact NE-OE1 3.24Å; R1245-E1624 PolarHBondContact NE-OE1 3.05Å; R1245-E1624 IonicContact NH1-OE1 3.12Å; R1245-E1624 IonicContact NH2-OE1 3Å; Y1465-E1624 VanDerWaalsContact OH-CG 3.24Å; Y1465-E1624 WeakPolarHBondContact OH-CG 3.25Å; Y1465-E1624 PolarHBondContact OH-OE2 3.02Å; R1620-E1624 IonicContact CZ-OE2 3.85Å; R1620-E1624 IonicContact NE-OE2 2.67Å; R1620-E1624 PolarHBondContact NE-OE2 2.98Å; R1620-E1624 IonicContact NH2-OE2 3.2Å; R1620-E1624 PolarHBondContact NH2-OE2 3.27Å; R1620-E1624 PolarHBondContact O-N 2.78Å; E1624-V1626 HydrophobicContact CB-CG2 3.85Å; E1624-V1626 PolarHBondContact O-N 3.03Å
1625	S	85.7	Confident	90	Very high	73 Å²	73	22 Å²	22	51%	0.51	11%	0.108	S	C	.	.	S	Bend	trans	56.7	26.1	-173.9	-61.7	0	0	0	0	114.7	A1306 L1621	A1306-S1625 WeakPolarHBondContact CB-O 3.32Å; A1306-S1625 PolarHBondContact N-O 2.91Å; L1621-S1625 WeakPolarHBondContact O-CA 3.25Å; L1621-S1625 PolarHBondContact O-N 2.96Å
1626	V	87.7	Confident	89.9	Confident	18 Å²	18	22.1 Å²	22.1	11%	0.109	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	158.7	174.8	-55.8	0	0	0	0	111	E1303 V1304 E1624	E1303-V1626 HydrophobicContact CG-CB 3.93Å; E1303-V1626 HydrophobicContact CG-CG2 4.04Å; V1304-V1626 CarbonylContact O-C 3.59Å; V1304-V1626 WeakPolarHBondContact O-CA 3.2Å; E1624-V1626 HydrophobicContact CB-CG2 3.85Å; E1624-V1626 PolarHBondContact O-N 3.03Å
1627	I	90.8	Very high	89.7	Confident	2 Å²	2	21.9 Å²	21.9	1%	0.01	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	128.2	-176.9	-62.7	159.3	0	0	0	107.3	E1303 V1304 L1309 V1617 L1621 M1629 T1657 L1661	E1303-I1627 WeakPolarHBondContact CA-O 3.16Å; V1304-I1627 PolarHBondContact N-O 3.15Å; V1304-I1627 PolarHBondContact O-N 3.03Å; L1309-I1627 HydrophobicContact CB-CD1 4.14Å; L1309-I1627 HydrophobicContact CD1-CD1 3.72Å; L1309-I1627 HydrophobicContact CD1-CG2 4.31Å; L1309-I1627 HydrophobicContact CD2-CD1 3.65Å; L1309-I1627 HydrophobicContact CG-CD1 4.01Å; V1617-I1627 HydrophobicContact CG1-CG1 4.45Å; V1617-I1627 HydrophobicContact CG1-CG2 3.99Å; L1621-I1627 HydrophobicContact CD1-CD1 3.96Å; L1621-I1627 HydrophobicContact CD1-CG1 3.92Å; L1621-I1627 HydrophobicContact CD2-CD1 4.31Å; I1627-M1629 HydrophobicContact CG2-CE 4.41Å; I1627-T1657 HydrophobicContact CD1-CG2 3.5Å; I1627-T1657 VanDerWaalsContact CD1-CG2 3.5Å; I1627-T1657 HydrophobicContact CG1-CG2 4.06Å; I1627-L1661 HydrophobicContact CD1-CD1 4.38Å
1628	D	91.1	Very high	89.3	Confident	1 Å²	1	22.9 Å²	22.9	1%	0.005	11%	0.111	C	C	.	.			trans	-134	83.8	169.4	-166.3	-28.2	0	0	0	107.9	R1244 T1302 E1303 Y1630 Q1631 T1632	R1244-D1628 IonicContact NH1-OD2 3.62Å; R1244-D1628 PolarHBondContact NH1-OD2 3.24Å; R1244-D1628 VanDerWaalsContact NH1-OD2 3.08Å; T1302-D1628 VanDerWaalsContact CB-OD1 3.29Å; T1302-D1628 WeakPolarHBondContact CB-OD1 3.13Å; T1302-D1628 PolarHBondContact OG1-OD1 3.01Å; T1302-D1628 PolarHBondContact OG1-OD2 3.26Å; E1303-D1628 HydrophobicContact CB-CB 4.14Å; E1303-D1628 HydrophobicContact CG-CB 4.39Å; E1303-D1628 PolarHBondContact N-OD2 2.8Å; D1628-Y1630 VanDerWaalsContact C-N 3.28Å; D1628-Y1630 PolarHBondContact O-N 3.13Å; D1628-Q1631 HydrophobicContact CB-CB 4.44Å; D1628-Q1631 VanDerWaalsContact CG-CG 3.47Å; D1628-Q1631 WeakPolarHBondContact OD1-CB 3.16Å; D1628-Q1631 VanDerWaalsContact OD1-CG 3.31Å; D1628-Q1631 WeakPolarHBondContact OD1-CG 3.23Å; D1628-Q1631 PolarHBondContact OD1-N 3.4Å; D1628-Q1631 WeakPolarHBondContact OD2-CG 3.49Å; D1628-T1632 WeakPolarHBondContact O-CB 3.27Å; D1628-T1632 PolarHBondContact O-N 3.17Å; D1628-T1632 VanDerWaalsContact O-N 3.08Å; D1628-T1632 PolarHBondContact O-OG1 2.98Å
1629	M	93.9	Very high	89.2	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-62.4	-41	-176.9	-163.6	68.9	65.1	0	0	110.8	T1613 V1617 I1627 T1632 V1633 Y1650 C1653 Y1654	T1613-M1629 HydrophobicContact CG2-SD 3.5Å; T1613-M1629 WeakPolarHBondContact CG2-SD 3.5Å; V1617-M1629 HydrophobicContact CG1-CE 4.09Å; V1617-M1629 HydrophobicContact CG2-CE 4.21Å; V1617-M1629 HydrophobicContact CG2-SD 3.85Å; I1627-M1629 HydrophobicContact CG2-CE 4.41Å; M1629-T1632 PolarHBondContact O-N 3.02Å; M1629-V1633 WeakPolarHBondContact O-CG2 3.07Å; M1629-V1633 PolarHBondContact O-N 2.86Å; M1629-Y1650 HydrophobicContact CB-CE2 4.37Å; M1629-Y1650 HydrophobicContact CG-CD2 4.3Å; M1629-Y1650 HydrophobicContact CG-CE2 3.64Å; M1629-C1653 HydrophobicContact CE-CB 3.63Å; M1629-C1653 HydrophobicContact CG-CB 4.44Å; M1629-C1653 HydrophobicContact SD-CB 3.43Å; M1629-C1653 WeakPolarHBondContact SD-CB 3.24Å; M1629-Y1654 HydrophobicContact CB-CD2 4.09Å; M1629-Y1654 HydrophobicContact CB-CE1 4.25Å; M1629-Y1654 HydrophobicContact CB-CE2 3.37Å; M1629-Y1654 VanDerWaalsContact CB-CZ 3.48Å; M1629-Y1654 HydrophobicContact CE-CD2 4.22Å; M1629-Y1654 HydrophobicContact CE-CG 4.25Å; M1629-Y1654 HydrophobicContact CG-CD2 3.79Å; M1629-Y1654 HydrophobicContact CG-CE2 3.48Å; M1629-Y1654 VanDerWaalsContact CG-CE2 3.48Å
1630	Y	92.7	Very high	89.3	Confident	1 Å²	1	22.3 Å²	22.3	0%	0.004	11%	0.109	C	C	.	.	H	α-helix	trans	-61.8	-53.3	-178	179.7	-91.5	0	0	0	111.7	D1299 T1302 E1375 K1378 I1379 L1382 D1628 T1632 V1633 K1634 Y1650	D1299-Y1630 HydrophobicContact CB-CE1 3.9Å; D1299-Y1630 VanDerWaalsContact CG-CE1 3.42Å; D1299-Y1630 WeakPolarHBondContact OD1-CE1 3.29Å; D1299-Y1630 PolarHBondContact OD1-OH 2.96Å; T1302-Y1630 HydrophobicContact CG2-CD1 3.8Å; T1302-Y1630 HydrophobicContact CG2-CG 3.83Å; E1375-Y1630 HydrophobicContact CG-CD2 3.47Å; E1375-Y1630 VanDerWaalsContact CG-CD2 3.47Å; E1375-Y1630 HydrophobicContact CG-CE2 4.09Å; E1375-Y1630 HydrophobicContact CG-CG 4.36Å; K1378-Y1630 HydrophobicContact CB-CE2 3.87Å; K1378-Y1630 WeakPolarHBondContact CB-OH 3.36Å; K1378-Y1630 HydrophobicContact CD-CE2 4.35Å; I1379-Y1630 HydrophobicContact CD1-CD2 3.73Å; I1379-Y1630 HydrophobicContact CD1-CE2 4.13Å; I1379-Y1630 HydrophobicContact CG1-CD2 3.5Å; I1379-Y1630 HydrophobicContact CG1-CE2 3.35Å; L1382-Y1630 WeakPolarHBondContact CD1-OH 3.3Å; D1628-Y1630 VanDerWaalsContact C-N 3.28Å; D1628-Y1630 PolarHBondContact O-N 3.13Å; Y1630-T1632 VanDerWaalsContact C-N 3.32Å; Y1630-T1632 PolarHBondContact O-N 3.32Å; Y1630-V1633 PolarHBondContact O-N 3.37Å; Y1630-K1634 HydrophobicContact CE1-CD 4.18Å; Y1630-K1634 WeakPolarHBondContact O-CB 3.15Å; Y1630-K1634 PolarHBondContact O-N 2.79Å; Y1630-Y1650 WeakPolarHBondContact CA-OH 3.35Å; Y1630-Y1650 WeakPolarHBondContact CB-OH 3.29Å; Y1630-Y1650 PolarHBondContact N-OH 3.39Å; Y1630-Y1650 VanDerWaalsContact N-OH 3.13Å
