A0A3Q0KVH4_SCHMA Loading...

Kinesin motor domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KVH4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 2,010 aa.

						>A0A3Q0KVH4_SCHMA|A0A3Q0KVH4
MSSKFKKDSYNLKHSPFTPPPQPPSSSSSSLASSSPSSLLNKQNKKMIKYSVTFEQSINLKSLLPSTSSTSPSPSPSSPSSSSPISQCCTNLCYKQKNSYTFSYLLRINPPILPGDILNYIELNKSTSTISTSIMSRSNVNINSTGKVKVIVCINQDCNHSNHHHNNQGLAITATTALKTVGSLLSPNSPLNTIHLKMDRSTSDFSPISSSSSCIQIDENKRIITLLDPTPSRRRRGVGGAVRNYKFDNIVTQDTLKQEFCSMVLIDALTGVLKGKDSCILTIGHKATGKTHSMIGYDYSPMECGIIPCGISWLYQLLNYQKQRYNTRFSIRISAVEITGLNEEFRDLLANTKASYDEEYSDKSPSHYLQTTNRSIQQKNSTSSSSSSSLSSSMNKTSLGTNYEKAQTVSAQMIDKLSHICELRASTAEKAAYLLDTALSNRTIHNCNNLSGLSHMLFTLHLYQCKLENNSSEMSISGGRTKFHFLDLGCGRYGQHSIHVNNKCVEVENNSNSADCSKFNKNETNSNTTDSLSPTSSDLNINRNNVLKSPTSEDSTSNCTTTLSQESRNIEHRTLSKALSLSGIGSVLLALLTGRRQLPYYDSSLTYLLREAITGNQIQPCILAHISENVQYYTETLQVIQLATEINRLRRRKIMINHIGTLTKNRELSLPLTLNTSKSQEEIGSSTSNDTDNDLFHRNQSKYLHRRPRLGRLSYARSLGSCSSELDCTSSGEQSCDTVIYVGNNKLLAQSERRLSDSRITSYSIKNLGPRGLADGSIDMIDKTYSCKGSSELITLNNETIKQHSMNQNQRTTHMNELSTMNNCITIKRMIPRTNATVWPRIMNKTKSRKFLQSLTTTTTATSSSMKISETIMNIGEETWIDGPNVSLSSLVKQTNDIVNVSNCKDNLSVNDSSKVLFISNESLSLTQSPLSSTPPPLPPPPSYHNVVHNLIKDHIQTSFVSNTEESCEQMKEEPIINSVEAQNVHSTSIQHFNNTTHTTENHFSSNTMNSSFSTLENNPTDDNIPRALSDISECTEDAETIHESNSIKQSIINLSLQDELSTDLLTTKLLTFDNLCTSCQLPISSMLNEKQNHNISNLSTMTNTATTTNNNTRPTEVLLDIGRQIREASKCNNYTIPTSYVTTVNVPQYLNHLNEDEELILNLNGTKSSFINQLKQPITMHDMIVTSNSKNQITLSPSINFTENNEINNKTISQSPIVPFNTSINDQCQQQSNQQDYYNHNQMKDQYSIRSKLNTPIVDKKLTNNSLHNSNNNTTTTNNISNHNVTTNITNTTLNNSLFRVAEWVSSISTPYLCQSMNLDNTINCSLCNTCYINNSNSANDTTTTTTTTTTTTTTTTTTHNNSTTHSIHSITPSTFNDSAIGSSKYTKQNNSFINSIYISKGNEIFNNKQGISLYSSSLSVPPPSLLSSNNDTNIPFYSSHLIKSDHLCKIPQSHSTPIFLSTKETKLHNLQSSYSSYYQSLLPVSDNLLEDYKYNPNYNIGNQLNDQLVNHEQINQNQMTNLNLFHNHNYYQHHHHPHHQHHHHHDQQQQQQQHQHHNYHPRTYENGSNHNSNNGHNIPHICTSKHAHCIELYQQSINLDQQQRQEQKHKSIHPPPHPPHLYQPHICDKITTNMTTATTTTNTTTMNEFSSSVNYSNNNEEKTKMKLSLKFLTLPLFRSFRLRKKGKKENKVICKNEQNLCIRNTNTTNNTTNNNGMNKIEPIKLNSFNYSNCQKSNQLSSTICDHYHHHHLHHPLPPSPLPPPHPPHSPPPPPPLHTINLPTNLFVNNNNNPSTTMVTKNSIDQCNQKSYLFDQFNNQYSINNNLISKSNQQQQQQKSIQNQYNHNQYKLCYIENNELNQYKNDNHHLNLLNHSSSIGFNGISGKLSSSVCRSSRRGGGGCALGGGSGGGGPSSSGYESMHTGASELSLSHPDSASDCSGHVKEVLTRRPSLDKYRRRCNSQHHRRHHHHHHHNSKNLYQQQYQDEHHLQHLTTTSRILQSNDIKNE
					

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(Predicted Aligned Error values between residue pairs)

Download Structure 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	26.1	Very low	27.1	Very low	240 Å²	240	146.3 Å²	146.3	100%	1.182	72%	0.723	S	S	*	*				0	148.5	0	-74.2	-179	-177.2	0	0	107.5
2	S	28.2	Very low	27	Very low	92 Å²	92	146.2 Å²	146.2	64%	0.643	73%	0.726	S	S	*	*			cis	-140.9	153.5	-2.7	-100.1	0	0	0	0	108.4
3	S	24.6	Very low	26.8	Very low	80 Å²	80	148.8 Å²	148.8	56%	0.559	73%	0.73	S	S	*	*				53.2	125.5	73.4	134.5	0	0	0	0	110.8
4	K	28.6	Very low	27	Very low	184 Å²	184	149.2 Å²	149.2	80%	0.8	73%	0.73	S	S	*	*			cis	-164.4	162.6	23.8	-102.7	155.2	-172.2	174.4	0	107.1
5	F	25.8	Very low	27.3	Very low	154 Å²	154	145.8 Å²	145.8	68%	0.675	73%	0.727	S	S	*	*			cis	174.3	158.1	-21.5	-138.7	-80.8	0	0	0	106.2
6	K	27.7	Very low	28.4	Very low	163 Å²	163	143.1 Å²	143.1	71%	0.709	72%	0.723	S	S	*	*			trans	63.3	-178.7	155.3	-97.4	152.4	-169.3	166.3	0	114.1
7	K	29.3	Very low	28.6	Very low	169 Å²	169	145.5 Å²	145.5	74%	0.735	73%	0.728	S	S	*	*			cis	-144.7	147.7	-4.7	-118.4	177.6	171.2	-170.9	0	104.6
8	D	30.1	Very low	28.8	Very low	119 Å²	119	144.2 Å²	144.2	64%	0.636	73%	0.729	S	S	*	*			cis	-139.6	136.3	7.3	-101	-54.3	0	0	0	108.4
9	S	29.1	Very low	29.6	Very low	75 Å²	75	142.5 Å²	142.5	52%	0.524	73%	0.729	S	S	.	*				79.9	106.1	77.4	-58.4	0	0	0	0	113.1
10	Y	24.1	Very low	30.1	Very low	204 Å²	204	141 Å²	141	80%	0.8	73%	0.729	S	S	*	*				79.3	106.9	86.3	-69.7	-49.6	0	0	0	112.5
11	N	24.1	Very low	30.4	Very low	129 Å²	129	139.7 Å²	139.7	69%	0.69	73%	0.73	S	S	*	*				82.3	122.9	77.9	-95.1	-6.6	0	0	0	114.1
12	L	26.6	Very low	30.8	Very low	145 Å²	145	135.8 Å²	135.8	76%	0.759	71%	0.708	S	S	*	*			trans	30.3	132.1	145	-68.8	85.8	0	0	0	119.1
13	K	23.9	Very low	31.8	Very low	180 Å²	180	134.2 Å²	134.2	78%	0.783	70%	0.696	S	S	*	*				-168.2	166.9	104.5	-109.5	167.1	178.4	-172.1	0	115.1
14	H	29.7	Very low	32.2	Very low	155 Å²	155	133.1 Å²	133.1	72%	0.718	69%	0.687	S	S	*	*			trans	63.4	90.4	161	-63.1	-56.5	0	0	0	121.1
15	S	31.3	Very low	32.4	Very low	98 Å²	98	127.7 Å²	127.7	69%	0.685	67%	0.672	S	S	*	*				-37.3	171.8	122.3	56.5	0	0	0	0	116.3
16	P	44.7	Very low	32.6	Very low	103 Å²	103	122.7 Å²	122.7	67%	0.669	66%	0.656	S	S	*	*			cis	-130	-174.4	-19.1	37.8	-21.4	0	0	0	112.6
17	F	32	Very low	32.7	Very low	183 Å²	183	119.7 Å²	119.7	80%	0.803	66%	0.656	S	S	*	*				179.4	139.3	120.1	-114	-88.2	0	0	0	114.7
18	T	31.8	Very low	32.7	Very low	122 Å²	122	116.6 Å²	116.6	75%	0.748	66%	0.655	S	S	*	*			trans	62.2	155.4	155.3	30.7	0	0	0	0	123.9
19	P	44	Very low	32.8	Very low	112 Å²	112	116.1 Å²	116.1	73%	0.727	66%	0.662	S	S	*	*			trans	-100.1	-160	-177.5	46.2	-37.9	0	0	0	110.9
20	P	39.3	Very low	32.7	Very low	113 Å²	113	117.2 Å²	117.2	73%	0.734	67%	0.669	S	S	*	*			cis	-140.8	-148	9.3	41.4	-17.2	0	0	0	114.1
21	P	37.7	Very low	32.9	Very low	114 Å²	114	112.8 Å²	112.8	74%	0.74	66%	0.659	S	S	*	*				-122.3	165.2	-51.3	22.7	-2.9	0	0	0	114.7
22	Q	34.8	Very low	33.2	Very low	158 Å²	158	110.4 Å²	110.4	74%	0.738	66%	0.657	S	S	*	*			trans	-91	139	154.9	-56.5	169.3	-75.8	0	0	108.7
23	P	49	Very low	33.1	Very low	58 Å²	58	108.8 Å²	108.8	38%	0.377	66%	0.658	S	S	.	*				-154.2	-144.4	99.9	43.8	-23.9	0	0	0	110.9	Y1657 S1658 N1659	P23-Y1657 HydrophobicContact CB-CD1 3.57Å; P23-Y1657 HydrophobicContact CB-CE1 3.67Å; P23-Y1657 HydrophobicContact CB-CG 4.31Å; P23-Y1657 HydrophobicContact CG-CD1 4.16Å; P23-Y1657 HydrophobicContact CG-CE1 3.71Å; P23-S1658 CarbonylContact C-O 3.11Å; P23-S1658 VanDerWaalsContact CA-O 3.28Å; P23-S1658 WeakPolarHBondContact CA-O 3.38Å; P23-N1659 WeakPolarHBondContact O-CB 3.49Å; P23-N1659 PolarHBondContact O-ND2 2.77Å
24	P	31.7	Very low	33.3	Very low	58 Å²	58	104.9 Å²	104.9	38%	0.377	65%	0.653	S	S	.	*			cis	-127.3	172.1	-26.4	39.8	-24.6	0	0	0	115.5	Y1657 S1658 N1659	P24-Y1657 HydrophobicContact CB-CD1 4.09Å; P24-Y1657 HydrophobicContact CB-CD2 3.35Å; P24-Y1657 HydrophobicContact CB-CE1 4.04Å; P24-Y1657 HydrophobicContact CB-CE2 3.29Å; P24-Y1657 HydrophobicContact CB-CG 3.77Å; P24-Y1657 HydrophobicContact CG-CE2 4.33Å; P24-S1658 VanDerWaalsContact CA-O 3.24Å; P24-S1658 WeakPolarHBondContact CA-O 3.03Å; P24-N1659 WeakPolarHBondContact CD-ND2 3.2Å; P24-N1659 PolarHBondContact O-ND2 3.43Å; P24-N1659 PolarHBondContact O-OD1 3Å
25	S	33.9	Very low	33.5	Very low	69 Å²	69	103.2 Å²	103.2	48%	0.483	66%	0.659	S	S	.	*			trans	-154.4	-72.3	155.7	92.6	0	0	0	0	116.5	S1658	S25-S1658 WeakPolarHBondContact OG-CB 3.19Å
26	S	29.1	Very low	33.6	Very low	49 Å²	49	103.8 Å²	103.8	34%	0.343	66%	0.66	S	S	.	*			trans	73.7	169.7	-150.7	-23.4	0	0	0	0	112.2	N1656	S26-N1656 VanDerWaalsContact OG-CA 3.25Å; S26-N1656 WeakPolarHBondContact OG-CA 3.35Å
27	S	31.2	Very low	32.8	Very low	101 Å²	101	104 Å²	104	71%	0.706	66%	0.664	S	S	*	*			cis	-152.4	165.3	1.6	59.9	0	0	0	0	113.3
28	S	28	Very low	32.5	Very low	103 Å²	103	100.5 Å²	100.5	72%	0.72	66%	0.662	S	S	*	*			trans	48	81.7	141.9	64.9	0	0	0	0	121.8
29	S	32.8	Very low	32.1	Very low	110 Å²	110	102.2 Å²	102.2	77%	0.769	67%	0.666	S	S	*	*				170.3	87.6	114.7	65.1	0	0	0	0	110
30	S	26.9	Very low	31.2	Very low	98 Å²	98	103.3 Å²	103.3	69%	0.685	67%	0.665	S	S	*	*				79.6	130.3	82	70.7	0	0	0	0	115.3
31	L	28.2	Very low	30.6	Very low	110 Å²	110	105.7 Å²	105.7	58%	0.576	67%	0.672	S	S	*	*			trans	83.7	143.4	150.5	-76.3	149.9	0	0	0	122	Q1700	L31-Q1700 VanDerWaalsContact CD1-NE2 3.31Å; L31-Q1700 HydrophobicContact CD2-CG 4.12Å
32	A	29.8	Very low	30.1	Very low	79 Å²	79	108 Å²	108	65%	0.653	67%	0.67	S	S	*	*			trans	56.8	109.7	159.8	0	0	0	0	0	116.1
33	S	24.8	Very low	29.6	Very low	112 Å²	112	107.8 Å²	107.8	78%	0.783	67%	0.669	S	S	*	*				55.1	136.2	51.8	103.5	0	0	0	0	112.9
34	S	29.7	Very low	28.4	Very low	98 Å²	98	108.7 Å²	108.7	69%	0.685	67%	0.671	S	S	*	*			cis	-149.9	122.2	23.7	39.9	0	0	0	0	113.2
35	S	32.1	Very low	28.2	Very low	119 Å²	119	113.3 Å²	113.3	83%	0.832	69%	0.685	S	S	*	*			trans	-60	142.5	130.7	-46.6	0	0	0	0	107.9
36	P	34.8	Very low	27.8	Very low	111 Å²	111	116.2 Å²	116.2	72%	0.721	69%	0.689	S	S	*	*				-137.1	150.5	111.5	36.3	-26.5	0	0	0	111.5
37	S	26.3	Very low	27.7	Very low	107 Å²	107	118.9 Å²	118.9	75%	0.748	70%	0.697	S	S	*	*	S	Bend	cis	-178.1	156.3	-4.5	45.5	0	0	0	0	107.1
38	S	26.5	Very low	27.6	Very low	109 Å²	109	121.6 Å²	121.6	76%	0.762	70%	0.702	S	S	*	*			cis	-154.9	150	1.8	27.9	0	0	0	0	110.9
39	L	23.1	Very low	27.5	Very low	159 Å²	159	124 Å²	124	83%	0.832	70%	0.699	S	S	*	*			trans	-56.9	135.3	153.3	-86.6	158.2	0	0	0	110.9
40	L	25.1	Very low	27.2	Very low	135 Å²	135	127.1 Å²	127.1	71%	0.707	70%	0.696	S	S	*	*				40.3	105.6	126.5	-159.3	78.9	0	0	0	117.7	K42	L40-K42 HydrophobicContact CD2-CG 4.4Å
41	N	27.7	Very low	27.2	Very low	162 Å²	162	126.9 Å²	126.9	87%	0.866	69%	0.694	S	S	*	*			trans	-99.6	135.7	149.1	-159.4	-1.9	0	0	0	109.2
42	K	26.2	Very low	27.2	Very low	164 Å²	164	126.3 Å²	126.3	71%	0.713	70%	0.695	S	S	*	*			trans	-91.2	136.2	177	-68.3	175	178.4	172.1	0	109.1	L40	L40-K42 HydrophobicContact CD2-CG 4.4Å
43	Q	24.5	Very low	26.9	Very low	152 Å²	152	126.1 Å²	126.1	71%	0.71	69%	0.686	S	S	*	*				157.8	137.8	127.8	-87	-175.7	27.7	0	0	117.2	L1671	Q43-L1671 CarbonylContact C-O 3.56Å
44	N	25	Very low	27	Very low	78 Å²	78	127.4 Å²	127.4	42%	0.417	68%	0.677	S	S	.	*			trans	76.5	95.8	145.8	-58.9	-23.3	0	0	0	125	L1671 K1672	N44-L1671 VanDerWaalsContact C-C 3.45Å; N44-L1671 CarbonylContact C-O 3.16Å; N44-L1671 VanDerWaalsContact C-O 3.23Å; N44-L1671 WeakPolarHBondContact CA-O 3.16Å; N44-L1671 PolarHBondContact N-O 2.96Å; N44-K1672 WeakPolarHBondContact O-CB 3.45Å; N44-K1672 WeakPolarHBondContact O-CG 3.42Å
45	K	25.9	Very low	26.7	Very low	155 Å²	155	127.4 Å²	127.4	67%	0.674	67%	0.667	S	S	*	*			trans	76.2	126.6	144.7	-53.5	166	-174.4	176.2	0	118	S1670 K1672	K45-S1670 CarbonylContact C-O 3.57Å; K45-S1670 WeakPolarHBondContact CA-O 3.27Å; K45-S1670 PolarHBondContact N-O 2.77Å; K45-K1672 WeakPolarHBondContact O-CA 3.32Å
46	K	26.3	Very low	26.5	Very low	129 Å²	129	128.9 Å²	128.9	56%	0.561	66%	0.66	S	S	*	*			cis	-166.3	149.3	-1.8	177.8	-141	171.2	-162.8	0	110.4	L1671	K46-L1671 VanDerWaalsContact N-CB 3.27Å
47	M	26.1	Very low	26.1	Very low	105 Å²	105	128.9 Å²	128.9	52%	0.517	66%	0.663	S	S	.	*			trans	86.6	150.4	169.1	-52.6	-171.8	-66.1	0	0	118.4	L1671	M47-L1671 WeakPolarHBondContact O-CD1 3.47Å; M47-L1671 WeakPolarHBondContact O-CD2 3.05Å
48	I	29.4	Very low	26.3	Very low	158 Å²	158	132.2 Å²	132.2	81%	0.81	67%	0.671	S	S	*	*			cis	-154.1	170.6	-11.5	-111.8	166.6	0	0	0	111.6