1631	Q	90.2	Very high	89.2	Confident	2 Å²	2	22.2 Å²	22.2	1%	0.009	11%	0.108	C	C	.	.	H	α-helix	trans	-67.4	-35.1	179.2	-60.2	-61.8	-22.5	0	0	111.1	M1241 D1299 T1302 D1628 K1634 L1635	M1241-Q1631 HydrophobicContact CG-CB 4.37Å; M1241-Q1631 HydrophobicContact CG-CG 4.5Å; M1241-Q1631 HydrophobicContact SD-CB 3.82Å; D1299-Q1631 PolarHBondContact OD2-NE2 3.23Å; D1299-Q1631 VanDerWaalsContact OD2-NE2 3.14Å; T1302-Q1631 WeakPolarHBondContact OG1-CG 3.31Å; D1628-Q1631 HydrophobicContact CB-CB 4.44Å; D1628-Q1631 VanDerWaalsContact CG-CG 3.47Å; D1628-Q1631 WeakPolarHBondContact OD1-CB 3.16Å; D1628-Q1631 VanDerWaalsContact OD1-CG 3.31Å; D1628-Q1631 WeakPolarHBondContact OD1-CG 3.23Å; D1628-Q1631 PolarHBondContact OD1-N 3.4Å; D1628-Q1631 WeakPolarHBondContact OD2-CG 3.49Å; Q1631-K1634 PolarHBondContact O-N 2.88Å; Q1631-L1635 WeakPolarHBondContact O-CB 3.17Å; Q1631-L1635 VanDerWaalsContact O-CG 3.24Å; Q1631-L1635 WeakPolarHBondContact O-CG 3.47Å; Q1631-L1635 PolarHBondContact O-N 3.32Å
1632	T	92.7	Very high	89	Confident	12 Å²	12	26.2 Å²	26.2	7%	0.074	12%	0.123	C	C	.	.	H	α-helix	trans	-61.1	-50	175.7	-53.8	0	0	0	0	111.7	T1613 N1616 V1617 D1628 M1629 Y1630 K1634 L1635 L1636	T1613-T1632 HydrophobicContact CG2-CG2 4.25Å; N1616-T1632 HydrophobicContact CB-CG2 3.96Å; V1617-T1632 HydrophobicContact CG2-CG2 4.08Å; D1628-T1632 WeakPolarHBondContact O-CB 3.27Å; D1628-T1632 PolarHBondContact O-N 3.17Å; D1628-T1632 VanDerWaalsContact O-N 3.08Å; D1628-T1632 PolarHBondContact O-OG1 2.98Å; M1629-T1632 PolarHBondContact O-N 3.02Å; Y1630-T1632 VanDerWaalsContact C-N 3.32Å; Y1630-T1632 PolarHBondContact O-N 3.32Å; T1632-K1634 VanDerWaalsContact C-N 3.34Å; T1632-K1634 PolarHBondContact O-N 3.19Å; T1632-L1635 PolarHBondContact O-N 2.78Å; T1632-L1636 HydrophobicContact CG2-CD1 4.46Å; T1632-L1636 WeakPolarHBondContact O-CG 3.2Å; T1632-L1636 PolarHBondContact O-N 2.69Å
1633	V	93.4	Very high	89.4	Confident	0 Å²	0	19 Å²	19	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-68.8	-34.3	179.7	175.4	0	0	0	0	111.6	I1379 T1613 M1629 Y1630 L1636 R1637 I1644 Y1650	I1379-V1633 HydrophobicContact CD1-CB 4.32Å; I1379-V1633 HydrophobicContact CD1-CG1 4.15Å; I1379-V1633 HydrophobicContact CG2-CG1 4.27Å; T1613-V1633 HydrophobicContact CG2-CG2 3.67Å; M1629-V1633 WeakPolarHBondContact O-CG2 3.07Å; M1629-V1633 PolarHBondContact O-N 2.86Å; Y1630-V1633 PolarHBondContact O-N 3.37Å; V1633-L1636 PolarHBondContact O-N 3.34Å; V1633-R1637 WeakPolarHBondContact O-CG 3.23Å; V1633-R1637 PolarHBondContact O-N 2.89Å; V1633-I1644 HydrophobicContact CG1-CB 4.12Å; V1633-I1644 HydrophobicContact CG2-CD1 3.75Å; V1633-I1644 HydrophobicContact CG2-CG1 4.48Å; V1633-Y1650 HydrophobicContact CB-CD2 4.43Å; V1633-Y1650 HydrophobicContact CB-CE2 4.06Å; V1633-Y1650 HydrophobicContact CG1-CD2 4.39Å; V1633-Y1650 HydrophobicContact CG1-CE2 4.41Å; V1633-Y1650 HydrophobicContact CG2-CD2 3.96Å; V1633-Y1650 HydrophobicContact CG2-CE2 3.77Å
1634	K	90	Very high	90	Very high	5 Å²	5	15 Å²	15	2%	0.022	8%	0.077	C	C	.	.	H	α-helix	trans	-62.7	-45.9	173	-176.2	-177.5	172.1	-169.2	0	112	T1237 E1295 D1299 L1382 Y1630 Q1631 T1632 R1637 Q1638	T1237-K1634 HydrophobicContact CG2-CD 3.93Å; T1237-K1634 HydrophobicContact CG2-CG 4.34Å; E1295-K1634 IonicContact OE1-NZ 3.43Å; E1295-K1634 PolarHBondContact OE1-NZ 3.3Å; E1295-K1634 IonicContact OE2-NZ 2.68Å; E1295-K1634 PolarHBondContact OE2-NZ 3.03Å; D1299-K1634 IonicContact OD2-NZ 2.71Å; D1299-K1634 PolarHBondContact OD2-NZ 3.07Å; L1382-K1634 HydrophobicContact CD1-CD 4.03Å; L1382-K1634 HydrophobicContact CD1-CG 4.42Å; Y1630-K1634 HydrophobicContact CE1-CD 4.18Å; Y1630-K1634 WeakPolarHBondContact O-CB 3.15Å; Y1630-K1634 PolarHBondContact O-N 2.79Å; Q1631-K1634 PolarHBondContact O-N 2.88Å; T1632-K1634 VanDerWaalsContact C-N 3.34Å; T1632-K1634 PolarHBondContact O-N 3.19Å; K1634-R1637 PolarHBondContact O-N 2.88Å; K1634-Q1638 WeakPolarHBondContact O-CG 3.48Å; K1634-Q1638 PolarHBondContact O-N 3.25Å
1635	L	89.3	Confident	90.4	Very high	30 Å²	30	17.7 Å²	17.7	16%	0.157	9%	0.09	C	C	.	.	H	α-helix	trans	-59.1	-46.4	174.2	-73.2	172.6	0	0	0	111.5	T1237 V1238 M1241 Q1631 T1632 R1637 Q1638 Q1639	T1237-L1635 HydrophobicContact CG2-CD2 3.69Å; T1237-L1635 HydrophobicContact CG2-CG 3.98Å; V1238-L1635 HydrophobicContact CG2-CD2 3.42Å; V1238-L1635 VanDerWaalsContact CG2-CD2 3.42Å; M1241-L1635 HydrophobicContact CE-CD1 4.48Å; M1241-L1635 HydrophobicContact SD-CD1 3.77Å; Q1631-L1635 WeakPolarHBondContact O-CB 3.17Å; Q1631-L1635 VanDerWaalsContact O-CG 3.24Å; Q1631-L1635 WeakPolarHBondContact O-CG 3.47Å; Q1631-L1635 PolarHBondContact O-N 3.32Å; T1632-L1635 PolarHBondContact O-N 2.78Å; L1635-R1637 VanDerWaalsContact C-N 3.29Å; L1635-R1637 PolarHBondContact O-N 3.45Å; L1635-Q1638 WeakPolarHBondContact O-CB 3.41Å; L1635-Q1638 PolarHBondContact O-N 3.38Å; L1635-Q1639 PolarHBondContact O-N 2.76Å
1636	L	92.6	Very high	90.6	Very high	4 Å²	4	16.6 Å²	16.6	2%	0.021	8%	0.08	C	C	.	.	H	α-helix	trans	-61.3	-37.7	177.2	-66.2	174.1	0	0	0	112	I1462 I1612 T1613 T1632 V1633 Q1638 Q1639 R1640 M1643	I1462-L1636 HydrophobicContact CG2-CD2 3.36Å; I1612-L1636 HydrophobicContact CB-CD1 4.5Å; I1612-L1636 HydrophobicContact CG2-CD1 4.15Å; I1612-L1636 HydrophobicContact CG2-CD2 3.62Å; T1613-L1636 WeakPolarHBondContact OG1-CD1 3.26Å; T1632-L1636 HydrophobicContact CG2-CD1 4.46Å; T1632-L1636 WeakPolarHBondContact O-CG 3.2Å; T1632-L1636 PolarHBondContact O-N 2.69Å; V1633-L1636 PolarHBondContact O-N 3.34Å; L1636-Q1638 VanDerWaalsContact C-N 3.32Å; L1636-Q1638 PolarHBondContact O-N 2.82Å; L1636-Q1639 CarbonylContact O-C 3.58Å; L1636-Q1639 PolarHBondContact O-N 2.68Å; L1636-Q1639 VanDerWaalsContact O-N 3.14Å; L1636-R1640 PolarHBondContact O-N 3.12Å; L1636-M1643 HydrophobicContact CB-CB 3.87Å; L1636-M1643 HydrophobicContact CB-CE 4.3Å; L1636-M1643 HydrophobicContact CB-CG 4.19Å; L1636-M1643 HydrophobicContact CD2-CE 4.33Å; L1636-M1643 WeakPolarHBondContact O-CG 3.45Å
1637	R	90.9	Very high	90.7	Very high	10 Å²	10	18.6 Å²	18.6	4%	0.038	9%	0.088	C	C	.	.	H	α-helix	trans	-70.6	-23.7	174.1	-75.8	-172.1	178.9	-164	11.3	114.5	N1380 S1383 V1633 K1634 L1635 R1640 M1643 I1644	N1380-R1637 PolarHBondContact OD1-NH1 2.78Å; N1380-R1637 PolarHBondContact OD1-NH2 2.82Å; N1380-R1637 VanDerWaalsContact OD1-NH2 3.11Å; S1383-R1637 PolarHBondContact OG-NH1 2.94Å; V1633-R1637 WeakPolarHBondContact O-CG 3.23Å; V1633-R1637 PolarHBondContact O-N 2.89Å; K1634-R1637 PolarHBondContact O-N 2.88Å; L1635-R1637 VanDerWaalsContact C-N 3.29Å; L1635-R1637 PolarHBondContact O-N 3.45Å; R1637-R1640 WeakPolarHBondContact CA-O 3.3Å; R1637-M1643 HydrophobicContact CG-CB 3.99Å; R1637-M1643 WeakPolarHBondContact CG-O 3.39Å; R1637-M1643 PolarHBondContact NE-O 3.42Å; R1637-I1644 PolarHBondContact NH2-O 3Å
1638	Q	86	Confident	90.7	Very high	22 Å²	22	24.5 Å²	24.5	10%	0.103	12%	0.115	C	C	.	.	H	α-helix	trans	-73.4	-17.8	170.6	-72	171.2	-16.4	0	0	112	Y1235 T1237 F1438 K1634 L1635 L1636	Y1235-Q1638 HydrophobicContact CD1-CG 3.9Å; Y1235-Q1638 HydrophobicContact CD2-CB 3.9Å; Y1235-Q1638 HydrophobicContact CD2-CG 3.91Å; Y1235-Q1638 HydrophobicContact CE1-CB 4.44Å; Y1235-Q1638 HydrophobicContact CE1-CG 3.73Å; Y1235-Q1638 HydrophobicContact CE2-CB 3.57Å; Y1235-Q1638 HydrophobicContact CE2-CG 3.76Å; Y1235-Q1638 HydrophobicContact CG-CB 4.45Å; Y1235-Q1638 VanDerWaalsContact CG-CD 3.41Å; Y1235-Q1638 HydrophobicContact CG-CG 3.95Å; T1237-Q1638 VanDerWaalsContact OG1-CD 3.27Å; T1237-Q1638 PolarHBondContact OG1-NE2 2.89Å; T1237-Q1638 PolarHBondContact OG1-OE1 3.43Å; F1438-Q1638 WeakPolarHBondContact CE2-O 3.34Å; K1634-Q1638 WeakPolarHBondContact O-CG 3.48Å; K1634-Q1638 PolarHBondContact O-N 3.25Å; L1635-Q1638 WeakPolarHBondContact O-CB 3.41Å; L1635-Q1638 PolarHBondContact O-N 3.38Å; L1636-Q1638 VanDerWaalsContact C-N 3.32Å; L1636-Q1638 PolarHBondContact O-N 2.82Å
1639	Q	89.3	Confident	90.8	Very high	22 Å²	22	25.6 Å²	25.6	10%	0.103	12%	0.12	C	C	.	.	H	α-helix	trans	-106.8	-27.1	178.9	-59.6	-174	-2.4	0	0	114.2	F1438 W1440 N1441 I1462 D1463 L1635 L1636	F1438-Q1639 VanDerWaalsContact CD2-O 3.3Å; F1438-Q1639 WeakPolarHBondContact CD2-O 3.38Å; W1440-Q1639 HydrophobicContact CH2-CG 4.1Å; W1440-Q1639 HydrophobicContact CZ2-CG 4.21Å; N1441-Q1639 PolarHBondContact ND2-O 2.95Å; N1441-Q1639 PolarHBondContact OD1-O 3.36Å; I1462-Q1639 HydrophobicContact CD1-CB 3.67Å; D1463-Q1639 PolarHBondContact OD2-NE2 2.84Å; L1635-Q1639 PolarHBondContact O-N 2.76Å; L1636-Q1639 CarbonylContact O-C 3.58Å; L1636-Q1639 PolarHBondContact O-N 2.68Å; L1636-Q1639 VanDerWaalsContact O-N 3.14Å
1640	R	91.4	Very high	90.8	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	12%	0.12	C	C	.	.	B	Isolated β-bridge	trans	-149	140	169.4	-178.6	172.2	177.4	86.1	1.8	111.6	N1458 S1460 I1462 A1473 S1603 G1604 S1605 L1636 R1637 W1642 M1643	N1458-R1640 PolarHBondContact OD1-NH1 2.82Å; N1458-R1640 PolarHBondContact OD1-NH2 2.85Å; S1460-R1640 PolarHBondContact OG-NH1 2.91Å; I1462-R1640 HydrophobicContact CD1-CB 3.81Å; A1473-R1640 PolarHBondContact O-NH1 2.9Å; S1603-R1640 PolarHBondContact O-NH2 3.18Å; G1604-R1640 WeakPolarHBondContact O-CD 3.42Å; G1604-R1640 PolarHBondContact O-NE 2.93Å; S1605-R1640 PolarHBondContact OG-NE 3.47Å; L1636-R1640 PolarHBondContact O-N 3.12Å; R1637-R1640 WeakPolarHBondContact CA-O 3.3Å; R1640-W1642 PolarHBondContact O-N 3.43Å; R1640-M1643 HydrophobicContact CB-CG 3.85Å; R1640-M1643 HydrophobicContact CB-SD 4.16Å; R1640-M1643 HydrophobicContact CG-CG 4.39Å; R1640-M1643 HydrophobicContact CG-SD 4.32Å; R1640-M1643 VanDerWaalsContact O-CG 3.25Å; R1640-M1643 WeakPolarHBondContact O-CG 3.26Å
1641	V	87.7	Confident	90.8	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.012	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	138.3	-177.6	-58.3	0	0	0	0	111.7	P1384 I1386 I1435 V1436 F1438 S1605 M1643	P1384-V1641 HydrophobicContact CG-CG1 4.49Å; I1386-V1641 HydrophobicContact CD1-CB 4.35Å; I1386-V1641 HydrophobicContact CD1-CG1 4.06Å; I1386-V1641 HydrophobicContact CD1-CG2 4.33Å; I1435-V1641 HydrophobicContact CB-CG2 4.43Å; I1435-V1641 HydrophobicContact CG2-CG2 4.14Å; V1436-V1641 WeakPolarHBondContact O-CG2 3.2Å; F1438-V1641 HydrophobicContact CD1-CG1 4.31Å; F1438-V1641 HydrophobicContact CE1-CG1 3.45Å; F1438-V1641 VanDerWaalsContact CE1-CG1 3.45Å; F1438-V1641 HydrophobicContact CE2-CG1 4.32Å; F1438-V1641 HydrophobicContact CZ-CG1 3.45Å; F1438-V1641 VanDerWaalsContact CZ-CG1 3.45Å; S1605-V1641 WeakPolarHBondContact CB-O 3.3Å; S1605-V1641 PolarHBondContact OG-O 3.22Å; V1641-M1643 VanDerWaalsContact C-N 3.3Å; V1641-M1643 PolarHBondContact O-N 3.35Å
1642	W	88.1	Confident	90.9	Very high	93 Å²	93	32.2 Å²	32.2	35%	0.352	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.2	26	174.4	-56	105.2	0	0	0	116.5	S1605 R1640 I1644 Q1645	S1605-W1642 WeakPolarHBondContact CB-O 3.38Å; R1640-W1642 PolarHBondContact O-N 3.43Å; W1642-I1644 CarbonylContact O-C 3.53Å; W1642-I1644 PolarHBondContact O-N 3.21Å; W1642-Q1645 HydrophobicContact CB-CG 4.21Å; W1642-Q1645 WeakPolarHBondContact O-CG 3.28Å