49	K	26.5	Very low	26.4	Very low	153 Å²	153	132.9 Å²	132.9	67%	0.665	67%	0.666	S	S	*	*			trans	-81.8	175.5	-178.8	-74.9	172.4	164.1	-153.2	0	114
50	Y	27.1	Very low	26.8	Very low	177 Å²	177	132.9 Å²	132.9	69%	0.694	67%	0.666	S	S	*	*			cis	-160	155.4	-5.4	-105.4	-26.6	0	0	0	107.3
51	S	25.8	Very low	27.2	Very low	93 Å²	93	134.5 Å²	134.5	65%	0.65	67%	0.667	S	S	*	*				60.5	146.2	74.4	96.2	0	0	0	0	116
52	V	28.2	Very low	27.3	Very low	98 Å²	98	131.5 Å²	131.5	59%	0.594	66%	0.659	S	S	*	*			cis	-160.7	-167	5.9	88.7	0	0	0	0	113.3	I172	V52-I172 VanDerWaalsContact C-CD1 3.42Å
53	T	24.5	Very low	27.4	Very low	74 Å²	74	130.7 Å²	130.7	45%	0.454	66%	0.661	S	S	.	*			trans	-63.1	-177.8	168.3	46.8	0	0	0	0	113.1	I172	T53-I172 HydrophobicContact CG2-CB 3.78Å; T53-I172 HydrophobicContact CG2-CD1 4.18Å; T53-I172 HydrophobicContact CG2-CG1 4.42Å; T53-I172 HydrophobicContact CG2-CG2 3.95Å
54	F	25.6	Very low	27.6	Very low	139 Å²	139	130.8 Å²	130.8	61%	0.61	67%	0.666	S	S	*	*			cis	-142.2	-114.8	12	-171.7	-122.9	0	0	0	112.9	L170	F54-L170 WeakPolarHBondContact O-CD2 3.36Å; F54-L170 WeakPolarHBondContact O-CG 3.26Å
55	E	25	Very low	28.1	Very low	99 Å²	99	132.3 Å²	132.3	46%	0.463	68%	0.68	S	S	.	*			trans	-141.8	162.3	-179.2	-139.5	-159.2	139.4	0	0	109.2	L170	E55-L170 HydrophobicContact CG-CD1 4.07Å; E55-L170 HydrophobicContact CG-CD2 4.12Å; E55-L170 HydrophobicContact CG-CG 4.31Å
56	Q	27.9	Very low	28	Very low	149 Å²	149	129.8 Å²	129.8	70%	0.696	68%	0.682	S	S	*	*			trans	47.9	131.6	158.8	-62	-178.7	25.9	0	0	121.9
57	S	26.3	Very low	27.9	Very low	111 Å²	111	130.1 Å²	130.1	78%	0.776	70%	0.695	S	S	*	*				-178.4	152.3	103.7	36.2	0	0	0	0	113.4
58	I	29	Very low	28	Very low	177 Å²	177	129.8 Å²	129.8	91%	0.908	70%	0.703	S	S	*	*			trans	-61.7	144.4	165.6	-63.7	160.6	0	0	0	108.9
59	N	30.1	Very low	27.8	Very low	123 Å²	123	126.7 Å²	126.7	66%	0.658	70%	0.695	S	S	*	*			trans	-149.8	120	-179.3	-165.6	-37.9	0	0	0	113.6	K61	N59-K61 PolarHBondContact OD1-N 2.57Å
60	L	31	Very low	28	Very low	160 Å²	160	125.5 Å²	125.5	84%	0.838	70%	0.701	S	S	*	*			trans	-142.8	94.5	148.6	-102.1	168.3	0	0	0	109.2
61	K	32.2	Very low	27.8	Very low	169 Å²	169	122 Å²	122	74%	0.735	70%	0.703	S	S	*	*				34.9	141.4	125.1	-66.3	178.2	-176	173.8	0	118.5	N59	N59-K61 PolarHBondContact OD1-N 2.57Å
62	S	31	Very low	28	Very low	99 Å²	99	123.1 Å²	123.1	69%	0.692	71%	0.707	S	S	*	*			cis	-166.6	150.6	26.9	33.6	0	0	0	0	114.8
63	L	28.3	Very low	27.9	Very low	146 Å²	146	123.3 Å²	123.3	76%	0.764	71%	0.713	S	S	*	*			trans	41.2	138.9	133.9	-71.6	82.1	0	0	0	119.7
64	L	28.4	Very low	28.3	Very low	155 Å²	155	125.1 Å²	125.1	81%	0.812	73%	0.726	S	S	*	*			cis	-152.9	172.8	11	-102.9	152.1	0	0	0	110
65	P	35.3	Very low	28.2	Very low	110 Å²	110	123 Å²	123	71%	0.714	73%	0.728	S	S	*	*			trans	-120.1	176.6	-164.9	44	-35.8	0	0	0	116
66	S	23.6	Very low	28.3	Very low	102 Å²	102	124.6 Å²	124.6	71%	0.713	75%	0.748	S	S	*	*			trans	-169.5	149.8	131.3	41.8	0	0	0	0	112.7
67	T	24.7	Very low	28.1	Very low	135 Å²	135	122.3 Å²	122.3	83%	0.828	75%	0.748	S	S	*	*			trans	42	138.3	153.9	47.6	0	0	0	0	121.3
68	S	27.6	Very low	28.1	Very low	99 Å²	99	122.6 Å²	122.6	69%	0.692	75%	0.75	S	S	*	*			cis	-158.5	175.7	16.8	56.8	0	0	0	0	114
69	S	26.5	Very low	28	Very low	92 Å²	92	119.9 Å²	119.9	64%	0.643	74%	0.744	S	S	*	*			trans	61.1	120.4	142.9	57.7	0	0	0	0	122.1
70	T	29	Very low	27.6	Very low	128 Å²	128	118.9 Å²	118.9	79%	0.785	75%	0.746	S	S	*	*			trans	64.8	107.6	137.6	53.8	0	0	0	0	121.2
71	S	24.8	Very low	27.3	Very low	104 Å²	104	116.3 Å²	116.3	73%	0.727	74%	0.742	S	S	*	*			trans	-35	159.3	133.5	56.7	0	0	0	0	115
72	P	30.1	Very low	27	Very low	116 Å²	116	113.4 Å²	113.4	75%	0.753	74%	0.743	S	S	*	*			cis	-144.9	170.8	31.3	44.9	-26.6	0	0	0	118.7
73	S	25.5	Very low	26.7	Very low	103 Å²	103	114.2 Å²	114.2	72%	0.72	75%	0.749	S	S	*	*			trans	-55.1	163.7	149.6	51.4	0	0	0	0	111
74	P	32.2	Very low	26.9	Very low	111 Å²	111	112.7 Å²	112.7	72%	0.721	75%	0.748	S	S	*	*				-155.2	170.5	53.5	42.5	-20.1	0	0	0	120.8
75	S	24.1	Very low	26.8	Very low	94 Å²	94	112.9 Å²	112.9	66%	0.657	75%	0.748	S	S	*	*			trans	56.5	103.9	143	59.6	0	0	0	0	119.6
76	P	27.3	Very low	26.5	Very low	134 Å²	134	113.7 Å²	113.7	87%	0.87	76%	0.756	S	S	*	*			trans	-68.2	153	144	33	-34.8	0	0	0	110.3
77	S	23.7	Very low	26.7	Very low	101 Å²	101	116.8 Å²	116.8	71%	0.706	76%	0.759	S	S	*	*			trans	-141.9	95.9	171.7	62.2	0	0	0	0	111.7
78	S	25.7	Very low	26.7	Very low	117 Å²	117	116.3 Å²	116.3	82%	0.818	76%	0.76	S	S	*	*			trans	64.7	152.6	-179.2	79.1	0	0	0	0	114
79	P	26.2	Very low	26.7	Very low	120 Å²	120	117.9 Å²	117.9	78%	0.779	77%	0.77	S	S	*	*				-119.3	170.1	61	40.8	-35.8	0	0	0	114.8
80	S	22.3	Very low	26.8	Very low	101 Å²	101	118.8 Å²	118.8	71%	0.706	77%	0.772	S	S	*	*			trans	-73.2	175.1	156	48.4	0	0	0	0	111.4
81	S	24.9	Very low	26.7	Very low	107 Å²	107	120.6 Å²	120.6	75%	0.748	78%	0.776	S	S	*	*			trans	87.6	132.2	169.6	77.1	0	0	0	0	119.3
82	S	25.7	Very low	26.8	Very low	108 Å²	108	123.7 Å²	123.7	76%	0.755	78%	0.784	S	S	*	*			trans	46.3	105.2	150.8	54.8	0	0	0	0	121.5
83	S	25.6	Very low	26.8	Very low	115 Å²	115	123.4 Å²	123.4	80%	0.804	78%	0.783	S	S	*	*			trans	-144.8	115	137.9	60.2	0	0	0	0	109.8
84	P	32	Very low	26.9	Very low	115 Å²	115	129.3 Å²	129.3	75%	0.747	79%	0.791	S	S	*	*			trans	-88	-162.6	178	35.6	-33.7	0	0	0	112.2
85	I	26.7	Very low	26.8	Very low	158 Å²	158	133 Å²	133	81%	0.81	80%	0.796	S	S	*	*			trans	85.7	83.9	173.9	-47.7	169.9	0	0	0	115.2
86	S	29.3	Very low	27.3	Very low	128 Å²	128	135.8 Å²	135.8	90%	0.895	80%	0.799	S	S	*	*				-141.8	78.2	128	-174.8	0	0	0	0	107.1
87	Q	26.5	Very low	28.1	Very low	167 Å²	167	138.3 Å²	138.3	78%	0.78	80%	0.796	S	S	*	*			trans	-127.1	77.9	-167.6	-164.4	176.9	11	0	0	111
88	C	25.4	Very low	29.6	Very low	124 Å²	124	137.8 Å²	137.8	84%	0.838	79%	0.785	S	S	*	*	S	Bend	trans	-153.5	68	166.3	-162.7	0	0	0	0	112
89	C	27.6	Very low	31.7	Very low	133 Å²	133	136.4 Å²	136.4	90%	0.899	78%	0.775	S	S	*	*	S	Bend	trans	-173	42.2	156	-110.6	0	0	0	0	113.5
90	T	28.8	Very low	34.4	Very low	111 Å²	111	133 Å²	133	68%	0.681	75%	0.748	S	S	*	*			trans	-143.1	90.6	179.6	31.3	0	0	0	0	112.3
91	N	26.6	Very low	37.8	Very low	166 Å²	166	130.9 Å²	130.9	89%	0.888	73%	0.73	S	S	*	*			trans	-161.3	43.2	158.8	-109.3	-16.5	0	0	0	114.1
92	L	27.5	Very low	41.2	Very low	168 Å²	168	125.8 Å²	125.8	88%	0.88	70%	0.695	S	S	*	*	S	Bend	trans	-128.3	141.6	160.2	-86.3	96.5	0	0	0	110.9
93	C	29.2	Very low	44.6	Very low	110 Å²	110	121.8 Å²	121.8	74%	0.743	67%	0.666	S	S	*	*			trans	54.7	76.2	168.9	-70.9	0	0	0	0	117.6	K95	C93-K95 PolarHBondContact O-N 2.87Å
94	Y	27.1	Very low	47.9	Very low	227 Å²	227	124 Å²	124	89%	0.89	66%	0.658	S	S	*	*			trans	-69.4	68	152.9	-121.1	-82.3	0	0	0	110.8
95	K	30.9	Very low	50.9	Low	189 Å²	189	119.1 Å²	119.1	82%	0.822	63%	0.626	S	S	*	*			trans	-141.2	51	179	-143.3	171.9	-170.2	175.5	0	110.1	C93 K97	C93-K95 PolarHBondContact O-N 2.87Å; K95-K97 PolarHBondContact O-N 2.76Å
96	Q	34.1	Very low	54.2	Low	153 Å²	153	112.1 Å²	112.1	72%	0.715	59%	0.59	S	S	*	*			trans	-60.6	94.7	-175.6	-74.4	180	-31.5	0	0	112.4
97	K	44.7	Very low	57.3	Low	186 Å²	186	113.8 Å²	113.8	81%	0.809	58%	0.577	S	S	*	*			trans	-71.4	135.5	134.5	-73.2	-174.7	174.8	-175.4	0	107	K95 S99	K95-K97 PolarHBondContact O-N 2.76Å; K97-S99 PolarHBondContact O-N 3.49Å
98	N	53.9	Low	60.6	Low	91 Å²	91	110.6 Å²	110.6	49%	0.487	56%	0.564	S	S	.	*			trans	-73.4	84.2	170.3	-71.7	-5.1	0	0	0	108.7	Y100	N98-Y100 HydrophobicContact CB-CE2 4.19Å; N98-Y100 WeakPolarHBondContact O-CD2 3.42Å; N98-Y100 PolarHBondContact O-N 3.43Å
99	S	69.7	Low	63.8	Low	87 Å²	87	108.7 Å²	108.7	61%	0.608	55%	0.546	S	S	*	.			trans	-80.9	92.6	-178.7	-171	0	0	0	0	109.9	K97	K97-S99 PolarHBondContact O-N 3.49Å
100	Y	84.1	Confident	67	Low	50 Å²	50	104.6 Å²	104.6	20%	0.196	52%	0.517	C	S	.	.			trans	-71	144	171.7	-61.1	-84.9	0	0	0	110.9	N98 F102 I295 L439	N98-Y100 HydrophobicContact CB-CE2 4.19Å; N98-Y100 WeakPolarHBondContact O-CD2 3.42Å; N98-Y100 PolarHBondContact O-N 3.43Å; Y100-F102 HydrophobicContact CD1-CD2 4.39Å; Y100-F102 AromaticContact CD1-CE2 3.46Å; Y100-F102 HydrophobicContact CD1-CE2 3.46Å; Y100-F102 VanDerWaalsContact CD1-CE2 3.46Å; Y100-F102 AromaticContact CD1-CZ 3.97Å; Y100-F102 HydrophobicContact CD1-CZ 3.97Å; Y100-F102 HydrophobicContact CE1-CE2 4.28Å; Y100-F102 HydrophobicContact CG-CD2 4.48Å; Y100-F102 AromaticContact CG-CE2 3.9Å; Y100-F102 HydrophobicContact CG-CE2 3.9Å; Y100-I295 HydrophobicContact CD1-CG2 4.23Å; Y100-I295 HydrophobicContact CE1-CG2 3.89Å; Y100-L439 HydrophobicContact CD1-CD1 4.39Å; Y100-L439 HydrophobicContact CD2-CB 3.78Å; Y100-L439 HydrophobicContact CD2-CD1 3.77Å; Y100-L439 HydrophobicContact CD2-CG 4.36Å; Y100-L439 HydrophobicContact CE2-CB 4.19Å; Y100-L439 HydrophobicContact CE2-CD1 4.21Å; Y100-L439 HydrophobicContact CG-CD1 3.85Å
101	T	93.6	Very high	70.1	Confident	56 Å²	56	99.4 Å²	99.4	34%	0.344	49%	0.485	S	S	.	.			trans	-134.2	38.7	-174.8	61.5	0	0	0	0	112	S103 Y104 L105 D298 D436	T101-S103 PolarHBondContact O-N 2.83Å; T101-S103 VanDerWaalsContact O-N 3.14Å; T101-Y104 WeakPolarHBondContact O-CB 3.43Å; T101-Y104 PolarHBondContact O-N 3.4Å; T101-L105 PolarHBondContact O-N 2.67Å; T101-D298 WeakPolarHBondContact CA-OD2 3.36Å; T101-D298 PolarHBondContact N-OD2 3.37Å; T101-D298 PolarHBondContact OG1-OD2 3.38Å; T101-D436 PolarHBondContact N-OD1 3.45Å
102	F	96.5	Very high	73.1	Confident	0 Å²	0	95.8 Å²	95.8	0%	0	47%	0.465	C	S	.	.	H	α-helix	trans	-58.4	-27.5	178.9	-67.1	-71.9	0	0	0	113	Y100 L105 L106 I295 Y297 D298 P308 A432 L435 D436 L439	Y100-F102 HydrophobicContact CD1-CD2 4.39Å; Y100-F102 AromaticContact CD1-CE2 3.46Å; Y100-F102 HydrophobicContact CD1-CE2 3.46Å; Y100-F102 VanDerWaalsContact CD1-CE2 3.46Å; Y100-F102 AromaticContact CD1-CZ 3.97Å; Y100-F102 HydrophobicContact CD1-CZ 3.97Å; Y100-F102 HydrophobicContact CE1-CE2 4.28Å; Y100-F102 HydrophobicContact CG-CD2 4.48Å; Y100-F102 AromaticContact CG-CE2 3.9Å; Y100-F102 HydrophobicContact CG-CE2 3.9Å; F102-L105 PolarHBondContact O-N 2.65Å; F102-L106 HydrophobicContact CB-CD1 4.47Å; F102-L106 WeakPolarHBondContact O-CB 3.25Å; F102-L106 VanDerWaalsContact O-CD1 3.27Å; F102-L106 WeakPolarHBondContact O-CD1 3.34Å; F102-L106 PolarHBondContact O-N 3.03Å; F102-I295 HydrophobicContact CE2-CG2 3.48Å; F102-I295 VanDerWaalsContact CE2-CG2 3.48Å; F102-I295 HydrophobicContact CZ-CG2 3.63Å; F102-I295 VanDerWaalsContact CZ-O 3.3Å; F102-I295 WeakPolarHBondContact CZ-O 3.39Å; F102-Y297 VanDerWaalsContact CE1-C 3.49Å; F102-Y297 WeakPolarHBondContact CE1-O 3.4Å; F102-D298 HydrophobicContact CD1-CB 3.8Å; F102-D298 HydrophobicContact CE1-CB 3.77Å; F102-D298 HydrophobicContact CE2-CB 4.49Å; F102-D298 HydrophobicContact CG-CB 4.2Å; F102-D298 HydrophobicContact CZ-CB 4.12Å; F102-P308 HydrophobicContact CD1-CB 3.81Å; F102-P308 HydrophobicContact CD1-CG 3.47Å; F102-P308 VanDerWaalsContact CD1-CG 3.47Å; F102-P308 HydrophobicContact CD2-CG 4.33Å; F102-P308 HydrophobicContact CE1-CB 4.15Å; F102-P308 HydrophobicContact CE1-CG 3.48Å; F102-P308 VanDerWaalsContact CE1-CG 3.48Å; F102-P308 HydrophobicContact CE2-CG 4.35Å; F102-P308 HydrophobicContact CG-CB 4.4Å; F102-P308 HydrophobicContact CG-CG 3.92Å; F102-P308 HydrophobicContact CZ-CG 3.95Å; F102-A432 HydrophobicContact CB-CB 4.17Å; F102-L435 HydrophobicContact CD2-CD2 4.13Å; F102-L435 HydrophobicContact CG-CD2 4.5Å; F102-D436 WeakPolarHBondContact CB-OD1 2.89Å; F102-D436 VanDerWaalsContact CD2-OD1 3.31Å; F102-D436 WeakPolarHBondContact CD2-OD1 3.43Å; F102-D436 VanDerWaalsContact N-CG 3.34Å; F102-D436 PolarHBondContact N-OD1 2.97Å; F102-D436 PolarHBondContact N-OD2 2.66Å; F102-D436 VanDerWaalsContact N-OD2 3.14Å; F102-L439 HydrophobicContact CD2-CD1 4.27Å; F102-L439 HydrophobicContact CE2-CD1 3.98Å