1643	M	92.7	Very high	91	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	14%	0.142	C	C	.	.	S	Bend	trans	-57.1	125.2	170.5	-68.1	-70.3	-92.7	0	0	110.8	I1462 A1473 S1605 I1612 L1636 R1637 R1640 V1641	I1462-M1643 HydrophobicContact CD1-CE 4.36Å; I1462-M1643 HydrophobicContact CG1-CE 4.39Å; A1473-M1643 HydrophobicContact CB-CE 4.39Å; S1605-M1643 WeakPolarHBondContact O-CA 3.39Å; I1612-M1643 HydrophobicContact CD1-CE 4.11Å; L1636-M1643 HydrophobicContact CB-CB 3.87Å; L1636-M1643 HydrophobicContact CB-CE 4.3Å; L1636-M1643 HydrophobicContact CB-CG 4.19Å; L1636-M1643 HydrophobicContact CD2-CE 4.33Å; L1636-M1643 WeakPolarHBondContact O-CG 3.45Å; R1637-M1643 HydrophobicContact CG-CB 3.99Å; R1637-M1643 WeakPolarHBondContact CG-O 3.39Å; R1637-M1643 PolarHBondContact NE-O 3.42Å; R1640-M1643 HydrophobicContact CB-CG 3.85Å; R1640-M1643 HydrophobicContact CB-SD 4.16Å; R1640-M1643 HydrophobicContact CG-CG 4.39Å; R1640-M1643 HydrophobicContact CG-SD 4.32Å; R1640-M1643 VanDerWaalsContact O-CG 3.25Å; R1640-M1643 WeakPolarHBondContact O-CG 3.26Å; V1641-M1643 VanDerWaalsContact C-N 3.3Å; V1641-M1643 PolarHBondContact O-N 3.35Å
1644	I	92.9	Very high	91	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	14%	0.142	C	C	.	.	S	Bend	trans	55.3	105.8	-159.8	-65.9	-165.4	0	0	0	111.4	F1376 S1605 L1610 T1613 V1633 R1637 W1642 Q1649 C1653	F1376-I1644 HydrophobicContact CE2-CG2 4.16Å; S1605-I1644 PolarHBondContact O-N 2.7Å; S1605-I1644 VanDerWaalsContact O-N 3.12Å; L1610-I1644 HydrophobicContact CB-CD1 4.49Å; L1610-I1644 HydrophobicContact CB-CG1 4.37Å; T1613-I1644 HydrophobicContact CG2-CD1 4.14Å; T1613-I1644 WeakPolarHBondContact OG1-CD1 3.25Å; V1633-I1644 HydrophobicContact CG1-CB 4.12Å; V1633-I1644 HydrophobicContact CG2-CD1 3.75Å; V1633-I1644 HydrophobicContact CG2-CG1 4.48Å; R1637-I1644 PolarHBondContact NH2-O 3Å; W1642-I1644 CarbonylContact O-C 3.53Å; W1642-I1644 PolarHBondContact O-N 3.21Å; I1644-Q1649 HydrophobicContact CG2-CB 3.79Å; I1644-C1653 VanDerWaalsContact CD1-SG 3.57Å
1645	Q	88.8	Confident	91.1	Very high	75 Å²	75	33.9 Å²	33.9	35%	0.35	16%	0.157	S	C	.	.			trans	-91.2	-22.9	-169.5	-69.3	-173.4	-93.6	0	0	114.1	S1603 G1606 W1642	S1603-Q1645 PolarHBondContact OG-OE1 2.8Å; G1606-Q1645 VanDerWaalsContact CA-OE1 3.25Å; W1642-Q1645 HydrophobicContact CB-CG 4.21Å; W1642-Q1645 WeakPolarHBondContact O-CG 3.28Å
1646	T	90.3	Very high	91.3	Very high	50 Å²	50	32.5 Å²	32.5	31%	0.307	15%	0.149	S	C	.	.	S	Bend	trans	-129	156.3	-176.7	68.7	0	0	0	0	113.2	E1648 Q1649 Y1650	T1646-E1648 PolarHBondContact O-N 2.65Å; T1646-Q1649 WeakPolarHBondContact O-CB 3.43Å; T1646-Q1649 PolarHBondContact O-N 2.82Å; T1646-Q1649 WeakPolarHBondContact OG1-CG 3.44Å; T1646-Q1649 PolarHBondContact OG1-N 2.93Å; T1646-Q1649 VanDerWaalsContact OG1-N 3.14Å; T1646-Y1650 PolarHBondContact O-N 2.99Å; T1646-Y1650 VanDerWaalsContact O-N 3.11Å
1647	E	90.4	Very high	91.3	Very high	59 Å²	59	32.3 Å²	32.3	28%	0.276	15%	0.148	S	C	.	.	H	α-helix	trans	-59	-37.5	172	-177.3	-167.7	143.2	0	0	111.1	Q1373 F1376 Y1650 R1651	Q1373-E1647 VanDerWaalsContact CG-OE1 3.28Å; Q1373-E1647 WeakPolarHBondContact CG-OE1 3.26Å; Q1373-E1647 WeakPolarHBondContact CG-OE2 3.4Å; Q1373-E1647 PolarHBondContact NE2-OE1 2.69Å; F1376-E1647 HydrophobicContact CD1-CB 3.81Å; F1376-E1647 HydrophobicContact CD1-CG 4.5Å; F1376-E1647 HydrophobicContact CE1-CB 4.19Å; F1376-E1647 VanDerWaalsContact CE1-N 3.29Å; F1376-E1647 HydrophobicContact CG-CB 4.33Å; E1647-Y1650 WeakPolarHBondContact O-CB 3.36Å; E1647-Y1650 PolarHBondContact O-N 2.83Å; E1647-R1651 WeakPolarHBondContact O-CB 3.25Å; E1647-R1651 PolarHBondContact O-N 2.78Å
1648	E	91.2	Very high	91.3	Very high	126 Å²	126	33.2 Å²	33.2	59%	0.589	15%	0.154	S	C	*	.	H	α-helix	trans	-61.4	-45.3	177	-57.2	172.5	150.4	0	0	111.2	L1570 T1646 Y1650 R1651 F1652	L1570-E1648 HydrophobicContact CD1-CB 3.78Å; T1646-E1648 PolarHBondContact O-N 2.65Å; E1648-Y1650 VanDerWaalsContact C-N 3.31Å; E1648-Y1650 PolarHBondContact O-N 2.79Å; E1648-R1651 PolarHBondContact O-N 2.89Å; E1648-F1652 VanDerWaalsContact O-CB 3.26Å; E1648-F1652 WeakPolarHBondContact O-CB 3.47Å; E1648-F1652 PolarHBondContact O-N 2.84Å
1649	Q	92	Very high	91.5	Very high	24 Å²	24	34.9 Å²	34.9	11%	0.112	16%	0.163	C	C	.	.	H	α-helix	trans	-60.6	-40.7	174	-76.3	168.6	10.2	0	0	111.5	L1570 L1610 I1644 T1646 F1652 C1653	L1570-Q1649 HydrophobicContact CD2-CG 3.96Å; L1610-Q1649 HydrophobicContact CD1-CB 3.83Å; L1610-Q1649 HydrophobicContact CD1-CG 3.88Å; I1644-Q1649 HydrophobicContact CG2-CB 3.79Å; T1646-Q1649 WeakPolarHBondContact O-CB 3.43Å; T1646-Q1649 PolarHBondContact O-N 2.82Å; T1646-Q1649 WeakPolarHBondContact OG1-CG 3.44Å; T1646-Q1649 PolarHBondContact OG1-N 2.93Å; T1646-Q1649 VanDerWaalsContact OG1-N 3.14Å; Q1649-F1652 PolarHBondContact O-N 2.86Å; Q1649-C1653 PolarHBondContact O-N 3.01Å; Q1649-C1653 PolarHBondContact O-SG 2.94Å
1650	Y	93.7	Very high	91.5	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-65.4	-45.1	177.2	-170	-108.9	0	0	0	112.4	E1375 F1376 I1379 M1629 Y1630 V1633 T1646 E1647 E1648 F1652 C1653 Y1654	E1375-Y1650 HydrophobicContact CG-CE1 4.27Å; E1375-Y1650 VanDerWaalsContact OE1-CE1 3.28Å; E1375-Y1650 WeakPolarHBondContact OE1-CE1 3.23Å; E1375-Y1650 VanDerWaalsContact OE1-CZ 3.32Å; E1375-Y1650 PolarHBondContact OE1-OH 2.62Å; F1376-Y1650 HydrophobicContact CB-CD1 4.38Å; F1376-Y1650 HydrophobicContact CD2-CD1 4.33Å; F1376-Y1650 HydrophobicContact CD2-CD2 4.35Å; F1376-Y1650 AromaticContact CD2-CG 3.92Å; F1376-Y1650 HydrophobicContact CD2-CG 3.92Å; I1379-Y1650 HydrophobicContact CD1-CD2 4.21Å; I1379-Y1650 HydrophobicContact CD1-CE2 3.6Å; M1629-Y1650 HydrophobicContact CB-CE2 4.37Å; M1629-Y1650 HydrophobicContact CG-CD2 4.3Å; M1629-Y1650 HydrophobicContact CG-CE2 3.64Å; Y1630-Y1650 WeakPolarHBondContact CA-OH 3.35Å; Y1630-Y1650 WeakPolarHBondContact CB-OH 3.29Å; Y1630-Y1650 PolarHBondContact N-OH 3.39Å; Y1630-Y1650 VanDerWaalsContact N-OH 3.13Å; V1633-Y1650 HydrophobicContact CB-CD2 4.43Å; V1633-Y1650 HydrophobicContact CB-CE2 4.06Å; V1633-Y1650 HydrophobicContact CG1-CD2 4.39Å; V1633-Y1650 HydrophobicContact CG1-CE2 4.41Å; V1633-Y1650 HydrophobicContact CG2-CD2 3.96Å; V1633-Y1650 HydrophobicContact CG2-CE2 3.77Å; T1646-Y1650 PolarHBondContact O-N 2.99Å; T1646-Y1650 VanDerWaalsContact O-N 3.11Å; E1647-Y1650 WeakPolarHBondContact O-CB 3.36Å; E1647-Y1650 PolarHBondContact O-N 2.83Å; E1648-Y1650 VanDerWaalsContact C-N 3.31Å; E1648-Y1650 PolarHBondContact O-N 2.79Å; Y1650-F1652 VanDerWaalsContact C-N 3.35Å; Y1650-C1653 PolarHBondContact O-N 2.87Å; Y1650-Y1654 HydrophobicContact CD1-CE2 4.44Å; Y1650-Y1654 HydrophobicContact CE1-CD2 4.37Å; Y1650-Y1654 AromaticContact CE1-CE2 3.74Å; Y1650-Y1654 HydrophobicContact CE1-CE2 3.74Å; Y1650-Y1654 AromaticContact CZ-CE2 3.86Å