103	S	96.2	Very high	76.2	Confident	23 Å²	23	89 Å²	89	16%	0.161	43%	0.43	C	S	.	.	H	α-helix	trans	-53.1	-54.4	168.1	44.5	0	0	0	0	112.8	T101 L105 L106 R107 D436	T101-S103 PolarHBondContact O-N 2.83Å; T101-S103 VanDerWaalsContact O-N 3.14Å; S103-L105 PolarHBondContact O-N 3.39Å; S103-L106 PolarHBondContact O-N 2.71Å; S103-R107 PolarHBondContact O-N 3.26Å; S103-D436 VanDerWaalsContact CB-OD2 3.26Å; S103-D436 WeakPolarHBondContact CB-OD2 3.33Å; S103-D436 PolarHBondContact N-OD2 3.08Å; S103-D436 PolarHBondContact OG-OD2 2.87Å
104	Y	95.5	Very high	79	Confident	162 Å²	162	85.1 Å²	85.1	64%	0.635	40%	0.403	S	S	*	.	H	α-helix	trans	-59.9	-46.1	177.1	-179.1	-95.6	0	0	0	111.5	T101 R107 I108	T101-Y104 WeakPolarHBondContact O-CB 3.43Å; T101-Y104 PolarHBondContact O-N 3.4Å; Y104-R107 PolarHBondContact O-N 3.29Å; Y104-I108 HydrophobicContact CD1-CD1 4.08Å; Y104-I108 HydrophobicContact CD2-CD1 3.67Å; Y104-I108 HydrophobicContact CE1-CD1 3.72Å; Y104-I108 HydrophobicContact CE2-CD1 3.28Å; Y104-I108 HydrophobicContact CG-CD1 4.05Å; Y104-I108 PolarHBondContact O-N 3.05Å
105	L	95.1	Very high	81.5	Confident	13 Å²	13	76.3 Å²	76.3	7%	0.068	38%	0.381	C	S	.	.	H	α-helix	trans	-60.9	-47.2	177.7	-178	67.9	0	0	0	112.2	T101 F102 S103 R107 I108 N109 D298 P301 C304	T101-L105 PolarHBondContact O-N 2.67Å; F102-L105 PolarHBondContact O-N 2.65Å; S103-L105 PolarHBondContact O-N 3.39Å; L105-R107 VanDerWaalsContact C-N 3.3Å; L105-R107 PolarHBondContact O-N 3.3Å; L105-I108 PolarHBondContact O-N 2.79Å; L105-N109 HydrophobicContact CD1-CB 4.3Å; L105-N109 CarbonylContact O-C 3.57Å; L105-N109 WeakPolarHBondContact O-CA 2.96Å; L105-N109 PolarHBondContact O-N 3.16Å; L105-D298 WeakPolarHBondContact CD2-O 3.37Å; L105-P301 HydrophobicContact CD1-CG 4.18Å; L105-C304 WeakPolarHBondContact CD2-SG 3.45Å
106	L	95.9	Very high	83.4	Confident	10 Å²	10	70.4 Å²	70.4	5%	0.052	36%	0.359	C	S	.	.	H	α-helix	trans	-73.4	-18	-178.5	-89.1	76.4	0	0	0	113.7	F102 S103 P308 I311 A428 A432	F102-L106 HydrophobicContact CB-CD1 4.47Å; F102-L106 WeakPolarHBondContact O-CB 3.25Å; F102-L106 VanDerWaalsContact O-CD1 3.27Å; F102-L106 WeakPolarHBondContact O-CD1 3.34Å; F102-L106 PolarHBondContact O-N 3.03Å; S103-L106 PolarHBondContact O-N 2.71Å; L106-P308 HydrophobicContact CD1-CB 4.25Å; L106-I311 HydrophobicContact CD2-CB 4.27Å; L106-I311 HydrophobicContact CD2-CG2 3.84Å; L106-A428 HydrophobicContact CD2-CB 4.26Å; L106-A432 HydrophobicContact CB-CB 4.44Å; L106-A432 HydrophobicContact CD2-CB 4.23Å
107	R	94.9	Very high	85.5	Confident	163 Å²	163	63.1 Å²	63.1	62%	0.615	33%	0.325	S	S	*	.	H	α-helix	trans	-70.9	-46.7	167.2	176.9	-177.5	-81.6	-159.8	2.7	111.5	S103 Y104 L105 E429	S103-R107 PolarHBondContact O-N 3.26Å; Y104-R107 PolarHBondContact O-N 3.29Å; L105-R107 VanDerWaalsContact C-N 3.3Å; L105-R107 PolarHBondContact O-N 3.3Å; R107-E429 HydrophobicContact CB-CG 4.3Å; R107-E429 IonicContact CZ-OE1 2.65Å; R107-E429 VanDerWaalsContact CZ-OE1 3.28Å; R107-E429 IonicContact CZ-OE2 3.44Å; R107-E429 IonicContact NE-OE1 2.67Å; R107-E429 PolarHBondContact NE-OE1 3.46Å; R107-E429 VanDerWaalsContact NE-OE1 3.16Å; R107-E429 IonicContact NE-OE2 3.7Å; R107-E429 PolarHBondContact NE-OE2 2.95Å; R107-E429 IonicContact NH2-OE1 2.79Å; R107-E429 PolarHBondContact NH2-OE1 3.3Å; R107-E429 IonicContact NH2-OE2 3.7Å; R107-E429 PolarHBondContact NH2-OE2 3.01Å
108	I	94.6	Very high	87	Confident	100 Å²	100	56.6 Å²	56.6	51%	0.513	30%	0.298	S	S	.	.	H	α-helix	trans	-101	-38.9	-162.5	-61.9	167.8	0	0	0	112.7	Y104 L105	Y104-I108 HydrophobicContact CD1-CD1 4.08Å; Y104-I108 HydrophobicContact CD2-CD1 3.67Å; Y104-I108 HydrophobicContact CE1-CD1 3.72Å; Y104-I108 HydrophobicContact CE2-CD1 3.28Å; Y104-I108 HydrophobicContact CG-CD1 4.05Å; Y104-I108 PolarHBondContact O-N 3.05Å; L105-I108 PolarHBondContact O-N 2.79Å
109	N	94.2	Very high	87.8	Confident	85 Å²	85	56.6 Å²	56.6	46%	0.455	30%	0.298	S	S	.	.	S	Bend	trans	-143.9	69.2	-178.6	-163	-5.9	0	0	0	110.3	L105 P301	L105-N109 HydrophobicContact CD1-CB 4.3Å; L105-N109 CarbonylContact O-C 3.57Å; L105-N109 WeakPolarHBondContact O-CA 2.96Å; L105-N109 PolarHBondContact O-N 3.16Å; N109-P301 HydrophobicContact CB-CG 3.98Å; N109-P301 WeakPolarHBondContact ND2-CG 3.43Å; N109-P301 VanDerWaalsContact O-CG 3.31Å; N109-P301 WeakPolarHBondContact O-CG 3.29Å; N109-P301 WeakPolarHBondContact OD1-CG 3.4Å
110	P	93.2	Very high	87.7	Confident	47 Å²	47	52.8 Å²	52.8	31%	0.305	27%	0.271	S	S	.	.	P	Polyproline II helix	trans	-64.9	139.9	-177.8	25.2	-34	0	0	0	111.8	I112	P110-I112 PolarHBondContact O-N 2.79Å
111	P	94.1	Very high	86.9	Confident	1 Å²	1	51 Å²	51	1%	0.006	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-50.7	123.2	177.2	-30.1	35.5	0	0	0	112.8	L113 P301 C304 S312 W313	P111-L113 PolarHBondContact O-N 3.15Å; P111-P301 HydrophobicContact CG-CB 4.3Å; P111-C304 HydrophobicContact CG-CB 3.95Å; P111-S312 PolarHBondContact O-OG 3.36Å; P111-W313 PolarHBondContact O-NE1 2.69Å
112	I	90.9	Very high	85.6	Confident	91 Å²	91	51.1 Å²	51.1	47%	0.467	26%	0.261	S	S	.	.	P	Polyproline II helix	trans	-65.4	125.6	-174	-58.2	172.8	0	0	0	110.2	P110 P114 Q258 W313	P110-I112 PolarHBondContact O-N 2.79Å; I112-P114 WeakPolarHBondContact O-CD 3.44Å; I112-Q258 PolarHBondContact O-NE2 3.13Å; I112-W313 PolarHBondContact O-NE1 3.16Å
113	L	92	Very high	83.5	Confident	25 Å²	25	54.8 Å²	54.8	13%	0.131	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-68.7	119.1	172.3	-179.1	65.1	0	0	0	110.2	P111 G115 I117 L118 W313 Q316 L317	P111-L113 PolarHBondContact O-N 3.15Å; L113-G115 PolarHBondContact O-N 3.46Å; L113-I117 HydrophobicContact CD1-CB 3.98Å; L113-I117 HydrophobicContact CD1-CD1 4.09Å; L113-I117 HydrophobicContact CD1-CG1 4.35Å; L113-I117 HydrophobicContact CD1-CG2 4.14Å; L113-L118 HydrophobicContact CD2-CD1 3.96Å; L113-L118 HydrophobicContact CD2-CD2 4.06Å; L113-L118 HydrophobicContact CD2-CG 3.75Å; L113-L118 HydrophobicContact CG-CG 4.45Å; L113-W313 HydrophobicContact CB-CG 4.48Å; L113-W313 HydrophobicContact CD1-CB 3.77Å; L113-W313 HydrophobicContact CD1-CD2 4.03Å; L113-W313 HydrophobicContact CD1-CG 3.65Å; L113-Q316 HydrophobicContact CD2-CB 4.3Å; L113-L317 HydrophobicContact CD1-CD1 4.4Å; L113-L317 HydrophobicContact CD1-CG 4.46Å; L113-L317 HydrophobicContact CD2-CD2 3.91Å; L113-L317 HydrophobicContact CD2-CG 4.02Å
114	P	87.9	Confident	81.3	Confident	29 Å²	29	54.9 Å²	54.9	19%	0.188	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-63.2	133	175.7	-13.2	23	0	0	0	110.8	I112 D116 I117 S262 W313	I112-P114 WeakPolarHBondContact O-CD 3.44Å; P114-D116 PolarHBondContact O-N 3.3Å; P114-D116 VanDerWaalsContact O-N 3.11Å; P114-I117 HydrophobicContact CB-CG1 4.08Å; P114-I117 HydrophobicContact CG-CD1 3.96Å; P114-I117 HydrophobicContact CG-CG1 4.03Å; P114-I117 WeakPolarHBondContact O-CB 3.29Å; P114-I117 WeakPolarHBondContact O-CG1 3.48Å; P114-I117 PolarHBondContact O-N 3.22Å; P114-S262 WeakPolarHBondContact CG-OG 3.03Å; P114-W313 HydrophobicContact CG-CH2 4.13Å; P114-W313 HydrophobicContact CG-CZ2 4.23Å
115	G	79.2	Confident	79	Confident	42 Å²	42	49.4 Å²	49.4	43%	0.433	26%	0.258	S	S	.	.	H	α-helix	trans	-56.9	-29.3	-179.5	0	0	0	0	0	113.7	L113 I117 L118 N119	L113-G115 PolarHBondContact O-N 3.46Å; G115-I117 PolarHBondContact O-N 3.18Å; G115-L118 PolarHBondContact O-N 2.81Å; G115-N119 WeakPolarHBondContact O-CB 3.34Å; G115-N119 VanDerWaalsContact O-CG 3.24Å; G115-N119 PolarHBondContact O-N 3.42Å; G115-N119 PolarHBondContact O-ND2 3.47Å
116	D	71.5	Confident	76	Confident	64 Å²	64	52.1 Å²	52.1	34%	0.342	28%	0.279	S	S	.	.	H	α-helix	trans	-59.1	-29.9	173.4	-75.7	-21.9	0	0	0	113.4	P114 Y120 A177	P114-D116 PolarHBondContact O-N 3.3Å; P114-D116 VanDerWaalsContact O-N 3.11Å; D116-Y120 WeakPolarHBondContact O-CB 3.24Å; D116-Y120 PolarHBondContact O-N 3.33Å; D116-A177 WeakPolarHBondContact OD2-CB 2.81Å
117	I	78.3	Confident	73	Confident	0 Å²	0	56 Å²	56	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-70.6	-46.2	177.2	-48.4	-158.9	0	0	0	110.2	L113 P114 G115 Y120 I121 I266 W313 L317	L113-I117 HydrophobicContact CD1-CB 3.98Å; L113-I117 HydrophobicContact CD1-CD1 4.09Å; L113-I117 HydrophobicContact CD1-CG1 4.35Å; L113-I117 HydrophobicContact CD1-CG2 4.14Å; P114-I117 HydrophobicContact CB-CG1 4.08Å; P114-I117 HydrophobicContact CG-CD1 3.96Å; P114-I117 HydrophobicContact CG-CG1 4.03Å; P114-I117 WeakPolarHBondContact O-CB 3.29Å; P114-I117 WeakPolarHBondContact O-CG1 3.48Å; P114-I117 PolarHBondContact O-N 3.22Å; G115-I117 PolarHBondContact O-N 3.18Å; I117-Y120 PolarHBondContact O-N 3.26Å; I117-I121 HydrophobicContact CG2-CD1 3.92Å; I117-I121 WeakPolarHBondContact O-CB 3.31Å; I117-I121 VanDerWaalsContact O-CG1 3.3Å; I117-I121 WeakPolarHBondContact O-CG1 3.19Å; I117-I121 PolarHBondContact O-N 3.28Å; I117-I266 HydrophobicContact CB-CG1 4.35Å; I117-I266 HydrophobicContact CD1-CD1 4.36Å; I117-I266 HydrophobicContact CD1-CG1 3.64Å; I117-I266 HydrophobicContact CG1-CD1 4.06Å; I117-I266 HydrophobicContact CG1-CG1 3.62Å; I117-I266 HydrophobicContact CG2-CG1 4.26Å; I117-W313 HydrophobicContact CD1-CE3 3.76Å; I117-W313 HydrophobicContact CD1-CH2 4.46Å; I117-W313 HydrophobicContact CD1-CZ3 3.72Å; I117-L317 HydrophobicContact CG2-CD1 4.29Å
118	L	74.9	Confident	69.8	Low	50 Å²	50	51.8 Å²	51.8	26%	0.262	30%	0.299	S	S	.	.	H	α-helix	trans	-58.9	-51.6	173.7	-76.4	164.5	0	0	0	110.6	L113 G115 Y120 I121 E122 L317 Y320	L113-L118 HydrophobicContact CD2-CD1 3.96Å; L113-L118 HydrophobicContact CD2-CD2 4.06Å; L113-L118 HydrophobicContact CD2-CG 3.75Å; L113-L118 HydrophobicContact CG-CG 4.45Å; G115-L118 PolarHBondContact O-N 2.81Å; L118-Y120 VanDerWaalsContact C-N 3.34Å; L118-Y120 PolarHBondContact O-N 3.2Å; L118-I121 PolarHBondContact O-N 3.02Å; L118-I121 VanDerWaalsContact O-N 3.16Å; L118-E122 VanDerWaalsContact O-CG 3.22Å; L118-E122 WeakPolarHBondContact O-CG 3.42Å; L118-E122 PolarHBondContact O-N 3.07Å; L118-L317 HydrophobicContact CD2-CD2 3.62Å; L118-L317 HydrophobicContact CG-CD2 4.32Å; L118-Y320 HydrophobicContact CD2-CD1 4.06Å; L118-Y320 HydrophobicContact CD2-CE1 4.22Å; L118-Y320 HydrophobicContact CD2-CG 4.33Å
119	N	71.6	Confident	66.6	Low	91 Å²	91	52.4 Å²	52.4	49%	0.487	31%	0.307	S	S	.	.	H	α-helix	trans	-58.2	-43.9	179.5	-70	-26.5	0	0	0	111.9	G115 E122 L123	G115-N119 WeakPolarHBondContact O-CB 3.34Å; G115-N119 VanDerWaalsContact O-CG 3.24Å; G115-N119 PolarHBondContact O-N 3.42Å; G115-N119 PolarHBondContact O-ND2 3.47Å; N119-E122 PolarHBondContact O-N 2.92Å; N119-L123 VanDerWaalsContact O-CB 3.28Å; N119-L123 WeakPolarHBondContact O-CB 3.42Å; N119-L123 WeakPolarHBondContact O-CD1 3.31Å; N119-L123 WeakPolarHBondContact O-CG 3.38Å; N119-L123 PolarHBondContact O-N 3.29Å
120	Y	67.7	Low	63.5	Low	6 Å²	6	55.5 Å²	55.5	2%	0.024	32%	0.322	C	S	.	.	H	α-helix	trans	-64.7	-40.1	177.2	-179.6	-111.6	0	0	0	112.4	D116 I117 L118 N124 L184 I266 T270	D116-Y120 WeakPolarHBondContact O-CB 3.24Å; D116-Y120 PolarHBondContact O-N 3.33Å; I117-Y120 PolarHBondContact O-N 3.26Å; L118-Y120 VanDerWaalsContact C-N 3.34Å; L118-Y120 PolarHBondContact O-N 3.2Å; Y120-N124 WeakPolarHBondContact CE2-ND2 3.39Å; Y120-N124 WeakPolarHBondContact O-CB 3.48Å; Y120-N124 PolarHBondContact O-N 2.95Å; Y120-N124 VanDerWaalsContact O-N 3.14Å; Y120-N124 PolarHBondContact O-ND2 3.47Å; Y120-L184 HydrophobicContact CD2-CB 4.06Å; Y120-L184 HydrophobicContact CE2-CB 3.53Å; Y120-L184 WeakPolarHBondContact CE2-O 3.44Å; Y120-L184 PolarHBondContact OH-O 3.14Å; Y120-I266 HydrophobicContact CD1-CG2 3.51Å; Y120-I266 HydrophobicContact CE1-CG2 3.61Å; Y120-I266 HydrophobicContact CG-CG2 4.3Å; Y120-T270 HydrophobicContact CE1-CG2 4.12Å
121	I	67.4	Low	60.1	Low	13 Å²	13	57.6 Å²	57.6	7%	0.067	34%	0.338	C	S	.	.	H	α-helix	trans	-67.4	-39.8	177	-71.1	166.8	0	0	0	110.9	I117 L118 K125 L273 L317	I117-I121 HydrophobicContact CG2-CD1 3.92Å; I117-I121 WeakPolarHBondContact O-CB 3.31Å; I117-I121 VanDerWaalsContact O-CG1 3.3Å; I117-I121 WeakPolarHBondContact O-CG1 3.19Å; I117-I121 PolarHBondContact O-N 3.28Å; L118-I121 PolarHBondContact O-N 3.02Å; L118-I121 VanDerWaalsContact O-N 3.16Å; I121-K125 WeakPolarHBondContact O-CG 3.37Å; I121-L273 HydrophobicContact CD1-CD1 3.88Å; I121-L317 HydrophobicContact CD1-CD1 3.73Å; I121-L317 HydrophobicContact CD1-CD2 3.69Å; I121-L317 HydrophobicContact CD1-CG 4.34Å
122	E	66.7	Low	56.8	Low	58 Å²	58	62.9 Å²	62.9	27%	0.271	37%	0.37	S	S	.	.	H	α-helix	trans	-67.6	-49.6	175.8	-59.1	-106.6	84.4	0	0	111.7	L118 N119 N124 K125 Y320 R324	L118-E122 VanDerWaalsContact O-CG 3.22Å; L118-E122 WeakPolarHBondContact O-CG 3.42Å; L118-E122 PolarHBondContact O-N 3.07Å; N119-E122 PolarHBondContact O-N 2.92Å; E122-N124 PolarHBondContact O-N 3.42Å; E122-K125 WeakPolarHBondContact O-CB 3.41Å; E122-K125 PolarHBondContact O-N 2.81Å; E122-K125 IonicContact OE1-NZ 3.75Å; E122-K125 PolarHBondContact OE1-NZ 2.82Å; E122-Y320 HydrophobicContact CG-CE1 4.46Å; E122-Y320 PolarHBondContact OE2-OH 2.69Å; E122-R324 IonicContact OE1-NH1 2.79Å; E122-R324 PolarHBondContact OE1-NH1 3.28Å; E122-R324 IonicContact OE2-NH1 2.69Å; E122-R324 PolarHBondContact OE2-NH1 2.71Å; E122-R324 IonicContact OE2-NH2 3.36Å
123	L	52.3	Low	53.5	Low	77 Å²	77	64 Å²	64	40%	0.403	39%	0.386	S	S	.	.	H	α-helix	trans	-59.3	-28.2	178.7	-75.5	168.2	0	0	0	113.4	N119 S126	N119-L123 VanDerWaalsContact O-CB 3.28Å; N119-L123 WeakPolarHBondContact O-CB 3.42Å; N119-L123 WeakPolarHBondContact O-CD1 3.31Å; N119-L123 WeakPolarHBondContact O-CG 3.38Å; N119-L123 PolarHBondContact O-N 3.29Å; L123-S126 PolarHBondContact O-OG 3.45Å
124	N	49.3	Very low	50.3	Low	25 Å²	25	70.1 Å²	70.1	13%	0.134	42%	0.417	C	S	.	.	H	α-helix	trans	-70.5	-33.2	173	-90.2	-78	0	0	0	112.6	Y120 E122 S126 T127	Y120-N124 WeakPolarHBondContact CE2-ND2 3.39Å; Y120-N124 WeakPolarHBondContact O-CB 3.48Å; Y120-N124 PolarHBondContact O-N 2.95Å; Y120-N124 VanDerWaalsContact O-N 3.14Å; Y120-N124 PolarHBondContact O-ND2 3.47Å; E122-N124 PolarHBondContact O-N 3.42Å; N124-S126 PolarHBondContact O-N 3.05Å; N124-T127 PolarHBondContact O-N 3.24Å; N124-T127 VanDerWaalsContact O-N 3.14Å; N124-T127 PolarHBondContact O-OG1 3.19Å
125	K	48.2	Very low	47.1	Very low	47 Å²	47	77.7 Å²	77.7	20%	0.204	45%	0.452	C	S	.	.	H	α-helix	trans	-63	-41.7	-176.9	-66.1	170.6	-169.2	169.2	0	112.2	I121 E122 T127 S128 Y325	I121-K125 WeakPolarHBondContact O-CG 3.37Å; E122-K125 WeakPolarHBondContact O-CB 3.41Å; E122-K125 PolarHBondContact O-N 2.81Å; E122-K125 IonicContact OE1-NZ 3.75Å; E122-K125 PolarHBondContact OE1-NZ 2.82Å; K125-T127 PolarHBondContact O-N 3.2Å; K125-S128 PolarHBondContact O-N 3.5Å; K125-S128 PolarHBondContact O-OG 3.36Å; K125-Y325 WeakPolarHBondContact CD-OH 3.32Å; K125-Y325 WeakPolarHBondContact CE-OH 3.38Å; K125-Y325 PolarHBondContact NZ-OH 3.24Å
126	S	30.3	Very low	44.4	Very low	71 Å²	71	80.2 Å²	80.2	50%	0.497	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-10.1	176.7	37.3	0	0	0	0	114.6	L123 N124	L123-S126 PolarHBondContact O-OG 3.45Å; N124-S126 PolarHBondContact O-N 3.05Å
127	T	33	Very low	42.1	Very low	92 Å²	92	88.4 Å²	88.4	56%	0.564	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-8.3	171.3	69.5	0	0	0	0	114	N124 K125	N124-T127 PolarHBondContact O-N 3.24Å; N124-T127 VanDerWaalsContact O-N 3.14Å; N124-T127 PolarHBondContact O-OG1 3.19Å; K125-T127 PolarHBondContact O-N 3.2Å
128	S	28.7	Very low	39.5	Very low	74 Å²	74	93.1 Å²	93.1	52%	0.517	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.4	-17.8	-171.1	67.2	0	0	0	0	114.8	K125 I130	K125-S128 PolarHBondContact O-N 3.5Å; K125-S128 PolarHBondContact O-OG 3.36Å; S128-I130 VanDerWaalsContact C-N 3.3Å; S128-I130 PolarHBondContact O-N 3.4Å
129	T	27.7	Very low	37	Very low	112 Å²	112	98.3 Å²	98.3	69%	0.687	55%	0.551	S	S	*	*	S	Bend	trans	-80.9	-3.6	178.6	43	0	0	0	0	114.3
130	I	27.9	Very low	34.7	Very low	150 Å²	150	100.8 Å²	100.8	77%	0.769	57%	0.569	S	S	*	*	S	Bend	trans	-106.9	41.8	-177.6	-37.2	-179	0	0	0	111.4	S128	S128-I130 VanDerWaalsContact C-N 3.3Å; S128-I130 PolarHBondContact O-N 3.4Å
131	S	23.1	Very low	32.6	Very low	91 Å²	91	104.3 Å²	104.3	64%	0.636	59%	0.588	S	S	*	*	S	Bend	trans	-144.3	26.5	178	83	0	0	0	0	117
132	T	23.5	Very low	30.7	Very low	113 Å²	113	108 Å²	108	69%	0.693	61%	0.607	S	S	*	*	S	Bend	trans	-137.8	47.1	172.3	50.8	0	0	0	0	113.3
133	S	21.7	Very low	28.7	Very low	114 Å²	114	111.4 Å²	111.4	80%	0.797	63%	0.627	S	S	*	*	S	Bend	trans	-163.1	162.8	160.2	-89.8	0	0	0	0	111.5
134	I	24.9	Very low	27.5	Very low	154 Å²	154	112.2 Å²	112.2	79%	0.79	64%	0.639	S	S	*	*			trans	63.1	93.8	178.6	-47	178.9	0	0	0	114.7
135	M	21.3	Very low	26.6	Very low	187 Å²	187	116.9 Å²	116.9	92%	0.921	67%	0.669	S	S	*	*			trans	-120.4	83	154.5	-100.6	-163.3	67	0	0	110.2
136	S	22.5	Very low	25.5	Very low	96 Å²	96	118 Å²	118	67%	0.671	69%	0.694	S	S	*	*			trans	-160.4	134.5	160.2	49.1	0	0	0	0	113.6
137	R	24.2	Very low	25.5	Very low	236 Å²	236	124.9 Å²	124.9	89%	0.891	72%	0.715	S	S	*	*			trans	64	103.8	155	-65	-177.3	177.1	-177.2	-1	120.9
138	S	22.2	Very low	24.9	Very low	99 Å²	99	126.8 Å²	126.8	69%	0.692	73%	0.726	S	S	*	*				75.2	111.6	128.1	56.7	0	0	0	0	123.3
139	N	22	Very low	24.6	Very low	158 Å²	158	129.2 Å²	129.2	85%	0.845	73%	0.728	S	S	*	*				62.3	90.9	127	-60.7	-14.8	0	0	0	121.5
140	V	24.6	Very low	24.3	Very low	143 Å²	143	130.1 Å²	130.1	87%	0.867	73%	0.733	S	S	*	*				-132.2	150.4	127.1	-177.7	0	0	0	0	108.3
141	N	23.4	Very low	24	Very low	80 Å²	80	128.7 Å²	128.7	43%	0.428	73%	0.725	S	S	.	*			trans	-139.6	116.7	-170.7	173.1	4.3	0	0	0	110.9	R1127	N141-R1127 WeakPolarHBondContact O-CG 3.49Å
142	I	26.6	Very low	24.1	Very low	90 Å²	90	130.5 Å²	130.5	46%	0.462	73%	0.732	S	S	.	*			trans	-134	121.8	172	-58.7	179.5	0	0	0	109.8	A1129	I142-A1129 WeakPolarHBondContact CD1-O 3.5Å
143	N	25.2	Very low	24.1	Very low	130 Å²	130	129.7 Å²	129.7	70%	0.695	73%	0.73	S	S	*	*			trans	-92.6	135.1	160.2	-72.8	-45	0	0	0	108.8
144	S	27.3	Very low	24.2	Very low	95 Å²	95	131.2 Å²	131.2	66%	0.664	73%	0.728	S	S	*	*			trans	-177.1	165.8	144.4	47.1	0	0	0	0	110.9
145	T	30.5	Very low	24.2	Very low	122 Å²	122	131.4 Å²	131.4	75%	0.748	73%	0.73	S	S	*	*			trans	-87.1	125	-171.6	53.2	0	0	0	0	112.8
146	G	24.4	Very low	24.3	Very low	72 Å²	72	130 Å²	130	74%	0.742	72%	0.722	S	S	*	*			trans	-157.3	142.7	174.7	0	0	0	0	0	114.3
147	K	30.1	Very low	24.4	Very low	214 Å²	214	132.4 Å²	132.4	93%	0.93	73%	0.727	S	S	*	*			trans	-80.9	128	168.2	-58.3	172.9	-177.9	176.1	0	109
148	V	21.7	Very low	24.4	Very low	133 Å²	133	126.9 Å²	126.9	81%	0.806	72%	0.723	S	S	*	*			trans	-145.8	127.6	164.5	-172.2	0	0	0	0	110.9
149	K	21.5	Very low	24.6	Very low	125 Å²	125	129 Å²	129	54%	0.543	73%	0.727	S	S	.	*			trans	-150.6	118.2	134	-124.9	-168.1	-178.6	-162.8	0	108.4	L185	K149-L185 PolarHBondContact NZ-O 2.82Å
150	V	21.5	Very low	24.9	Very low	131 Å²	131	130.7 Å²	130.7	79%	0.794	73%	0.729	S	S	*	*			trans	-137.2	118.2	166.2	175.9	0	0	0	0	105.4
151	I	22.7	Very low	25.1	Very low	119 Å²	119	128.2 Å²	128.2	61%	0.61	72%	0.718	S	S	*	*			trans	-142.2	119.1	165.3	-56.6	179.1	0	0	0	105.4
152	V	24.5	Very low	25.2	Very low	130 Å²	130	128.8 Å²	128.8	79%	0.788	72%	0.721	S	S	*	*			trans	-133.3	116	157.7	177	0	0	0	0	104.4
153	C	23	Very low	25.4	Very low	95 Å²	95	131 Å²	131	64%	0.642	73%	0.73	S	S	*	*			trans	-83.8	138.8	173.9	-61.5	0	0	0	0	108.6
154	I	24.2	Very low	25.6	Very low	147 Å²	147	130.8 Å²	130.8	75%	0.754	72%	0.724	S	S	*	*			trans	-114.5	118.7	166.9	-58.6	175.4	0	0	0	105.3	Q156	I154-Q156 PolarHBondContact O-N 3.05Å
155	N	25.1	Very low	25.6	Very low	158 Å²	158	133.2 Å²	133.2	85%	0.845	72%	0.724	S	S	*	*			trans	-82	111.2	166.3	-93.8	20.8	0	0	0	108.4
156	Q	24	Very low	25.4	Very low	158 Å²	158	133.1 Å²	133.1	74%	0.738	72%	0.72	S	S	*	*			trans	-93.2	148.6	137.6	-56.1	177.7	-98.6	0	0	105.2	I154	I154-Q156 PolarHBondContact O-N 3.05Å
157	D	23.9	Very low	25.5	Very low	145 Å²	145	137.8 Å²	137.8	78%	0.775	73%	0.727	S	S	*	*			cis	-128	149.4	19.2	-61.9	-72.6	0	0	0	113.7
158	C	24.9	Very low	25.3	Very low	120 Å²	120	136.8 Å²	136.8	81%	0.811	73%	0.726	S	S	*	*			trans	-159.1	141.8	142.7	-95.9	0	0	0	0	109.2
159	N	26	Very low	25.5	Very low	145 Å²	145	133.1 Å²	133.1	78%	0.775	72%	0.715	S	S	*	*			trans	67.4	89.5	166.3	-55	-4.2	0	0	0	118.2
160	H	27.1	Very low	25.8	Very low	192 Å²	192	133.2 Å²	133.2	89%	0.889	72%	0.721	S	S	*	*				-84.1	142.2	116.1	-81.5	-16	0	0	0	108.1
161	S	28.8	Very low	26	Very low	92 Å²	92	131.1 Å²	131.1	64%	0.643	72%	0.718	S	S	*	*			cis	-141.8	142.9	11.5	56.7	0	0	0	0	113.6
162	N	27.3	Very low	26.2	Very low	91 Å²	91	129.1 Å²	129.1	49%	0.487	71%	0.707	S	S	.	*			trans	52.6	124	148	-53.6	-1.4	0	0	0	117.3