1651	R	92.9	Very high	91.3	Very high	124 Å²	124	37.1 Å²	37.1	47%	0.468	17%	0.173	S	C	.	.	H	α-helix	trans	-66.1	-36.1	176.2	-170.6	179.2	-176.9	-166.7	0.9	112.1	F1372 E1647 E1648 C1653 Y1654 T1655	F1372-R1651 HydrophobicContact CD1-CG 4.45Å; F1372-R1651 HydrophobicContact CD2-CG 4.34Å; F1372-R1651 HydrophobicContact CE1-CG 4.32Å; F1372-R1651 HydrophobicContact CE2-CG 4.2Å; F1372-R1651 HydrophobicContact CG-CG 4.47Å; F1372-R1651 HydrophobicContact CZ-CG 4.2Å; E1647-R1651 WeakPolarHBondContact O-CB 3.25Å; E1647-R1651 PolarHBondContact O-N 2.78Å; E1648-R1651 PolarHBondContact O-N 2.89Å; R1651-C1653 VanDerWaalsContact C-N 3.31Å; R1651-C1653 PolarHBondContact O-N 3.12Å; R1651-Y1654 WeakPolarHBondContact O-CB 3.37Å; R1651-Y1654 PolarHBondContact O-N 3.48Å; R1651-T1655 PolarHBondContact O-N 2.85Å; R1651-T1655 VanDerWaalsContact O-N 3.1Å
1652	F	93.3	Very high	91.2	Very high	18 Å²	18	40.9 Å²	40.9	8%	0.079	19%	0.194	C	C	.	.	H	α-helix	trans	-65.2	-32.5	176.8	-173.5	-92.2	0	0	0	112.7	L1570 P1571 L1577 L1610 E1648 Q1649 Y1650 T1655 T1656	L1570-F1652 HydrophobicContact CB-CD2 4.21Å; L1570-F1652 HydrophobicContact CB-CE2 4.48Å; L1570-F1652 HydrophobicContact CD1-CB 3.89Å; L1570-F1652 HydrophobicContact CD1-CD2 4.21Å; L1570-F1652 HydrophobicContact CD1-CG 4.23Å; L1570-F1652 HydrophobicContact CD2-CB 4.02Å; L1570-F1652 HydrophobicContact CD2-CD1 4.22Å; L1570-F1652 HydrophobicContact CD2-CD2 4.35Å; L1570-F1652 HydrophobicContact CD2-CG 3.93Å; P1571-F1652 HydrophobicContact CB-CZ 3.96Å; P1571-F1652 HydrophobicContact CG-CE1 4.48Å; P1571-F1652 HydrophobicContact CG-CZ 4.14Å; P1571-F1652 WeakPolarHBondContact O-CE2 3.33Å; L1577-F1652 HydrophobicContact CD2-CE1 4.02Å; L1610-F1652 HydrophobicContact CD1-CD1 3.95Å; L1610-F1652 HydrophobicContact CD2-CD1 4.21Å; L1610-F1652 HydrophobicContact CD2-CE1 4.44Å; E1648-F1652 VanDerWaalsContact O-CB 3.26Å; E1648-F1652 WeakPolarHBondContact O-CB 3.47Å; E1648-F1652 PolarHBondContact O-N 2.84Å; Q1649-F1652 PolarHBondContact O-N 2.86Å; Y1650-F1652 VanDerWaalsContact C-N 3.35Å; F1652-T1655 WeakPolarHBondContact CA-OG1 3.1Å; F1652-T1655 PolarHBondContact O-N 3.01Å; F1652-T1655 PolarHBondContact O-OG1 3.33Å; F1652-T1655 VanDerWaalsContact O-OG1 3.08Å; F1652-T1656 WeakPolarHBondContact CD1-OG1 3.47Å; F1652-T1656 WeakPolarHBondContact CE1-OG1 3.43Å; F1652-T1656 VanDerWaalsContact O-CB 3.3Å; F1652-T1656 WeakPolarHBondContact O-CB 3.42Å; F1652-T1656 PolarHBondContact O-N 3.19Å; F1652-T1656 PolarHBondContact O-OG1 3.17Å
1653	C	94.4	Very high	90.9	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-60.9	-47.7	171	-68	0	0	0	0	111.1	T1613 M1614 M1629 I1644 Q1649 Y1650 R1651 T1655 T1656 T1657	T1613-C1653 HydrophobicContact CG2-CB 4.47Å; M1614-C1653 VanDerWaalsContact SD-CA 3.51Å; M1614-C1653 HydrophobicContact SD-CB 3.68Å; M1629-C1653 HydrophobicContact CE-CB 3.63Å; M1629-C1653 HydrophobicContact CG-CB 4.44Å; M1629-C1653 HydrophobicContact SD-CB 3.43Å; M1629-C1653 WeakPolarHBondContact SD-CB 3.24Å; I1644-C1653 VanDerWaalsContact CD1-SG 3.57Å; Q1649-C1653 PolarHBondContact O-N 3.01Å; Q1649-C1653 PolarHBondContact O-SG 2.94Å; Y1650-C1653 PolarHBondContact O-N 2.87Å; R1651-C1653 VanDerWaalsContact C-N 3.31Å; R1651-C1653 PolarHBondContact O-N 3.12Å; C1653-T1655 PolarHBondContact O-N 3.04Å; C1653-T1656 PolarHBondContact O-N 2.73Å; C1653-T1657 PolarHBondContact O-N 3.19Å; C1653-T1657 PolarHBondContact O-OG1 2.67Å
1654	Y	94	Very high	90	Very high	1 Å²	1	43.7 Å²	43.7	0%	0.004	22%	0.215	C	C	.	.	H	α-helix	trans	-58.9	-44.1	177	-88.1	-86.3	0	0	0	113.2	L1309 H1312 I1313 L1316 F1372 E1375 M1629 Y1650 R1651 L1658	L1309-Y1654 HydrophobicContact CD1-CD1 3.9Å; L1309-Y1654 HydrophobicContact CD1-CE1 4.18Å; H1312-Y1654 AromaticContact CD2-CE1 3.61Å; H1312-Y1654 AromaticContact NE2-CE1 3.7Å; H1312-Y1654 AromaticContact NE2-CZ 3.85Å; H1312-Y1654 PolarHBondContact NE2-OH 3.2Å; I1313-Y1654 HydrophobicContact CD1-CD1 4.06Å; I1313-Y1654 WeakPolarHBondContact CD1-O 3.24Å; I1313-Y1654 HydrophobicContact CG1-CD1 3.66Å; I1313-Y1654 HydrophobicContact CG1-CG 4.28Å; L1316-Y1654 HydrophobicContact CD1-CE1 4.21Å; L1316-Y1654 HydrophobicContact CD1-CE2 4.28Å; F1372-Y1654 HydrophobicContact CD1-CD2 4.37Å; F1372-Y1654 HydrophobicContact CE1-CD1 4.45Å; F1372-Y1654 AromaticContact CE1-CD2 3.63Å; F1372-Y1654 HydrophobicContact CE1-CD2 3.63Å; F1372-Y1654 HydrophobicContact CE1-CE2 4.02Å; F1372-Y1654 AromaticContact CE1-CG 3.85Å; F1372-Y1654 HydrophobicContact CE1-CG 3.85Å; F1372-Y1654 HydrophobicContact CZ-CG 4.42Å; E1375-Y1654 PolarHBondContact OE1-OH 3.22Å; M1629-Y1654 HydrophobicContact CB-CD2 4.09Å; M1629-Y1654 HydrophobicContact CB-CE1 4.25Å; M1629-Y1654 HydrophobicContact CB-CE2 3.37Å; M1629-Y1654 VanDerWaalsContact CB-CZ 3.48Å; M1629-Y1654 HydrophobicContact CE-CD2 4.22Å; M1629-Y1654 HydrophobicContact CE-CG 4.25Å; M1629-Y1654 HydrophobicContact CG-CD2 3.79Å; M1629-Y1654 HydrophobicContact CG-CE2 3.48Å; M1629-Y1654 VanDerWaalsContact CG-CE2 3.48Å; Y1650-Y1654 HydrophobicContact CD1-CE2 4.44Å; Y1650-Y1654 HydrophobicContact CE1-CD2 4.37Å; Y1650-Y1654 AromaticContact CE1-CE2 3.74Å; Y1650-Y1654 HydrophobicContact CE1-CE2 3.74Å; Y1650-Y1654 AromaticContact CZ-CE2 3.86Å; R1651-Y1654 WeakPolarHBondContact O-CB 3.37Å; R1651-Y1654 PolarHBondContact O-N 3.48Å; Y1654-L1658 PolarHBondContact O-N 2.87Å; Y1654-L1658 VanDerWaalsContact O-N 3.15Å