163	H	30.6	Very low	26.5	Very low	138 Å²	138	129.2 Å²	129.2	64%	0.639	71%	0.708	S	S	*	*				-141.1	143.3	63.4	-84.2	45	0	0	0	114.4	Q1193	H163-Q1193 WeakPolarHBondContact CD2-CG 3.35Å; H163-Q1193 PolarHBondContact CD2-NE2 2.77Å; H163-Q1193 WeakPolarHBondContact NE2-CG 3.5Å
164	H	27.6	Very low	26.8	Very low	125 Å²	125	127.6 Å²	127.6	58%	0.579	70%	0.702	S	S	*	*			trans	-68.2	160.7	156.2	-85.3	-115.8	0	0	0	110.5	Q1193	H164-Q1193 PolarHBondContact O-NE2 2.9Å
165	H	28.5	Very low	27	Very low	145 Å²	145	125.9 Å²	125.9	67%	0.671	70%	0.698	S	S	*	*			cis	-157.3	157.5	18.9	-127.3	-56	0	0	0	112.2
166	N	25.9	Very low	27.5	Very low	121 Å²	121	123.6 Å²	123.6	65%	0.647	69%	0.69	S	S	*	*			trans	65.2	97.1	149.9	-61.7	-21.8	0	0	0	120.8
167	N	26.6	Very low	27.8	Very low	170 Å²	170	117.4 Å²	117.4	91%	0.909	67%	0.666	S	S	*	*				-143.8	133.4	106.9	-110.1	-26.9	0	0	0	110.1
168	Q	27	Very low	28	Very low	192 Å²	192	116.2 Å²	116.2	90%	0.897	66%	0.659	S	S	*	*			trans	-115.9	126	174.5	-76.1	-169.9	-11.9	0	0	109.2
169	G	24.7	Very low	28.3	Very low	56 Å²	56	119.1 Å²	119.1	58%	0.577	66%	0.658	S	S	*	*			trans	-179.8	27.5	-177.6	0	0	0	0	0	117.5
170	L	27.1	Very low	28.8	Very low	127 Å²	127	116 Å²	116	67%	0.665	64%	0.644	S	S	*	*			trans	-162.6	92.9	175.6	-119.8	162.5	0	0	0	111.8	F54 E55	F54-L170 WeakPolarHBondContact O-CD2 3.36Å; F54-L170 WeakPolarHBondContact O-CG 3.26Å; E55-L170 HydrophobicContact CG-CD1 4.07Å; E55-L170 HydrophobicContact CG-CD2 4.12Å; E55-L170 HydrophobicContact CG-CG 4.31Å
171	A	26.8	Very low	29	Very low	88 Å²	88	107.5 Å²	107.5	73%	0.727	61%	0.606	S	S	*	*			trans	-154	19.2	-176.7	0	0	0	0	0	116.7
172	I	27.2	Very low	29	Very low	76 Å²	76	105.7 Å²	105.7	39%	0.39	60%	0.602	S	S	.	*			trans	-134.7	88.9	169.1	-56.5	-172.2	0	0	0	110.9	V52 T53	V52-I172 VanDerWaalsContact C-CD1 3.42Å; T53-I172 HydrophobicContact CG2-CB 3.78Å; T53-I172 HydrophobicContact CG2-CD1 4.18Å; T53-I172 HydrophobicContact CG2-CG1 4.42Å; T53-I172 HydrophobicContact CG2-CG2 3.95Å
173	T	30.9	Very low	29.4	Very low	132 Å²	132	104.4 Å²	104.4	81%	0.81	60%	0.6	S	S	*	*	S	Bend	trans	-160	73.3	145.7	-67.5	0	0	0	0	108
174	A	28.3	Very low	29.5	Very low	61 Å²	61	99.3 Å²	99.3	50%	0.504	58%	0.578	S	S	.	*			trans	-146.3	-17.9	-178	0	0	0	0	0	114.9	T176	A174-T176 PolarHBondContact O-N 3.39Å
175	T	29.5	Very low	29.8	Very low	111 Å²	111	96.3 Å²	96.3	68%	0.681	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-15	-170.3	-29.4	0	0	0	0	114
176	T	33.9	Very low	30.1	Very low	110 Å²	110	92.1 Å²	92.1	68%	0.675	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-50.7	175.1	37.1	0	0	0	0	111.7	A174 L178 K179	A174-T176 PolarHBondContact O-N 3.39Å; T176-L178 VanDerWaalsContact C-N 3.3Å; T176-L178 PolarHBondContact O-N 2.87Å; T176-K179 PolarHBondContact O-N 3.44Å; T176-K179 VanDerWaalsContact O-N 3.12Å
177	A	30.8	Very low	30.5	Very low	29 Å²	29	91.4 Å²	91.4	24%	0.24	55%	0.554	C	S	.	*	H	α-helix	trans	-52.3	-44.2	177.9	0	0	0	0	0	113.1	D116 K179 T180 V181	D116-A177 WeakPolarHBondContact OD2-CB 2.81Å; A177-K179 PolarHBondContact O-N 3.48Å; A177-K179 VanDerWaalsContact O-N 3.16Å; A177-T180 WeakPolarHBondContact O-CB 3.31Å; A177-T180 PolarHBondContact O-N 3.07Å; A177-V181 PolarHBondContact O-N 2.69Å; A177-V181 VanDerWaalsContact O-N 3.14Å
178	L	29	Very low	31	Very low	119 Å²	119	88.9 Å²	88.9	62%	0.623	54%	0.541	S	S	*	.	H	α-helix	trans	-62.2	-24	-178.4	-72.9	170.7	0	0	0	114.5	T176 G182	T176-L178 VanDerWaalsContact C-N 3.3Å; T176-L178 PolarHBondContact O-N 2.87Å; L178-G182 PolarHBondContact O-N 3.21Å
179	K	31.8	Very low	31.8	Very low	181 Å²	181	81.3 Å²	81.3	79%	0.787	51%	0.509	S	S	*	.	H	α-helix	trans	-68.8	-37.4	171.9	-90.9	-177.7	175.4	175.7	0	112	T176 A177	T176-K179 PolarHBondContact O-N 3.44Å; T176-K179 VanDerWaalsContact O-N 3.12Å; A177-K179 PolarHBondContact O-N 3.48Å; A177-K179 VanDerWaalsContact O-N 3.16Å
180	T	34.7	Very low	33	Very low	80 Å²	80	80.4 Å²	80.4	49%	0.491	49%	0.493	S	S	.	.	H	α-helix	trans	-66.9	-50.6	176.2	-51.6	0	0	0	0	110	A177 G182 S183 L184	A177-T180 WeakPolarHBondContact O-CB 3.31Å; A177-T180 PolarHBondContact O-N 3.07Å; T180-G182 VanDerWaalsContact C-N 3.28Å; T180-G182 PolarHBondContact O-N 2.62Å; T180-S183 PolarHBondContact O-N 2.74Å; T180-S183 PolarHBondContact O-OG 3.14Å; T180-L184 HydrophobicContact CG2-CD1 4.46Å; T180-L184 PolarHBondContact O-N 3.45Å
181	V	32.5	Very low	34.4	Very low	13 Å²	13	78 Å²	78	8%	0.079	48%	0.481	C	S	.	.	H	α-helix	trans	-58.4	-37.5	176.1	-178.9	0	0	0	0	112	A177 S183 L184 L185	A177-V181 PolarHBondContact O-N 2.69Å; A177-V181 VanDerWaalsContact O-N 3.14Å; V181-S183 PolarHBondContact O-N 2.86Å; V181-L184 PolarHBondContact O-N 2.83Å; V181-L185 HydrophobicContact CG1-CD1 3.88Å; V181-L185 HydrophobicContact CG1-CG 4.04Å; V181-L185 WeakPolarHBondContact O-CG 3.4Å; V181-L185 PolarHBondContact O-N 2.9Å
182	G	29.4	Very low	36.2	Very low	55 Å²	55	74.7 Å²	74.7	57%	0.567	45%	0.45	S	S	*	.	H	α-helix	trans	-58.9	-25.1	174.6	0	0	0	0	0	114.8	L178 T180	L178-G182 PolarHBondContact O-N 3.21Å; T180-G182 VanDerWaalsContact C-N 3.28Å; T180-G182 PolarHBondContact O-N 2.62Å
183	S	34.9	Very low	38.6	Very low	64 Å²	64	72 Å²	72	45%	0.448	44%	0.437	S	S	.	.	H	α-helix	trans	-85.7	-31.9	173.1	74.8	0	0	0	0	113.2	T180 V181	T180-S183 PolarHBondContact O-N 2.74Å; T180-S183 PolarHBondContact O-OG 3.14Å; V181-S183 PolarHBondContact O-N 2.86Å
184	L	33.3	Very low	41.1	Very low	31 Å²	31	65.7 Å²	65.7	16%	0.162	40%	0.399	C	S	.	.	H	α-helix	trans	-73.8	-26.2	178	-67.8	165.8	0	0	0	112.8	Y120 T180 V181 S186 I266	Y120-L184 HydrophobicContact CD2-CB 4.06Å; Y120-L184 HydrophobicContact CE2-CB 3.53Å; Y120-L184 WeakPolarHBondContact CE2-O 3.44Å; Y120-L184 PolarHBondContact OH-O 3.14Å; T180-L184 HydrophobicContact CG2-CD1 4.46Å; T180-L184 PolarHBondContact O-N 3.45Å; V181-L184 PolarHBondContact O-N 2.83Å; L184-S186 PolarHBondContact O-N 3.02Å; L184-I266 HydrophobicContact CD1-CD1 4.18Å; L184-I266 HydrophobicContact CD1-CG2 4.2Å; L184-I266 HydrophobicContact CD2-CG2 4.12Å
185	L	33.8	Very low	43.8	Very low	61 Å²	61	63 Å²	63	32%	0.319	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	20.8	-178.9	-75.9	172	0	0	0	115.3	K149 V181 P187	K149-L185 PolarHBondContact NZ-O 2.82Å; V181-L185 HydrophobicContact CG1-CD1 3.88Å; V181-L185 HydrophobicContact CG1-CG 4.04Å; V181-L185 WeakPolarHBondContact O-CG 3.4Å; V181-L185 PolarHBondContact O-N 2.9Å; L185-P187 WeakPolarHBondContact O-CD 3.41Å
186	S	34.1	Very low	46.4	Very low	57 Å²	57	57.7 Å²	57.7	40%	0.399	34%	0.343	S	S	.	.			trans	-76.6	115.5	162.6	-179.8	0	0	0	0	109.2	L184 N188 S189	L184-S186 PolarHBondContact O-N 3.02Å; S186-N188 CarbonylContact O-C 3.6Å; S186-N188 PolarHBondContact O-N 3.26Å; S186-N188 VanDerWaalsContact O-N 3.14Å; S186-N188 PolarHBondContact OG-O 3.38Å; S186-S189 PolarHBondContact O-N 3.26Å; S186-S189 VanDerWaalsContact O-N 3.08Å
187	P	33.8	Very low	49	Very low	106 Å²	106	53.1 Å²	53.1	69%	0.688	31%	0.314	S	S	*	.	S	Bend	trans	-66.7	-15.8	178.9	29.3	-35.5	0	0	0	112.7	L185	L185-P187 WeakPolarHBondContact O-CD 3.41Å
188	N	36.7	Very low	51.4	Low	117 Å²	117	51.9 Å²	51.9	63%	0.626	30%	0.303	S	S	*	.	S	Bend	trans	-98.3	78.2	159	-63.9	-42.8	0	0	0	107.7	S186	S186-N188 CarbonylContact O-C 3.6Å; S186-N188 PolarHBondContact O-N 3.26Å; S186-N188 VanDerWaalsContact O-N 3.14Å; S186-N188 PolarHBondContact OG-O 3.38Å
189	S	45	Very low	53.7	Low	34 Å²	34	46.9 Å²	46.9	24%	0.238	28%	0.277	C	S	.	.			trans	-64.4	135.4	162.7	65	0	0	0	0	107.4	S186 L191 D267	S186-S189 PolarHBondContact O-N 3.26Å; S186-S189 VanDerWaalsContact O-N 3.08Å; S189-L191 PolarHBondContact O-N 3.38Å; S189-D267 WeakPolarHBondContact CB-OD1 3.39Å; S189-D267 PolarHBondContact OG-OD1 3.43Å
190	P	50	Low	55.1	Low	37 Å²	37	45.7 Å²	45.7	24%	0.24	27%	0.268	C	S	.	.			trans	-66.2	130.1	-168.6	24.4	-32.6	0	0	0	110.5	N192 T193	P190-N192 CarbonylContact O-C 3.56Å; P190-N192 PolarHBondContact O-N 3.05Å; P190-T193 HydrophobicContact CG-CG2 4.23Å
191	L	55.8	Low	56	Low	76 Å²	76	43.9 Å²	43.9	40%	0.398	26%	0.258	S	S	.	.	S	Bend	trans	-48.4	-27.8	-171.7	-74.4	169.3	0	0	0	115.5	S189 Q619 P620	S189-L191 PolarHBondContact O-N 3.38Å; L191-Q619 WeakPolarHBondContact O-CA 3.17Å; L191-P620 VanDerWaalsContact O-CD 3.28Å; L191-P620 WeakPolarHBondContact O-CD 3.36Å
192	N	64.7	Low	56.6	Low	18 Å²	18	49.2 Å²	49.2	10%	0.096	29%	0.291	C	S	.	.	S	Bend	trans	-130.7	130.1	175.3	-45	43.2	0	0	0	108.1	P190 L592 P620 R650	P190-N192 CarbonylContact O-C 3.56Å; P190-N192 PolarHBondContact O-N 3.05Å; N192-L592 WeakPolarHBondContact ND2-CD2 3.38Å; N192-P620 WeakPolarHBondContact CA-O 3.48Å; N192-P620 HydrophobicContact CB-CG 4.21Å; N192-P620 WeakPolarHBondContact CB-O 3.25Å; N192-P620 WeakPolarHBondContact ND2-CG 3.42Å; N192-R650 WeakPolarHBondContact O-CD 3.1Å; N192-R650 PolarHBondContact O-NH1 3.04Å
193	T	78.8	Confident	57	Low	19 Å²	19	49.4 Å²	49.4	12%	0.117	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	146.2	173	49.8	0	0	0	0	111.1	P190 P620 C621 I622	P190-T193 HydrophobicContact CG-CG2 4.23Å; T193-P620 PolarHBondContact N-O 3.1Å; T193-C621 WeakPolarHBondContact O-CA 3.29Å; T193-C621 WeakPolarHBondContact OG1-CB 3.38Å; T193-C621 PolarHBondContact OG1-SG 3.46Å; T193-I622 PolarHBondContact O-N 3.39Å
194	I	81.5	Confident	56.9	Low	0 Å²	0	53.5 Å²	53.5	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	111.6	-178.7	-53.4	175.5	0	0	0	110.2	F247 D248 I622 A643 I646 N647	I194-F247 HydrophobicContact CG2-CD1 3.99Å; I194-D248 PolarHBondContact N-OD2 3.36Å; I194-D248 WeakPolarHBondContact O-CB 3.44Å; I194-D248 PolarHBondContact O-N 3.33Å; I194-I622 WeakPolarHBondContact CA-O 3.28Å; I194-I622 HydrophobicContact CG1-CB 4.41Å; I194-A643 HydrophobicContact CG2-CB 4.18Å; I194-I646 HydrophobicContact CD1-CB 4.06Å; I194-I646 HydrophobicContact CD1-CG2 3.91Å; I194-N647 HydrophobicContact CD1-CB 3.78Å
195	H	85.2	Confident	56.8	Low	4 Å²	4	62.3 Å²	62.3	2%	0.019	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	122.4	179.4	-61.8	-132.8	0	0	0	107.4	N249 M263 I622 L623 A624	H195-N249 PolarHBondContact CE1-ND2 2.98Å; H195-M263 PolarHBondContact CE1-O 3.13Å; H195-M263 VanDerWaalsContact CE1-O 3.31Å; H195-I622 PolarHBondContact N-O 2.89Å; H195-L623 HydrophobicContact CB-CD2 4.04Å; H195-A624 PolarHBondContact O-N 2.88Å