1655	T	92.3	Very high	88.3	Confident	52 Å²	52	48.4 Å²	48.4	32%	0.319	24%	0.24	S	C	.	.	H	α-helix	trans	-67.3	-44	177.1	56	0	0	0	0	111.4	R1651 F1652 C1653 T1657 L1658 D1659	R1651-T1655 PolarHBondContact O-N 2.85Å; R1651-T1655 VanDerWaalsContact O-N 3.1Å; F1652-T1655 WeakPolarHBondContact CA-OG1 3.1Å; F1652-T1655 PolarHBondContact O-N 3.01Å; F1652-T1655 PolarHBondContact O-OG1 3.33Å; F1652-T1655 VanDerWaalsContact O-OG1 3.08Å; C1653-T1655 PolarHBondContact O-N 3.04Å; T1655-T1657 VanDerWaalsContact C-N 3.31Å; T1655-T1657 PolarHBondContact O-N 3.48Å; T1655-L1658 WeakPolarHBondContact O-CA 3.42Å; T1655-L1658 WeakPolarHBondContact O-CB 3.38Å; T1655-L1658 PolarHBondContact O-N 3.37Å; T1655-D1659 PolarHBondContact O-N 3.37Å
1656	T	92.8	Very high	86.2	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61.5	-37.2	177.4	-55.5	0	0	0	0	112.1	I1578 M1614 F1652 C1653 L1658 D1659 Y1660	I1578-T1656 HydrophobicContact CD1-CG2 3.87Å; I1578-T1656 HydrophobicContact CG1-CG2 3.81Å; M1614-T1656 HydrophobicContact CE-CG2 3.48Å; M1614-T1656 VanDerWaalsContact CE-CG2 3.48Å; M1614-T1656 HydrophobicContact SD-CG2 4.21Å; F1652-T1656 WeakPolarHBondContact CD1-OG1 3.47Å; F1652-T1656 WeakPolarHBondContact CE1-OG1 3.43Å; F1652-T1656 VanDerWaalsContact O-CB 3.3Å; F1652-T1656 WeakPolarHBondContact O-CB 3.42Å; F1652-T1656 PolarHBondContact O-N 3.19Å; F1652-T1656 PolarHBondContact O-OG1 3.17Å; C1653-T1656 PolarHBondContact O-N 2.73Å; T1656-L1658 VanDerWaalsContact C-N 3.33Å; T1656-D1659 PolarHBondContact O-N 2.77Å; T1656-Y1660 WeakPolarHBondContact O-CB 3.35Å; T1656-Y1660 PolarHBondContact O-N 2.82Å
1657	T	92.9	Very high	83.6	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-68.4	-31.6	174.7	-53.5	0	0	0	0	112.3	L1309 M1614 V1617 L1618 L1621 I1627 C1653 T1655 L1661	L1309-T1657 HydrophobicContact CD2-CG2 4Å; M1614-T1657 WeakPolarHBondContact CE-OG1 3.41Å; V1617-T1657 HydrophobicContact CG1-CG2 3.81Å; L1618-T1657 HydrophobicContact CD2-CG2 4.4Å; L1621-T1657 HydrophobicContact CD2-CG2 3.74Å; I1627-T1657 HydrophobicContact CD1-CG2 3.5Å; I1627-T1657 VanDerWaalsContact CD1-CG2 3.5Å; I1627-T1657 HydrophobicContact CG1-CG2 4.06Å; C1653-T1657 PolarHBondContact O-N 3.19Å; C1653-T1657 PolarHBondContact O-OG1 2.67Å; T1655-T1657 VanDerWaalsContact C-N 3.31Å; T1655-T1657 PolarHBondContact O-N 3.48Å; T1657-L1661 PolarHBondContact O-N 2.68Å; T1657-L1661 VanDerWaalsContact O-N 3.12Å
1658	L	91.5	Very high	80.9	Confident	29 Å²	29	56.8 Å²	56.8	15%	0.152	30%	0.299	C	S	.	.	H	α-helix	trans	-71.7	-44.8	173.1	-179	66	0	0	0	111.6	L1309 Y1310 I1313 Y1654 T1655 T1656 Y1660 L1661 N1662	L1309-L1658 HydrophobicContact CD2-CB 3.94Å; L1309-L1658 HydrophobicContact CD2-CD1 4.31Å; Y1310-L1658 HydrophobicContact CD2-CD1 4.33Å; Y1310-L1658 HydrophobicContact CD2-CD2 3.98Å; I1313-L1658 HydrophobicContact CD1-CB 4.09Å; I1313-L1658 HydrophobicContact CD1-CD2 4.23Å; Y1654-L1658 PolarHBondContact O-N 2.87Å; Y1654-L1658 VanDerWaalsContact O-N 3.15Å; T1655-L1658 WeakPolarHBondContact O-CA 3.42Å; T1655-L1658 WeakPolarHBondContact O-CB 3.38Å; T1655-L1658 PolarHBondContact O-N 3.37Å; T1656-L1658 VanDerWaalsContact C-N 3.33Å; L1658-Y1660 VanDerWaalsContact C-N 3.26Å; L1658-Y1660 PolarHBondContact O-N 3.04Å; L1658-L1661 WeakPolarHBondContact O-CB 3.31Å; L1658-L1661 PolarHBondContact O-N 3.31Å; L1658-L1661 VanDerWaalsContact O-N 3.12Å; L1658-N1662 PolarHBondContact O-N 3.31Å; L1658-N1662 PolarHBondContact O-ND2 3.5Å
1659	D	89	Confident	77.9	Confident	58 Å²	58	57 Å²	57	31%	0.31	30%	0.3	S	S	.	.	H	α-helix	trans	-56.5	-42.9	174.4	-60	-20.9	0	0	0	110.7	T1655 T1656 N1662 S1663	T1655-D1659 PolarHBondContact O-N 3.37Å; T1656-D1659 PolarHBondContact O-N 2.77Å; D1659-N1662 PolarHBondContact O-N 2.87Å; D1659-S1663 PolarHBondContact O-N 3.04Å
1660	Y	89.5	Confident	74.9	Confident	33 Å²	33	61.6 Å²	61.6	13%	0.129	33%	0.332	C	S	.	.	H	α-helix	trans	-61.5	-45.3	174.4	-173.2	-110.5	0	0	0	112.8	I1578 L1618 L1621 R1622 T1656 L1658 N1662 S1663 F1664	I1578-Y1660 HydrophobicContact CD1-CD2 4.15Å; I1578-Y1660 HydrophobicContact CG1-CD2 4.24Å; I1578-Y1660 HydrophobicContact CG2-CD2 3.65Å; I1578-Y1660 HydrophobicContact CG2-CE2 3.97Å; L1618-Y1660 HydrophobicContact CB-CE1 4.31Å; L1618-Y1660 HydrophobicContact CD2-CD1 3.44Å; L1618-Y1660 VanDerWaalsContact CD2-CD1 3.44Å; L1618-Y1660 HydrophobicContact CD2-CD2 4.21Å; L1618-Y1660 HydrophobicContact CD2-CE1 3.93Å; L1618-Y1660 HydrophobicContact CD2-CG 3.55Å; L1621-Y1660 HydrophobicContact CD2-CD1 3.88Å; L1621-Y1660 HydrophobicContact CD2-CE1 4.34Å; R1622-Y1660 WeakPolarHBondContact CD-OH 3.39Å; R1622-Y1660 HydrophobicContact CG-CE1 4.49Å; T1656-Y1660 WeakPolarHBondContact O-CB 3.35Å; T1656-Y1660 PolarHBondContact O-N 2.82Å; L1658-Y1660 VanDerWaalsContact C-N 3.26Å; L1658-Y1660 PolarHBondContact O-N 3.04Å; Y1660-N1662 VanDerWaalsContact C-N 3.34Å; Y1660-N1662 PolarHBondContact O-N 2.79Å; Y1660-S1663 WeakPolarHBondContact O-CB 3.38Å; Y1660-S1663 PolarHBondContact O-N 2.83Å; Y1660-S1663 PolarHBondContact O-OG 2.99Å; Y1660-F1664 AromaticContact CD1-CE2 3.73Å; Y1660-F1664 HydrophobicContact CD1-CE2 3.73Å; Y1660-F1664 HydrophobicContact CD2-CE2 4.29Å; Y1660-F1664 AromaticContact CE1-CE2 3.4Å; Y1660-F1664 HydrophobicContact CE1-CE2 3.4Å; Y1660-F1664 VanDerWaalsContact CE1-CE2 3.4Å; Y1660-F1664 AromaticContact CE1-CZ 3.85Å; Y1660-F1664 HydrophobicContact CE1-CZ 3.85Å; Y1660-F1664 AromaticContact CE2-CE2 3.97Å; Y1660-F1664 HydrophobicContact CE2-CE2 3.97Å; Y1660-F1664 HydrophobicContact CE2-CZ 4.3Å; Y1660-F1664 HydrophobicContact CG-CE2 4.21Å; Y1660-F1664 AromaticContact CZ-CE2 3.52Å; Y1660-F1664 AromaticContact CZ-CZ 3.67Å; Y1660-F1664 VanDerWaalsContact O-CD2 3.31Å; Y1660-F1664 WeakPolarHBondContact O-CD2 3.44Å