196	L	84.7	Confident	56.6	Low	0 Å²	0	63.3 Å²	63.3	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	134.2	162.4	-85	-179	0	0	0	108.5	I224 F247 N249 I250 V251 A624 I626 I640	L196-I224 HydrophobicContact CB-CD1 4.37Å; L196-I224 HydrophobicContact CD1-CB 4.39Å; L196-I224 HydrophobicContact CD1-CD1 3.52Å; L196-I224 HydrophobicContact CD1-CG2 4.47Å; L196-F247 HydrophobicContact CD1-CD1 4.34Å; L196-F247 HydrophobicContact CD1-CD2 3.33Å; L196-F247 HydrophobicContact CD1-CE1 4.26Å; L196-F247 HydrophobicContact CD1-CE2 3.22Å; L196-F247 HydrophobicContact CD1-CG 3.91Å; L196-F247 HydrophobicContact CD1-CZ 3.73Å; L196-F247 HydrophobicContact CG-CD1 4.1Å; L196-F247 HydrophobicContact CG-CD2 3.92Å; L196-F247 HydrophobicContact CG-CE1 4.21Å; L196-F247 HydrophobicContact CG-CE2 4.02Å; L196-F247 HydrophobicContact CG-CG 3.95Å; L196-F247 HydrophobicContact CG-CZ 4.17Å; L196-N249 PolarHBondContact N-O 3.31Å; L196-N249 VanDerWaalsContact N-O 3.07Å; L196-I250 CarbonylContact O-C 3.58Å; L196-I250 WeakPolarHBondContact O-CA 3.36Å; L196-V251 PolarHBondContact O-N 3.47Å; L196-A624 CarbonylContact C-O 3.42Å; L196-A624 WeakPolarHBondContact CA-O 3.39Å; L196-A624 HydrophobicContact CD2-CB 3.63Å; L196-A624 VanDerWaalsContact CD2-O 3.32Å; L196-A624 WeakPolarHBondContact CD2-O 3.45Å; L196-I626 HydrophobicContact CD1-CD1 4.15Å; L196-I626 HydrophobicContact CD2-CD1 4.12Å; L196-I626 HydrophobicContact CD2-CG1 4.37Å; L196-I626 HydrophobicContact CD2-CG2 4.06Å; L196-I640 HydrophobicContact CD1-CG1 4.38Å; L196-I640 HydrophobicContact CD2-CG1 4.31Å
197	K	87.8	Confident	56.7	Low	15 Å²	15	67.1 Å²	67.1	7%	0.065	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	134.6	166.8	-179.7	166.2	170.8	178.5	0	109.9	D199 V251 F260 S293 A624 H625 I626	K197-D199 WeakPolarHBondContact CE-OD1 3.29Å; K197-V251 WeakPolarHBondContact CA-O 3.47Å; K197-V251 HydrophobicContact CB-CB 4.16Å; K197-V251 HydrophobicContact CD-CG1 4.17Å; K197-V251 HydrophobicContact CG-CB 4.23Å; K197-V251 HydrophobicContact CG-CG1 4.1Å; K197-F260 HydrophobicContact CD-CD1 4.49Å; K197-F260 HydrophobicContact CD-CD2 4.37Å; K197-F260 HydrophobicContact CD-CE1 4.03Å; K197-F260 HydrophobicContact CD-CE2 3.89Å; K197-F260 HydrophobicContact CD-CZ 3.68Å; K197-S293 WeakPolarHBondContact CD-OG 3.01Å; K197-S293 PolarHBondContact NZ-OG 2.77Å; K197-A624 PolarHBondContact N-O 3.44Å; K197-H625 WeakPolarHBondContact O-CA 3.38Å; K197-I626 WeakPolarHBondContact O-CG1 3.34Å; K197-I626 PolarHBondContact O-N 3.36Å
198	M	81.7	Confident	56.5	Low	2 Å²	2	69 Å²	69	1%	0.01	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	109.8	-173.9	-171.1	178.9	-60.6	0	0	110.4	I215 I217 I224 V251 Q253 I626 E628	M198-I215 HydrophobicContact CE-CB 4.12Å; M198-I215 HydrophobicContact CE-CD1 3.82Å; M198-I215 HydrophobicContact CE-CG2 3.63Å; M198-I215 HydrophobicContact SD-CD1 4.23Å; M198-I217 HydrophobicContact CE-CD1 3.56Å; M198-I217 HydrophobicContact CE-CG1 3.85Å; M198-I217 HydrophobicContact SD-CD1 3.75Å; M198-I217 HydrophobicContact SD-CG1 4.43Å; M198-I224 HydrophobicContact CE-CD1 3.52Å; M198-I224 HydrophobicContact CE-CG1 4.02Å; M198-V251 PolarHBondContact N-O 3.47Å; M198-Q253 WeakPolarHBondContact O-CG 3.49Å; M198-Q253 PolarHBondContact O-NE2 2.91Å; M198-I626 WeakPolarHBondContact CA-O 3.35Å; M198-I626 HydrophobicContact CB-CD1 4.45Å; M198-I626 HydrophobicContact CB-CG1 4.16Å; M198-I626 HydrophobicContact CE-CD1 3.79Å; M198-I626 HydrophobicContact CG-CD1 4.47Å; M198-I626 HydrophobicContact CG-CG1 4.3Å; M198-E628 HydrophobicContact CG-CG 3.69Å; M198-E628 HydrophobicContact SD-CG 3.35Å; M198-E628 WeakPolarHBondContact SD-CG 3.33Å
199	D	77.7	Confident	56.7	Low	14 Å²	14	67.7 Å²	67.7	8%	0.075	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	146.4	-178.6	-56.4	-55.4	0	0	0	111.2	K197 G289 H625 I626	K197-D199 WeakPolarHBondContact CE-OD1 3.29Å; D199-G289 WeakPolarHBondContact OD2-CA 3.15Å; D199-G289 PolarHBondContact OD2-N 2.78Å; D199-H625 IonicContact OD2-CE1 3.61Å; D199-H625 PolarHBondContact OD2-CE1 3.3Å; D199-H625 IonicContact OD2-CG 2.74Å; D199-H625 IonicContact OD2-ND1 2.69Å; D199-H625 PolarHBondContact OD2-ND1 2.91Å; D199-I626 PolarHBondContact N-O 3.43Å
200	R	62	Low	56.6	Low	157 Å²	157	71.9 Å²	71.9	59%	0.592	41%	0.406	S	S	*	.			trans	-81.7	142.6	157.1	-82.4	170.7	-159.6	143.4	16.3	109	T202 E628	R200-T202 PolarHBondContact O-N 3.48Å; R200-E628 IonicContact NE-OE1 3.56Å; R200-E628 IonicContact NH2-OE1 2.77Å
201	S	53.4	Low	56.8	Low	41 Å²	41	74 Å²	74	29%	0.287	42%	0.421	S	S	.	.			trans	-67.7	110.6	179.2	47.7	0	0	0	0	111.1	S203	S201-S203 PolarHBondContact O-N 2.95Å
202	T	44.9	Very low	57.4	Low	125 Å²	125	74.7 Å²	74.7	77%	0.767	43%	0.432	S	S	*	.			trans	-83.7	55.4	-178.6	56.7	0	0	0	0	112.5	R200	R200-T202 PolarHBondContact O-N 3.48Å
203	S	37.8	Very low	58.2	Low	59 Å²	59	76 Å²	76	41%	0.413	44%	0.443	S	S	.	.			trans	179.5	128.8	177.8	52.8	0	0	0	0	107.2	S201	S201-S203 PolarHBondContact O-N 2.95Å
204	D	33.4	Very low	58.6	Low	150 Å²	150	75.3 Å²	75.3	80%	0.802	44%	0.439	S	S	*	.			cis	-138.1	-177.2	5.3	-70.9	-51	0	0	0	111.4	S206	D204-S206 PolarHBondContact O-N 3.37Å
205	F	30.3	Very low	59	Low	216 Å²	216	76 Å²	76	95%	0.947	44%	0.443	S	S	*	.			trans	-57.1	98.2	-176.2	-79.4	-103.8	0	0	0	114.6
206	S	29.6	Very low	59.2	Low	83 Å²	83	81.5 Å²	81.5	58%	0.58	47%	0.468	S	S	*	.			trans	-171	116.6	142.6	43.5	0	0	0	0	112.7	D204 I208	D204-S206 PolarHBondContact O-N 3.37Å; S206-I208 PolarHBondContact O-N 2.77Å
207	P	35.7	Very low	59.4	Low	137 Å²	137	84 Å²	84	89%	0.89	48%	0.481	S	S	*	.			trans	-79.4	46.4	167.3	35.4	-35.5	0	0	0	111
208	I	30.2	Very low	59.4	Low	145 Å²	145	85.4 Å²	85.4	74%	0.744	49%	0.489	S	S	*	.			trans	-123.2	42.8	-169.4	-41.2	179.8	0	0	0	111.3	S206	S206-I208 PolarHBondContact O-N 2.77Å
209	S	40.8	Very low	59.4	Low	89 Å²	89	90.3 Å²	90.3	62%	0.622	51%	0.512	S	S	*	.	S	Bend	trans	-159.2	146.4	143.4	60.7	0	0	0	0	109.5	S211	S209-S211 VanDerWaalsContact C-N 3.25Å; S209-S211 PolarHBondContact O-N 3.47Å
210	S	43.5	Very low	59.7	Low	123 Å²	123	97.3 Å²	97.3	86%	0.86	55%	0.55	S	S	*	.			trans	-75.3	81.5	170.6	56.7	0	0	0	0	109.1	S212	S210-S212 PolarHBondContact O-N 3.39Å
211	S	54.3	Low	60.9	Low	81 Å²	81	95.7 Å²	95.7	57%	0.566	55%	0.547	S	S	*	.			trans	-59	95.4	-177.2	-57.7	0	0	0	0	111.5	S209 S213	S209-S211 VanDerWaalsContact C-N 3.25Å; S209-S211 PolarHBondContact O-N 3.47Å; S211-S213 PolarHBondContact O-N 3.43Å; S211-S213 VanDerWaalsContact O-N 3.1Å
212	S	66.7	Low	62.6	Low	90 Å²	90	98.3 Å²	98.3	63%	0.629	55%	0.55	S	S	*	*			trans	-65.7	108.8	178.5	41.3	0	0	0	0	109.9	S210 C214 V630	S210-S212 PolarHBondContact O-N 3.39Å; S212-C214 PolarHBondContact O-N 3.47Å; S212-V630 WeakPolarHBondContact O-CG2 3.1Å
213	S	82.4	Confident	64.8	Low	46 Å²	46	94.1 Å²	94.1	32%	0.322	52%	0.523	S	S	.	.			trans	-58.9	125.8	-178.8	-171.7	0	0	0	0	110.4	S211 I215 E628	S211-S213 PolarHBondContact O-N 3.43Å; S211-S213 VanDerWaalsContact O-N 3.1Å; S213-I215 PolarHBondContact O-N 2.97Å; S213-I215 PolarHBondContact OG-O 2.98Å; S213-E628 WeakPolarHBondContact OG-CB 3.25Å; S213-E628 PolarHBondContact OG-OE2 3.27Å
214	C	87.5	Confident	67.3	Low	5 Å²	5	91.3 Å²	91.3	3%	0.034	50%	0.503	C	S	.	.	S	Bend	trans	-82.1	7.7	-179.8	66.4	0	0	0	0	113.3	S212 L227 E628 V630 Y633	S212-C214 PolarHBondContact O-N 3.47Å; C214-L227 PolarHBondContact O-N 2.72Å; C214-E628 PolarHBondContact N-O 2.84Å; C214-E628 VanDerWaalsContact N-O 3.08Å; C214-E628 PolarHBondContact SG-O 3.36Å; C214-V630 HydrophobicContact CB-CG2 3.94Å; C214-Y633 HydrophobicContact CB-CD2 3.95Å; C214-Y633 HydrophobicContact CB-CE2 4.5Å
215	I	89.1	Confident	70.1	Confident	14 Å²	14	84.8 Å²	84.8	7%	0.072	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	132.4	-172.9	-40.7	-176.1	0	0	0	110.5	M198 S213 I224 T225 L226 I626 S627 T636	M198-I215 HydrophobicContact CE-CB 4.12Å; M198-I215 HydrophobicContact CE-CD1 3.82Å; M198-I215 HydrophobicContact CE-CG2 3.63Å; M198-I215 HydrophobicContact SD-CD1 4.23Å; S213-I215 PolarHBondContact O-N 2.97Å; S213-I215 PolarHBondContact OG-O 2.98Å; I215-I224 HydrophobicContact CG2-CB 4.47Å; I215-I224 HydrophobicContact CG2-CG1 3.99Å; I215-I224 HydrophobicContact CG2-CG2 3.87Å; I215-T225 WeakPolarHBondContact CA-O 3.4Å; I215-L226 HydrophobicContact CB-CD1 4.49Å; I215-L226 HydrophobicContact CD1-CD1 4.16Å; I215-L226 HydrophobicContact CG1-CD1 3.87Å; I215-L226 HydrophobicContact CG2-CD1 4.16Å; I215-I626 HydrophobicContact CD1-CD1 4.09Å; I215-S627 WeakPolarHBondContact CD1-O 3.49Å; I215-T636 HydrophobicContact CD1-CG2 4Å
216	Q	89.9	Confident	72.9	Confident	120 Å²	120	74.5 Å²	74.5	56%	0.561	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.3	141.6	165.5	-179.9	-178.6	17.9	0	0	109.1	T225	Q216-T225 HydrophobicContact CB-CG2 4.37Å; Q216-T225 PolarHBondContact N-O 3.24Å; Q216-T225 WeakPolarHBondContact O-CB 3.23Å; Q216-T225 PolarHBondContact O-N 2.97Å
217	I	88.1	Confident	75.7	Confident	53 Å²	53	73.8 Å²	73.8	27%	0.272	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	140.4	-177.9	-46.4	178.2	0	0	0	110.1	M198 E219 I224 I250 T252	M198-I217 HydrophobicContact CE-CD1 3.56Å; M198-I217 HydrophobicContact CE-CG1 3.85Å; M198-I217 HydrophobicContact SD-CD1 3.75Å; M198-I217 HydrophobicContact SD-CG1 4.43Å; I217-E219 HydrophobicContact CG2-CG 3.68Å; I217-I224 HydrophobicContact CG1-CG1 4.1Å; I217-I224 HydrophobicContact CG2-CG1 4.32Å; I217-I250 HydrophobicContact CG2-CD1 4.25Å; I217-I250 HydrophobicContact CG2-CG2 3.96Å; I217-T252 HydrophobicContact CD1-CG2 3.6Å
218	D	89.2	Confident	78.1	Confident	43 Å²	43	70 Å²	70	23%	0.23	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	88.4	161.8	-173.4	-30.7	0	0	0	108.5	N220 K221 R222 I223	D218-N220 VanDerWaalsContact C-N 3.29Å; D218-N220 PolarHBondContact O-N 3.02Å; D218-N220 PolarHBondContact OD1-N 2.99Å; D218-K221 HydrophobicContact CB-CB 4.29Å; D218-K221 CarbonylContact O-C 3.58Å; D218-K221 PolarHBondContact O-N 3.31Å; D218-K221 WeakPolarHBondContact OD1-CB 3.27Å; D218-K221 WeakPolarHBondContact OD1-CG 3.46Å; D218-K221 PolarHBondContact OD1-N 3.45Å; D218-K221 WeakPolarHBondContact OD2-CD 3.32Å; D218-K221 WeakPolarHBondContact OD2-CE 3.38Å; D218-K221 WeakPolarHBondContact OD2-CG 3.46Å; D218-K221 IonicContact OD2-NZ 3.58Å; D218-K221 PolarHBondContact OD2-NZ 2.84Å; D218-R222 WeakPolarHBondContact O-CA 3.41Å; D218-R222 PolarHBondContact O-N 3.36Å; D218-I223 HydrophobicContact CB-CB 4.44Å; D218-I223 PolarHBondContact N-O 2.63Å; D218-I223 PolarHBondContact O-N 3.3Å
219	E	81.6	Confident	80.5	Confident	106 Å²	106	65.5 Å²	65.5	50%	0.495	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-40.5	-177.3	-60	178.2	161	0	0	111.5	I217 K221 R222 T252	I217-E219 HydrophobicContact CG2-CG 3.68Å; E219-K221 PolarHBondContact O-N 3.45Å; E219-R222 WeakPolarHBondContact O-CA 3.44Å; E219-R222 WeakPolarHBondContact O-CG 3.27Å; E219-R222 PolarHBondContact O-N 3.41Å; E219-T252 VanDerWaalsContact OE1-CG2 3.31Å; E219-T252 WeakPolarHBondContact OE1-CG2 3.23Å
220	N	84.2	Confident	82.2	Confident	161 Å²	161	65.6 Å²	65.6	86%	0.861	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-41.1	178.7	-75.8	-69.3	0	0	0	112.2	D218 R222	D218-N220 VanDerWaalsContact C-N 3.29Å; D218-N220 PolarHBondContact O-N 3.02Å; D218-N220 PolarHBondContact OD1-N 2.99Å; N220-R222 VanDerWaalsContact C-N 3.33Å