1661	L	87.9	Confident	71.9	Confident	35 Å²	35	69.4 Å²	69.4	18%	0.183	37%	0.368	C	S	.	.	H	α-helix	trans	-59.3	-44.9	177.1	-84.6	176.2	0	0	0	112.3	A1306 L1309 L1621 I1627 T1657 L1658 S1663 F1664	A1306-L1661 HydrophobicContact CB-CD1 4.1Å; A1306-L1661 HydrophobicContact CB-CD2 4.11Å; L1309-L1661 HydrophobicContact CB-CD1 4.19Å; L1309-L1661 HydrophobicContact CD2-CD1 3.76Å; L1621-L1661 HydrophobicContact CD1-CD2 4.07Å; L1621-L1661 HydrophobicContact CD2-CD2 3.89Å; L1621-L1661 HydrophobicContact CD2-CG 3.89Å; L1621-L1661 HydrophobicContact CG-CD2 4.3Å; I1627-L1661 HydrophobicContact CD1-CD1 4.38Å; T1657-L1661 PolarHBondContact O-N 2.68Å; T1657-L1661 VanDerWaalsContact O-N 3.12Å; L1658-L1661 WeakPolarHBondContact O-CB 3.31Å; L1658-L1661 PolarHBondContact O-N 3.31Å; L1658-L1661 VanDerWaalsContact O-N 3.12Å; L1661-S1663 PolarHBondContact O-N 3.38Å; L1661-S1663 VanDerWaalsContact O-N 3.1Å; L1661-F1664 PolarHBondContact O-N 2.8Å
1662	N	85.4	Confident	69	Low	82 Å²	82	70.8 Å²	70.8	44%	0.439	38%	0.384	S	S	.	.	H	α-helix	trans	-57.9	-27	179.6	-62	-27.1	0	0	0	112.4	L1658 D1659 Y1660 F1664	L1658-N1662 PolarHBondContact O-N 3.31Å; L1658-N1662 PolarHBondContact O-ND2 3.5Å; D1659-N1662 PolarHBondContact O-N 2.87Å; Y1660-N1662 VanDerWaalsContact C-N 3.34Å; Y1660-N1662 PolarHBondContact O-N 2.79Å; N1662-F1664 PolarHBondContact O-N 2.95Å
1663	S	82.3	Confident	65.9	Low	54 Å²	54	76.3 Å²	76.3	38%	0.378	41%	0.414	S	S	.	.	H	α-helix	trans	-68.3	-26.6	177.2	78.1	0	0	0	0	114.4	D1659 Y1660 L1661	D1659-S1663 PolarHBondContact O-N 3.04Å; Y1660-S1663 WeakPolarHBondContact O-CB 3.38Å; Y1660-S1663 PolarHBondContact O-N 2.83Å; Y1660-S1663 PolarHBondContact O-OG 2.99Å; L1661-S1663 PolarHBondContact O-N 3.38Å; L1661-S1663 VanDerWaalsContact O-N 3.1Å
1664	F	72.3	Confident	62.8	Low	97 Å²	97	82.5 Å²	82.5	43%	0.425	45%	0.445	S	S	.	.	H	α-helix	trans	-80.6	-36.2	179.5	-70.8	-91.6	0	0	0	113	Y1660 L1661 N1662 L1666 C1667 T1668	Y1660-F1664 AromaticContact CD1-CE2 3.73Å; Y1660-F1664 HydrophobicContact CD1-CE2 3.73Å; Y1660-F1664 HydrophobicContact CD2-CE2 4.29Å; Y1660-F1664 AromaticContact CE1-CE2 3.4Å; Y1660-F1664 HydrophobicContact CE1-CE2 3.4Å; Y1660-F1664 VanDerWaalsContact CE1-CE2 3.4Å; Y1660-F1664 AromaticContact CE1-CZ 3.85Å; Y1660-F1664 HydrophobicContact CE1-CZ 3.85Å; Y1660-F1664 AromaticContact CE2-CE2 3.97Å; Y1660-F1664 HydrophobicContact CE2-CE2 3.97Å; Y1660-F1664 HydrophobicContact CE2-CZ 4.3Å; Y1660-F1664 HydrophobicContact CG-CE2 4.21Å; Y1660-F1664 AromaticContact CZ-CE2 3.52Å; Y1660-F1664 AromaticContact CZ-CZ 3.67Å; Y1660-F1664 VanDerWaalsContact O-CD2 3.31Å; Y1660-F1664 WeakPolarHBondContact O-CD2 3.44Å; L1661-F1664 PolarHBondContact O-N 2.8Å; N1662-F1664 PolarHBondContact O-N 2.95Å; F1664-L1666 PolarHBondContact O-N 2.91Å; F1664-C1667 PolarHBondContact O-N 3.01Å; F1664-C1667 VanDerWaalsContact O-N 3.14Å; F1664-T1668 PolarHBondContact O-N 2.81Å; F1664-T1668 PolarHBondContact O-OG1 2.7Å
1665	D	57.1	Low	59.7	Low	99 Å²	99	91 Å²	91	53%	0.529	49%	0.485	S	S	.	.	H	α-helix	trans	-65.7	-31	177.7	-72.3	-24.9	0	0	0	111.3	T1668 Q1669	D1665-T1668 PolarHBondContact O-N 3.4Å; D1665-T1668 PolarHBondContact O-OG1 2.73Å; D1665-Q1669 PolarHBondContact O-N 3.23Å
1666	L	45.2	Very low	56.6	Low	141 Å²	141	93.7 Å²	93.7	74%	0.738	50%	0.502	S	S	*	.	H	α-helix	trans	-66.8	-30.9	173	-70.7	169.4	0	0	0	113.4	F1664	F1664-L1666 PolarHBondContact O-N 2.91Å
1667	C	36	Very low	53.5	Low	117 Å²	117	99.3 Å²	99.3	79%	0.791	54%	0.536	S	S	*	.	H	α-helix	trans	-86.5	-6.1	177.1	-78.4	0	0	0	0	114.5	F1664	F1664-C1667 PolarHBondContact O-N 3.01Å; F1664-C1667 VanDerWaalsContact O-N 3.14Å
1668	T	32.8	Very low	50.4	Low	102 Å²	102	106.7 Å²	106.7	63%	0.626	58%	0.576	S	S	*	*	H	α-helix	trans	-113.6	-4.3	-175.3	49	0	0	0	0	114.8	F1664 D1665	F1664-T1668 PolarHBondContact O-N 2.81Å; F1664-T1668 PolarHBondContact O-OG1 2.7Å; D1665-T1668 PolarHBondContact O-N 3.4Å; D1665-T1668 PolarHBondContact O-OG1 2.73Å
1669	Q	29.2	Very low	47.4	Very low	131 Å²	131	111.8 Å²	111.8	61%	0.612	61%	0.608	S	S	*	*			trans	-86.8	111.5	167.4	-63.9	-170.8	36.1	0	0	110.4	D1665	D1665-Q1669 PolarHBondContact O-N 3.23Å
1670	P	28.6	Very low	44.7	Very low	121 Å²	121	117.3 Å²	117.3	79%	0.786	64%	0.636	S	S	*	*	S	Bend		-142.8	37.7	101.7	40.7	-27.7	0	0	0	114.2
1671	Q	31.6	Very low	41.9	Very low	164 Å²	164	123.9 Å²	123.9	77%	0.766	67%	0.668	S	S	*	*	S	Bend	trans	-125.8	-6.8	179.3	-67.9	-164.1	-1.6	0	0	116.9
1672	L	30.4	Very low	39.1	Very low	153 Å²	153	129 Å²	129	80%	0.801	69%	0.694	S	S	*	*	S	Bend	trans	-89.7	0.1	177.3	-114.2	139.7	0	0	0	114.6	I1674	L1672-I1674 PolarHBondContact O-N 3.24Å
1673	L	28.7	Very low	36.6	Very low	133 Å²	133	131.7 Å²	131.7	70%	0.696	71%	0.709	S	S	*	*			trans	-90.6	43.4	174.4	-140.4	165.3	0	0	0	111.9
1674	I	29.8	Very low	34.2	Very low	130 Å²	130	134.8 Å²	134.8	67%	0.667	73%	0.731	S	S	*	*			trans	-130.4	46.7	174.5	-45.3	173.3	0	0	0	110.8	L1672	L1672-I1674 PolarHBondContact O-N 3.24Å
1675	Q	27.7	Very low	32.3	Very low	181 Å²	181	135.6 Å²	135.6	85%	0.846	75%	0.746	S	S	*	*	S	Bend	trans	-128.8	11.5	165.7	-79.6	-162.9	-24.9	0	0	113.8
1676	T	28.9	Very low	31.3	Very low	108 Å²	108	138.5 Å²	138.5	66%	0.663	76%	0.761	S	S	*	*			trans	-136	45	-173.6	54.1	0	0	0	0	113.8
1677	T	26.5	Very low	30.5	Very low	117 Å²	117	140 Å²	140	72%	0.718	77%	0.769	S	S	*	*			trans	-133.9	64.1	171.9	59.1	0	0	0	0	112.9
1678	N	28.1	Very low	30.2	Very low	156 Å²	156	144.2 Å²	144.2	83%	0.834	77%	0.774	S	S	*	*	S	Bend	trans	-143.2	135.8	148.9	-98.8	-36.3	0	0	0	108.5
1679	T	29	Very low	30	Very low	136 Å²	136	147 Å²	147	83%	0.834	78%	0.782	S	S	*	*	S	Bend	trans	49.4	81.2	180	43.6	0	0	0	0	117.1
1680	I	32.3	Very low	29.9	Very low	174 Å²	174	150.7 Å²	150.7	89%	0.892	80%	0.796	S	S	*	*				-158.4	145.5	114.9	-95.6	153.2	0	0	0	107.6
1681	Q	29.2	Very low	29.8	Very low	171 Å²	171	152.6 Å²	152.6	80%	0.799	80%	0.796	S	S	*	*			trans	-107.6	145.1	-179.1	-61	176.7	-51.7	0	0	110.7
1682	L	29.2	Very low	29.7	Very low	142 Å²	142	154.2 Å²	154.2	74%	0.743	80%	0.8	S	S	*	*				157.6	117.6	119.5	-82.8	162.7	0	0	0	113.6
1683	N	33	Very low	29.4	Very low	139 Å²	139	153 Å²	153	74%	0.743	80%	0.804	S	S	*	*			trans	44.1	103.1	138.8	-53.8	-4.1	0	0	0	120.7