221	K	86.5	Confident	82.9	Confident	122 Å²	122	65 Å²	65	53%	0.53	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-10.8	172.9	-61.9	-172.6	-168.1	84	0	112.7	D218 E219 I223 K246	D218-K221 HydrophobicContact CB-CB 4.29Å; D218-K221 CarbonylContact O-C 3.58Å; D218-K221 PolarHBondContact O-N 3.31Å; D218-K221 WeakPolarHBondContact OD1-CB 3.27Å; D218-K221 WeakPolarHBondContact OD1-CG 3.46Å; D218-K221 PolarHBondContact OD1-N 3.45Å; D218-K221 WeakPolarHBondContact OD2-CD 3.32Å; D218-K221 WeakPolarHBondContact OD2-CE 3.38Å; D218-K221 WeakPolarHBondContact OD2-CG 3.46Å; D218-K221 IonicContact OD2-NZ 3.58Å; D218-K221 PolarHBondContact OD2-NZ 2.84Å; E219-K221 PolarHBondContact O-N 3.45Å; K221-I223 VanDerWaalsContact C-N 3.33Å; K221-I223 HydrophobicContact CB-CB 4.4Å; K221-I223 HydrophobicContact CB-CD1 3.77Å; K221-I223 HydrophobicContact CB-CG1 3.9Å; K221-I223 HydrophobicContact CD-CD1 4.27Å; K221-K246 WeakPolarHBondContact O-CE 3.44Å; K221-K246 PolarHBondContact O-NZ 2.99Å
222	R	88.5	Confident	82.9	Confident	96 Å²	96	64.8 Å²	64.8	36%	0.362	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.5	46.9	-168.5	-57.1	-171.2	-179.3	170.9	-2.2	112.3	D218 E219 N220 K246 F247 D248 N249 I250	D218-R222 WeakPolarHBondContact O-CA 3.41Å; D218-R222 PolarHBondContact O-N 3.36Å; E219-R222 WeakPolarHBondContact O-CA 3.44Å; E219-R222 WeakPolarHBondContact O-CG 3.27Å; E219-R222 PolarHBondContact O-N 3.41Å; N220-R222 VanDerWaalsContact C-N 3.33Å; R222-K246 WeakPolarHBondContact O-CA 3.37Å; R222-K246 WeakPolarHBondContact O-CG 3.43Å; R222-F247 PolarHBondContact O-N 2.9Å; R222-D248 WeakPolarHBondContact CD-O 3.31Å; R222-D248 PolarHBondContact NH1-O 3.47Å; R222-N249 PolarHBondContact NH1-OD1 3.12Å; R222-I250 VanDerWaalsContact C-CD1 3.44Å
223	I	90.9	Very high	82	Confident	37 Å²	37	72.1 Å²	72.1	19%	0.19	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	135.8	179.7	-63.5	175.8	0	0	0	109.5	D218 K221 N244 Y245 K246	D218-I223 HydrophobicContact CB-CB 4.44Å; D218-I223 PolarHBondContact N-O 2.63Å; D218-I223 PolarHBondContact O-N 3.3Å; K221-I223 VanDerWaalsContact C-N 3.33Å; K221-I223 HydrophobicContact CB-CB 4.4Å; K221-I223 HydrophobicContact CB-CD1 3.77Å; K221-I223 HydrophobicContact CB-CG1 3.9Å; K221-I223 HydrophobicContact CD-CD1 4.27Å; I223-N244 HydrophobicContact CG2-CB 4Å; I223-Y245 CarbonylContact C-O 3.3Å; I223-Y245 VanDerWaalsContact CA-O 3.3Å; I223-Y245 WeakPolarHBondContact CA-O 3.47Å; I223-K246 HydrophobicContact CG1-CB 4.19Å; I223-K246 HydrophobicContact CG1-CD 4.23Å; I223-K246 HydrophobicContact CG1-CG 4.5Å
224	I	91.2	Very high	80	Confident	0 Å²	0	81.4 Å²	81.4	0%	0	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	138.9	164	-102.2	157	0	0	0	108.9	L196 M198 I215 I217 L226 N244 Y245 I250 I626 I640	L196-I224 HydrophobicContact CB-CD1 4.37Å; L196-I224 HydrophobicContact CD1-CB 4.39Å; L196-I224 HydrophobicContact CD1-CD1 3.52Å; L196-I224 HydrophobicContact CD1-CG2 4.47Å; M198-I224 HydrophobicContact CE-CD1 3.52Å; M198-I224 HydrophobicContact CE-CG1 4.02Å; I215-I224 HydrophobicContact CG2-CB 4.47Å; I215-I224 HydrophobicContact CG2-CG1 3.99Å; I215-I224 HydrophobicContact CG2-CG2 3.87Å; I217-I224 HydrophobicContact CG1-CG1 4.1Å; I217-I224 HydrophobicContact CG2-CG1 4.32Å; I224-L226 HydrophobicContact CG2-CD1 4.29Å; I224-N244 CarbonylContact O-C 3.58Å; I224-N244 WeakPolarHBondContact O-CA 3.5Å; I224-Y245 PolarHBondContact N-O 2.78Å; I224-Y245 PolarHBondContact O-N 3.49Å; I224-I250 HydrophobicContact CB-CD1 4.34Å; I224-I250 HydrophobicContact CD1-CD1 3.99Å; I224-I250 HydrophobicContact CD1-CG1 4.17Å; I224-I250 HydrophobicContact CD1-CG2 3.65Å; I224-I250 HydrophobicContact CG1-CD1 3.96Å; I224-I250 HydrophobicContact CG1-CG2 4.4Å; I224-I626 HydrophobicContact CD1-CD1 4.01Å; I224-I640 HydrophobicContact CG2-CD1 4.07Å
225	T	91.6	Very high	77.8	Confident	14 Å²	14	91.4 Å²	91.4	9%	0.086	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	110.1	-174.2	-65.2	0	0	0	0	108	I215 Q216 L227 V242 R243 N244	I215-T225 WeakPolarHBondContact CA-O 3.4Å; Q216-T225 HydrophobicContact CB-CG2 4.37Å; Q216-T225 PolarHBondContact N-O 3.24Å; Q216-T225 WeakPolarHBondContact O-CB 3.23Å; Q216-T225 PolarHBondContact O-N 2.97Å; T225-L227 HydrophobicContact CG2-CD2 4.33Å; T225-V242 HydrophobicContact CG2-CG1 3.3Å; T225-R243 WeakPolarHBondContact CA-O 3.27Å; T225-N244 WeakPolarHBondContact CG2-OD1 3.49Å; T225-N244 PolarHBondContact OG1-OD1 3.4Å
226	L	90.1	Very high	75.3	Confident	0 Å²	0	103 Å²	103	0%	0	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	123.2	178.1	-125.5	72.1	0	0	0	110.7	I215 I224 R243 Y633 T636 L637 I640	I215-L226 HydrophobicContact CB-CD1 4.49Å; I215-L226 HydrophobicContact CD1-CD1 4.16Å; I215-L226 HydrophobicContact CG1-CD1 3.87Å; I215-L226 HydrophobicContact CG2-CD1 4.16Å; I224-L226 HydrophobicContact CG2-CD1 4.29Å; L226-R243 HydrophobicContact CB-CB 4.28Å; L226-R243 PolarHBondContact N-O 3.34Å; L226-R243 PolarHBondContact O-N 3.28Å; L226-Y633 HydrophobicContact CD2-CD2 4.19Å; L226-Y633 HydrophobicContact CD2-CE2 3.55Å; L226-Y633 HydrophobicContact CG-CD2 4.48Å; L226-Y633 HydrophobicContact CG-CE2 3.78Å; L226-T636 HydrophobicContact CD1-CG2 4.32Å; L226-L637 HydrophobicContact CD2-CB 3.94Å; L226-L637 HydrophobicContact CD2-CD1 3.72Å; L226-L637 HydrophobicContact CD2-CG 4.38Å; L226-I640 HydrophobicContact CD1-CD1 3.5Å; L226-I640 VanDerWaalsContact CD1-CD1 3.5Å; L226-I640 HydrophobicContact CD2-CD1 4.47Å
227	L	88.4	Confident	73	Confident	68 Å²	68	101.1 Å²	101.1	36%	0.356	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-94.5	126.1	174.3	-56.4	176.6	0	0	0	108	C214 T225 P229 Y633	C214-L227 PolarHBondContact O-N 2.72Å; T225-L227 HydrophobicContact CG2-CD2 4.33Å; L227-P229 WeakPolarHBondContact O-CD 3.47Å; L227-Y633 WeakPolarHBondContact O-CE2 3.46Å
228	D	84.8	Confident	70.9	Confident	58 Å²	58	103.6 Å²	103.6	31%	0.31	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-76.9	118.8	179.1	-159	-59.1	0	0	0	109.9	T230 R243 Y633	D228-T230 PolarHBondContact O-N 3Å; D228-T230 WeakPolarHBondContact OD1-CB 3.5Å; D228-T230 PolarHBondContact OD1-N 3.36Å; D228-T230 VanDerWaalsContact OD1-N 3.11Å; D228-T230 PolarHBondContact OD1-OG1 3.47Å; D228-R243 IonicContact OD2-NH2 3.49Å; D228-R243 PolarHBondContact OD2-NH2 3.2Å; D228-Y633 WeakPolarHBondContact CA-OH 3.34Å; D228-Y633 PolarHBondContact OD2-OH 3.29Å
229	P	80.8	Confident	68.7	Low	50 Å²	50	104.6 Å²	104.6	33%	0.325	53%	0.527	S	S	.	.			trans	-75.7	-5.3	-175.1	32.3	-36.5	0	0	0	112.8	L227 P231 V630 Y633	L227-P229 WeakPolarHBondContact O-CD 3.47Å; P229-P231 WeakPolarHBondContact O-CD 3.3Å; P229-V630 HydrophobicContact CB-CB 4.49Å; P229-V630 HydrophobicContact CB-CG1 3.67Å; P229-V630 HydrophobicContact CB-CG2 4.03Å; P229-V630 HydrophobicContact CG-CG1 3.97Å; P229-Y633 HydrophobicContact CG-CD1 3.98Å; P229-Y633 HydrophobicContact CG-CD2 4.06Å; P229-Y633 HydrophobicContact CG-CE1 4.47Å; P229-Y633 HydrophobicContact CG-CG 3.76Å
230	T	77.9	Confident	67.5	Low	90 Å²	90	101.5 Å²	101.5	55%	0.552	52%	0.523	S	S	*	.	S	Bend	trans	-81.9	108.7	-179.8	64	0	0	0	0	111.3	D228 S232	D228-T230 PolarHBondContact O-N 3Å; D228-T230 WeakPolarHBondContact OD1-CB 3.5Å; D228-T230 PolarHBondContact OD1-N 3.36Å; D228-T230 VanDerWaalsContact OD1-N 3.11Å; D228-T230 PolarHBondContact OD1-OG1 3.47Å; T230-S232 PolarHBondContact O-N 3.18Å; T230-S232 VanDerWaalsContact O-N 3.15Å
231	P	57.3	Low	66.5	Low	111 Å²	111	95.4 Å²	95.4	72%	0.721	50%	0.496	S	S	*	.			trans	-64.2	121.9	176.6	27.2	-34.2	0	0	0	108.7	P229 R233	P229-P231 WeakPolarHBondContact O-CD 3.3Å; P231-R233 VanDerWaalsContact C-N 3.3Å; P231-R233 PolarHBondContact O-N 3.38Å
232	S	54	Low	66.1	Low	76 Å²	76	93.4 Å²	93.4	53%	0.531	49%	0.493	S	S	.	.			trans	-72.7	68.1	-152.3	-45.6	0	0	0	0	115.5	T230 R234	T230-S232 PolarHBondContact O-N 3.18Å; T230-S232 VanDerWaalsContact O-N 3.15Å; S232-R234 PolarHBondContact O-N 3.29Å; S232-R234 VanDerWaalsContact O-N 3.07Å
233	R	47.8	Very low	66	Low	245 Å²	245	91.1 Å²	91.1	93%	0.925	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-10.2	-177.7	-81.8	-167.7	171.1	-151.1	-1.8	115.3	P231	P231-R233 VanDerWaalsContact C-N 3.3Å; P231-R233 PolarHBondContact O-N 3.38Å
234	R	40.3	Very low	65.9	Low	240 Å²	240	94.2 Å²	94.2	91%	0.906	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-143	70.1	-179.5	-70.2	-169	176.3	164.5	3.3	115.6	S232	S232-R234 PolarHBondContact O-N 3.29Å; S232-R234 VanDerWaalsContact O-N 3.07Å
235	R	41.7	Very low	66	Low	215 Å²	215	95.9 Å²	95.9	81%	0.811	51%	0.508	S	S	*	.				174.9	128.4	128.5	-96.2	168.6	-166.7	-158	5.7	110.7	G237	R235-G237 PolarHBondContact O-N 2.97Å
236	R	36.5	Very low	65.9	Low	258 Å²	258	100.5 Å²	100.5	97%	0.974	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	126.6	166.8	-62.1	178.8	-175.7	169.3	0.8	108.3
237	G	40.8	Very low	65.9	Low	81 Å²	81	100.7 Å²	100.7	84%	0.835	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	118.5	-10	168.3	0	0	0	0	0	117.6	R235	R235-G237 PolarHBondContact O-N 2.97Å
238	V	43.9	Very low	65.9	Low	104 Å²	104	98.8 Å²	98.8	63%	0.63	52%	0.518	S	S	*	.			trans	-130.8	101.7	170.5	-175.6	0	0	0	0	108.3	A241	V238-A241 HydrophobicContact CG1-CB 4.29Å
239	G	44.7	Very low	66.1	Low	65 Å²	65	97.2 Å²	97.2	67%	0.67	51%	0.51	S	S	*	.			trans	-62.9	147.2	167.9	0	0	0	0	0	109.9	A241	G239-A241 WeakPolarHBondContact O-CA 3.34Å; G239-A241 PolarHBondContact O-N 3.16Å
240	G	55.6	Low	66.5	Low	40 Å²	40	95.8 Å²	95.8	41%	0.412	50%	0.499	S	S	.	.			trans	-41.7	105.5	-172.3	0	0	0	0	0	112.4	V242	G240-V242 PolarHBondContact O-N 3.13Å
241	A	63.5	Low	67.1	Low	34 Å²	34	91.5 Å²	91.5	28%	0.281	47%	0.473	S	S	.	.			trans	-74.4	102.5	-159.4	0	0	0	0	0	110.8	V238 G239 R243	V238-A241 HydrophobicContact CG1-CB 4.29Å; G239-A241 WeakPolarHBondContact O-CA 3.34Å; G239-A241 PolarHBondContact O-N 3.16Å; A241-R243 WeakPolarHBondContact O-CG 3.36Å; A241-R243 PolarHBondContact O-N 3.34Å
242	V	77.5	Confident	68.5	Low	79 Å²	79	87 Å²	87	48%	0.479	44%	0.443	S	S	.	.			trans	-59.4	112	-174.2	179.8	0	0	0	0	110.7	T225 G240	T225-V242 HydrophobicContact CG2-CG1 3.3Å; G240-V242 PolarHBondContact O-N 3.13Å
243	R	86.1	Confident	69.7	Low	49 Å²	49	86.2 Å²	86.2	19%	0.185	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	104.2	-171.3	-80.9	179.7	-81.6	-137.7	-4.7	111.9	T225 L226 D228 A241 Y245 Y633	T225-R243 WeakPolarHBondContact CA-O 3.27Å; L226-R243 HydrophobicContact CB-CB 4.28Å; L226-R243 PolarHBondContact N-O 3.34Å; L226-R243 PolarHBondContact O-N 3.28Å; D228-R243 IonicContact OD2-NH2 3.49Å; D228-R243 PolarHBondContact OD2-NH2 3.2Å; A241-R243 WeakPolarHBondContact O-CG 3.36Å; A241-R243 PolarHBondContact O-N 3.34Å; R243-Y245 HydrophobicContact CB-CD2 4.35Å; R243-Y245 HydrophobicContact CB-CE2 3.63Å; R243-Y245 WeakPolarHBondContact O-CD2 3.39Å; R243-Y633 PolarHBondContact NH2-OH 3.41Å