1684	S	32.7	Very low	29.4	Very low	119 Å²	119	152.1 Å²	152.1	83%	0.832	81%	0.81	S	S	*	*				-172.2	151.9	93.7	-75.6	0	0	0	0	112.5
1685	P	32	Very low	29.3	Very low	114 Å²	114	155 Å²	155	74%	0.74	82%	0.82	S	S	*	*			trans	-103	147.3	-171.2	37.6	-32.5	0	0	0	114.5
1686	N	35.7	Very low	29.3	Very low	160 Å²	160	152.3 Å²	152.3	86%	0.856	82%	0.82	S	S	*	*			trans	-176.6	-12.6	135	-99.3	-21.2	0	0	0	117.4
1687	L	29.1	Very low	29.2	Very low	171 Å²	171	154.3 Å²	154.3	90%	0.895	83%	0.827	S	S	*	*			trans	-80.6	126.3	178.4	-95.4	74.5	0	0	0	113.3
1688	K	30.1	Very low	29.4	Very low	206 Å²	206	155.6 Å²	155.6	90%	0.896	83%	0.829	S	S	*	*			trans	-128.3	96.4	166.2	-77.8	178.4	177.8	169	0	109.7
1689	M	28	Very low	29.5	Very low	162 Å²	162	157.3 Å²	157.3	80%	0.798	83%	0.829	S	S	*	*			trans	-98.4	126.3	162.2	-83	-176.1	71.2	0	0	110.4
1690	K	27.4	Very low	29.4	Very low	208 Å²	208	156.5 Å²	156.5	90%	0.904	82%	0.824	S	S	*	*			trans	-101.9	115.5	163.5	-83	-178.3	173	177.9	0	107.9
1691	M	27.1	Very low	29.2	Very low	160 Å²	160	153.7 Å²	153.7	79%	0.788	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-101.8	134.2	156.2	-85.3	-174.2	155	0	0	109.3
1692	K	28.7	Very low	29.1	Very low	198 Å²	198	151.3 Å²	151.3	86%	0.861	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-95.2	137.2	170.5	-71.7	179.4	176.3	178.3	0	108.3
1693	S	25.1	Very low	29.1	Very low	127 Å²	127	152.3 Å²	152.3	89%	0.888	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-77	123.6	168.2	54	0	0	0	0	111
1694	S	28.5	Very low	28.7	Very low	115 Å²	115	154.7 Å²	154.7	80%	0.804	82%	0.817	S	S	*	*			trans	-140.5	137.1	163.8	49.2	0	0	0	0	108.9
1695	Q	26.8	Very low	28.7	Very low	191 Å²	191	156.7 Å²	156.7	89%	0.893	82%	0.818	S	S	*	*			trans	-73.4	147.7	-172.7	-60.6	161.8	-76.1	0	0	112.1
1696	C	27.4	Very low	28.7	Very low	125 Å²	125	158.6 Å²	158.6	85%	0.845	82%	0.822	S	S	*	*			trans	-148.3	136.8	154	-87.9	0	0	0	0	109.3
1697	N	28.2	Very low	28.5	Very low	149 Å²	149	159.9 Å²	159.9	80%	0.797	82%	0.82	S	S	*	*			trans	-91	148.8	157.7	-71.5	3.7	0	0	0	107.9
1698	D	29.8	Very low	28.7	Very low	144 Å²	144	158.7 Å²	158.7	77%	0.77	81%	0.814	S	S	*	*	S	Bend	trans	59	141	164.4	-54	-32.4	0	0	0	119.6
1699	K	30.1	Very low	28.8	Very low	193 Å²	193	159.4 Å²	159.4	84%	0.839	81%	0.813	S	S	*	*	S	Bend	trans	72.2	113.3	169	-54.2	175.9	-175.4	178.2	0	116.8
1700	T	27.8	Very low	29	Very low	118 Å²	118	160.4 Å²	160.4	72%	0.724	82%	0.816	S	S	*	*			trans	34.3	99.8	151	41.2	0	0	0	0	118.1
1701	V	27.9	Very low	29.3	Very low	115 Å²	115	158.2 Å²	158.2	70%	0.697	81%	0.813	S	S	*	*			trans	-81.7	113	158.2	-173.9	0	0	0	0	108.7	F1703	V1701-F1703 HydrophobicContact CB-CE2 4.45Å; V1701-F1703 HydrophobicContact CG1-CD1 4.44Å; V1701-F1703 HydrophobicContact CG1-CD2 3.93Å; V1701-F1703 HydrophobicContact CG1-CE1 4.03Å; V1701-F1703 HydrophobicContact CG1-CE2 3.47Å; V1701-F1703 VanDerWaalsContact CG1-CE2 3.47Å; V1701-F1703 HydrophobicContact CG1-CG 4.4Å; V1701-F1703 HydrophobicContact CG1-CZ 3.53Å
1702	V	26.5	Very low	29.7	Very low	122 Å²	122	157 Å²	157	74%	0.739	81%	0.809	S	S	*	*			trans	-97	126.1	166	177.5	0	0	0	0	107.6
1703	F	29	Very low	30	Very low	163 Å²	163	155.4 Å²	155.4	72%	0.715	81%	0.805	S	S	*	*			trans	-101.6	102.3	169.5	-70.7	-72	0	0	0	109.3	V1701	V1701-F1703 HydrophobicContact CB-CE2 4.45Å; V1701-F1703 HydrophobicContact CG1-CD1 4.44Å; V1701-F1703 HydrophobicContact CG1-CD2 3.93Å; V1701-F1703 HydrophobicContact CG1-CE1 4.03Å; V1701-F1703 HydrophobicContact CG1-CE2 3.47Å; V1701-F1703 VanDerWaalsContact CG1-CE2 3.47Å; V1701-F1703 HydrophobicContact CG1-CG 4.4Å; V1701-F1703 HydrophobicContact CG1-CZ 3.53Å
1704	E	25.1	Very low	30.3	Very low	188 Å²	188	153.7 Å²	153.7	88%	0.879	79%	0.793	S	S	*	*			trans	-87.3	123.1	162	-171.1	167.1	-138.5	0	0	107.6
1705	L	32.3	Very low	30.5	Very low	161 Å²	161	156.1 Å²	156.1	84%	0.843	79%	0.791	S	S	*	*			trans	-131.5	137.3	173.8	-97.1	168.9	0	0	0	108.8
1706	D	32.1	Very low	30.8	Very low	155 Å²	155	155 Å²	155	83%	0.829	79%	0.79	S	S	*	*			trans	-75	162.4	-161.4	-145.8	-19.9	0	0	0	113.2	D1708	D1706-D1708 PolarHBondContact O-N 3.03Å
1707	K	30.8	Very low	30.9	Very low	186 Å²	186	154.8 Å²	154.8	81%	0.809	79%	0.785	S	S	*	*			trans	-73.6	122	176.7	-65.7	173.5	-178.6	172	0	110.3
1708	D	34.5	Very low	31.1	Very low	146 Å²	146	160.6 Å²	160.6	78%	0.781	80%	0.803	S	S	*	*				177.6	168.7	126.7	-90.5	-15.9	0	0	0	110.9	D1706	D1706-D1708 PolarHBondContact O-N 3.03Å
1709	Y	32.3	Very low	31.2	Very low	221 Å²	221	161.4 Å²	161.4	87%	0.867	81%	0.805	S	S	*	*			trans	74.9	87.9	179.1	-70.1	-88.9	0	0	0	117.9
1710	E	31.5	Very low	31.3	Very low	183 Å²	183	159.7 Å²	159.7	86%	0.855	80%	0.803	S	S	*	*			trans	-63.5	144.7	148.6	-51.3	175	125.1	0	0	110.7
1711	L	33.8	Very low	31.4	Very low	163 Å²	163	162.1 Å²	162.1	85%	0.853	81%	0.807	S	S	*	*			trans	-170.6	93.1	139.1	-107.5	162.5	0	0	0	114.1
1712	N	36.2	Very low	31.7	Very low	133 Å²	133	164.8 Å²	164.8	71%	0.711	81%	0.814	S	S	*	*			trans	16.1	134.5	146.5	-73.1	-28.7	0	0	0	123.5
1713	H	33.4	Very low	32	Very low	165 Å²	165	167.5 Å²	167.5	76%	0.764	82%	0.819	S	S	*	*			trans	76.4	97.2	136.9	-76	-57.1	0	0	0	122.6
1714	S	32.7	Very low	32.2	Very low	92 Å²	92	167.8 Å²	167.8	64%	0.643	83%	0.826	S	S	*	*				88	150.3	112.5	77.4	0	0	0	0	121.8
1715	H	31.7	Very low	32.7	Very low	165 Å²	165	166.4 Å²	166.4	76%	0.764	82%	0.822	S	S	*	*			trans	63.4	85.4	165	-65.1	-70.6	0	0	0	119.6
1716	L	33.7	Very low	32.7	Very low	167 Å²	167	166.8 Å²	166.8	87%	0.874	82%	0.82	S	S	*	*			trans	-177	94.4	139.2	-98.1	152.8	0	0	0	106.6
1717	V	28.9	Very low	32.8	Very low	121 Å²	121	167.8 Å²	167.8	73%	0.733	82%	0.819	S	S	*	*				60.6	85.3	70.9	-172	0	0	0	0	112.7
1718	K	33.7	Very low	32.9	Very low	271 Å²	271	166.1 Å²	166.1	100%	1.178	82%	0.82	S	S	*	*				-157.8	0	100.9	-138	176.4	-175.8	179.1	0	112.5

Retrieved 1,718 of 1,718 residues in 1658 ms (Link to these results)

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