244	N	90.2	Very high	71.3	Confident	102 Å²	102	81.2 Å²	81.2	55%	0.545	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	127.2	179.2	-62.5	-8.1	0	0	0	111.8	I223 I224 T225	I223-N244 HydrophobicContact CG2-CB 4Å; I224-N244 CarbonylContact O-C 3.58Å; I224-N244 WeakPolarHBondContact O-CA 3.5Å; T225-N244 WeakPolarHBondContact CG2-OD1 3.49Å; T225-N244 PolarHBondContact OG1-OD1 3.4Å
245	Y	92.5	Very high	73.5	Confident	35 Å²	35	71.1 Å²	71.1	14%	0.137	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	136.3	-178.6	-63.5	-80.8	0	0	0	111	I223 I224 R243 I640 T644	I223-Y245 CarbonylContact C-O 3.3Å; I223-Y245 VanDerWaalsContact CA-O 3.3Å; I223-Y245 WeakPolarHBondContact CA-O 3.47Å; I224-Y245 PolarHBondContact N-O 2.78Å; I224-Y245 PolarHBondContact O-N 3.49Å; R243-Y245 HydrophobicContact CB-CD2 4.35Å; R243-Y245 HydrophobicContact CB-CE2 3.63Å; R243-Y245 WeakPolarHBondContact O-CD2 3.39Å; Y245-I640 HydrophobicContact CD1-CG2 3.88Å; Y245-I640 HydrophobicContact CD2-CG2 3.35Å; Y245-I640 HydrophobicContact CE1-CG2 4.16Å; Y245-I640 HydrophobicContact CE2-CG2 3.63Å; Y245-I640 HydrophobicContact CG-CG2 3.46Å; Y245-I640 VanDerWaalsContact CG-CG2 3.46Å; Y245-T644 HydrophobicContact CD1-CG2 3.97Å; Y245-T644 VanDerWaalsContact CD1-OG1 3.23Å; Y245-T644 WeakPolarHBondContact CD1-OG1 3.27Å; Y245-T644 HydrophobicContact CE1-CG2 4.38Å
246	K	90.2	Very high	75.7	Confident	110 Å²	110	66 Å²	66	48%	0.478	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	129.6	-174.7	175.9	151.7	-177.5	150.8	0	113.3	K221 R222 I223 N647	K221-K246 WeakPolarHBondContact O-CE 3.44Å; K221-K246 PolarHBondContact O-NZ 2.99Å; R222-K246 WeakPolarHBondContact O-CA 3.37Å; R222-K246 WeakPolarHBondContact O-CG 3.43Å; I223-K246 HydrophobicContact CG1-CB 4.19Å; I223-K246 HydrophobicContact CG1-CD 4.23Å; I223-K246 HydrophobicContact CG1-CG 4.5Å; K246-N647 PolarHBondContact O-ND2 2.94Å
247	F	89.9	Confident	78.2	Confident	5 Å²	5	54.5 Å²	54.5	2%	0.022	33%	0.333	C	S	.	.			trans	-121.3	176.2	-173.9	-63.6	-82.6	0	0	0	112.8	I194 L196 R222 I640 A643 T644	I194-F247 HydrophobicContact CG2-CD1 3.99Å; L196-F247 HydrophobicContact CD1-CD1 4.34Å; L196-F247 HydrophobicContact CD1-CD2 3.33Å; L196-F247 HydrophobicContact CD1-CE1 4.26Å; L196-F247 HydrophobicContact CD1-CE2 3.22Å; L196-F247 HydrophobicContact CD1-CG 3.91Å; L196-F247 HydrophobicContact CD1-CZ 3.73Å; L196-F247 HydrophobicContact CG-CD1 4.1Å; L196-F247 HydrophobicContact CG-CD2 3.92Å; L196-F247 HydrophobicContact CG-CE1 4.21Å; L196-F247 HydrophobicContact CG-CE2 4.02Å; L196-F247 HydrophobicContact CG-CG 3.95Å; L196-F247 HydrophobicContact CG-CZ 4.17Å; R222-F247 PolarHBondContact O-N 2.9Å; F247-I640 HydrophobicContact CE2-CG2 4.45Å; F247-I640 HydrophobicContact CZ-CG2 4.12Å; F247-A643 HydrophobicContact CE1-CB 3.7Å; F247-A643 HydrophobicContact CZ-CB 4.43Å; F247-T644 WeakPolarHBondContact CZ-OG1 3.44Å
248	D	88.1	Confident	80.5	Confident	28 Å²	28	53.1 Å²	53.1	15%	0.15	31%	0.305	C	S	.	.	S	Bend	trans	-75.5	-41.3	176	-63.2	-56.7	0	0	0	111.3	I194 R222 R650	I194-D248 PolarHBondContact N-OD2 3.36Å; I194-D248 WeakPolarHBondContact O-CB 3.44Å; I194-D248 PolarHBondContact O-N 3.33Å; R222-D248 WeakPolarHBondContact CD-O 3.31Å; R222-D248 PolarHBondContact NH1-O 3.47Å; D248-R650 IonicContact OD1-CZ 2.72Å; D248-R650 VanDerWaalsContact OD1-CZ 3.27Å; D248-R650 IonicContact OD1-NH1 3.59Å; D248-R650 PolarHBondContact OD1-NH1 3.29Å; D248-R650 IonicContact OD1-NH2 3.81Å; D248-R650 PolarHBondContact OD1-NH2 3.03Å; D248-R650 IonicContact OD2-CZ 3.75Å; D248-R650 IonicContact OD2-NH1 3.9Å; D248-R650 PolarHBondContact OD2-NH1 3.35Å; D248-R650 IonicContact OD2-NH2 3.59Å
249	N	89.5	Confident	82.7	Confident	25 Å²	25	53.5 Å²	53.5	13%	0.134	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	155.2	171.7	-68.2	-56	0	0	0	109.6	H195 L196 R222 M263	H195-N249 PolarHBondContact CE1-ND2 2.98Å; L196-N249 PolarHBondContact N-O 3.31Å; L196-N249 VanDerWaalsContact N-O 3.07Å; R222-N249 PolarHBondContact NH1-OD1 3.12Å; N249-M263 HydrophobicContact CB-CE 3.79Å
250	I	89.7	Confident	84.9	Confident	20 Å²	20	50.5 Å²	50.5	10%	0.103	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	137.5	168.7	-61.2	169.5	0	0	0	105.7	L196 I217 R222 I224	L196-I250 CarbonylContact O-C 3.58Å; L196-I250 WeakPolarHBondContact O-CA 3.36Å; I217-I250 HydrophobicContact CG2-CD1 4.25Å; I217-I250 HydrophobicContact CG2-CG2 3.96Å; R222-I250 VanDerWaalsContact C-CD1 3.44Å; I224-I250 HydrophobicContact CB-CD1 4.34Å; I224-I250 HydrophobicContact CD1-CD1 3.99Å; I224-I250 HydrophobicContact CD1-CG1 4.17Å; I224-I250 HydrophobicContact CD1-CG2 3.65Å; I224-I250 HydrophobicContact CG1-CD1 3.96Å; I224-I250 HydrophobicContact CG1-CG2 4.4Å
251	V	88.9	Confident	86.7	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	121	-175.1	-179.6	0	0	0	0	107.6	L196 K197 M198 T255 F260 M263	L196-V251 PolarHBondContact O-N 3.47Å; K197-V251 WeakPolarHBondContact CA-O 3.47Å; K197-V251 HydrophobicContact CB-CB 4.16Å; K197-V251 HydrophobicContact CD-CG1 4.17Å; K197-V251 HydrophobicContact CG-CB 4.23Å; K197-V251 HydrophobicContact CG-CG1 4.1Å; M198-V251 PolarHBondContact N-O 3.47Å; V251-T255 HydrophobicContact CG1-CG2 3.97Å; V251-F260 HydrophobicContact CB-CD2 4.29Å; V251-F260 HydrophobicContact CG1-CB 4.39Å; V251-F260 HydrophobicContact CG1-CD2 3.7Å; V251-F260 HydrophobicContact CG1-CE2 4.3Å; V251-F260 HydrophobicContact CG1-CG 4.26Å; V251-F260 HydrophobicContact CG2-CD2 3.88Å; V251-F260 HydrophobicContact CG2-CE2 4.22Å; V251-M263 HydrophobicContact CG2-CE 4.36Å; V251-M263 HydrophobicContact CG2-SD 4.44Å
252	T	88.2	Confident	88.1	Confident	16 Å²	16	47.8 Å²	47.8	10%	0.098	24%	0.241	C	C	.	.			trans	-94.8	171.6	178.7	49.6	0	0	0	0	110.7	I217 E219 D254 T255	I217-T252 HydrophobicContact CD1-CG2 3.6Å; E219-T252 VanDerWaalsContact OE1-CG2 3.31Å; E219-T252 WeakPolarHBondContact OE1-CG2 3.23Å; T252-D254 PolarHBondContact O-N 3.37Å; T252-T255 PolarHBondContact N-OG1 3.44Å; T252-T255 WeakPolarHBondContact O-CB 3.49Å; T252-T255 PolarHBondContact O-N 3.12Å; T252-T255 PolarHBondContact O-OG1 3.23Å; T252-T255 PolarHBondContact OG1-OG1 3.04Å
253	Q	78.4	Confident	88.6	Confident	60 Å²	60	46.7 Å²	46.7	28%	0.28	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-27.4	173.6	-71.1	127.8	61.5	0	0	112.7	M198 T255 E628	M198-Q253 WeakPolarHBondContact O-CG 3.49Å; M198-Q253 PolarHBondContact O-NE2 2.91Å; Q253-T255 PolarHBondContact O-N 2.88Å; Q253-E628 PolarHBondContact NE2-OE1 3.21Å
254	D	81.5	Confident	88.9	Confident	139 Å²	139	44.5 Å²	44.5	74%	0.743	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-10.9	178.8	-44.7	-52.4	0	0	0	112.3	T252 L256	T252-D254 PolarHBondContact O-N 3.37Å; D254-L256 PolarHBondContact O-N 3.5Å
255	T	86.3	Confident	89.1	Confident	28 Å²	28	39.6 Å²	39.6	17%	0.172	20%	0.197	C	C	.	.	S	Bend	trans	-78.3	113.2	175.1	-47.9	0	0	0	0	110.4	V251 T252 Q253 E259 F260	V251-T255 HydrophobicContact CG1-CG2 3.97Å; T252-T255 PolarHBondContact N-OG1 3.44Å; T252-T255 WeakPolarHBondContact O-CB 3.49Å; T252-T255 PolarHBondContact O-N 3.12Å; T252-T255 PolarHBondContact O-OG1 3.23Å; T252-T255 PolarHBondContact OG1-OG1 3.04Å; Q253-T255 PolarHBondContact O-N 2.88Å; T255-E259 HydrophobicContact CG2-CB 4.31Å; T255-E259 HydrophobicContact CG2-CG 4.28Å; T255-F260 HydrophobicContact CG2-CB 4.36Å
256	L	88.3	Confident	88.9	Confident	108 Å²	108	38.6 Å²	38.6	57%	0.565	19%	0.194	S	C	*	.			trans	-57.1	141.6	178.1	-63.5	177.8	0	0	0	111.8	D254 Q258 E259 F260	D254-L256 PolarHBondContact O-N 3.5Å; L256-Q258 VanDerWaalsContact C-N 3.28Å; L256-Q258 PolarHBondContact O-N 2.92Å; L256-E259 PolarHBondContact O-N 2.93Å; L256-F260 PolarHBondContact O-N 2.84Å
257	K	89.4	Confident	88.7	Confident	16 Å²	16	34.7 Å²	34.7	7%	0.07	18%	0.178	C	C	.	.	H	α-helix	trans	-53.8	-39.7	180	-92.3	173.6	173.4	172.9	0	113.5	F260 C261 H292 M302 E303	K257-F260 PolarHBondContact O-N 3.12Å; K257-C261 VanDerWaalsContact O-CB 3.32Å; K257-C261 WeakPolarHBondContact O-CB 3.14Å; K257-C261 PolarHBondContact O-N 3.28Å; K257-C261 PolarHBondContact O-SG 2.8Å; K257-H292 WeakPolarHBondContact CE-NE2 3.49Å; K257-H292 PolarHBondContact NZ-CD2 2.65Å; K257-H292 PolarHBondContact NZ-NE2 3.17Å; K257-M302 WeakPolarHBondContact CB-O 3.36Å; K257-E303 VanDerWaalsContact CD-O 3.32Å; K257-E303 WeakPolarHBondContact CD-O 3.35Å; K257-E303 WeakPolarHBondContact CE-O 3.34Å; K257-E303 PolarHBondContact NZ-O 3.13Å; K257-E303 IonicContact NZ-OE2 3.39Å; K257-E303 PolarHBondContact NZ-OE2 3.46Å
258	Q	88.4	Confident	88.8	Confident	52 Å²	52	34.7 Å²	34.7	24%	0.243	18%	0.179	C	C	.	.	H	α-helix	trans	-64	-40.6	176.8	-167.8	-178.5	8.1	0	0	112.3	I112 L256 S262 W313	I112-Q258 PolarHBondContact O-NE2 3.13Å; L256-Q258 VanDerWaalsContact C-N 3.28Å; L256-Q258 PolarHBondContact O-N 2.92Å; Q258-S262 WeakPolarHBondContact O-CB 3.45Å; Q258-S262 PolarHBondContact O-N 2.91Å; Q258-S262 PolarHBondContact O-OG 3.01Å; Q258-W313 HydrophobicContact CG-CZ2 4.37Å
259	E	89.8	Confident	89.1	Confident	113 Å²	113	33.3 Å²	33.3	53%	0.528	17%	0.172	S	C	.	.	H	α-helix	trans	-66.7	-46	174.6	-177.1	174.7	-168.8	0	0	110.8	T255 L256 C261 S262 M263	T255-E259 HydrophobicContact CG2-CB 4.31Å; T255-E259 HydrophobicContact CG2-CG 4.28Å; L256-E259 PolarHBondContact O-N 2.93Å; E259-C261 PolarHBondContact O-N 2.94Å; E259-S262 CarbonylContact O-C 3.58Å; E259-S262 WeakPolarHBondContact O-CA 3.34Å; E259-S262 VanDerWaalsContact O-CB 3.24Å; E259-S262 WeakPolarHBondContact O-CB 3.38Å; E259-S262 PolarHBondContact O-N 2.82Å; E259-M263 HydrophobicContact CG-CG 4.5Å; E259-M263 HydrophobicContact CG-SD 4.4Å; E259-M263 WeakPolarHBondContact O-CG 3.4Å; E259-M263 PolarHBondContact O-N 2.89Å
260	F	91.4	Very high	89.2	Confident	1 Å²	1	32.5 Å²	32.5	0%	0.004	17%	0.168	C	C	.	.	H	α-helix	trans	-56.5	-46.8	175	169.7	-118.4	0	0	0	112.6	K197 V251 T255 L256 K257 S262 M263 V264 S293 I306 L623	K197-F260 HydrophobicContact CD-CD1 4.49Å; K197-F260 HydrophobicContact CD-CD2 4.37Å; K197-F260 HydrophobicContact CD-CE1 4.03Å; K197-F260 HydrophobicContact CD-CE2 3.89Å; K197-F260 HydrophobicContact CD-CZ 3.68Å; V251-F260 HydrophobicContact CB-CD2 4.29Å; V251-F260 HydrophobicContact CG1-CB 4.39Å; V251-F260 HydrophobicContact CG1-CD2 3.7Å; V251-F260 HydrophobicContact CG1-CE2 4.3Å; V251-F260 HydrophobicContact CG1-CG 4.26Å; V251-F260 HydrophobicContact CG2-CD2 3.88Å; V251-F260 HydrophobicContact CG2-CE2 4.22Å; T255-F260 HydrophobicContact CG2-CB 4.36Å; L256-F260 PolarHBondContact O-N 2.84Å; K257-F260 PolarHBondContact O-N 3.12Å; F260-S262 VanDerWaalsContact C-N 3.31Å; F260-S262 PolarHBondContact O-N 2.81Å; F260-M263 PolarHBondContact O-N 3.28Å; F260-V264 HydrophobicContact CD2-CG2 4.29Å; F260-V264 HydrophobicContact CE2-CG2 3.98Å; F260-V264 HydrophobicContact CZ-CG2 4.47Å; F260-V264 WeakPolarHBondContact O-CG2 3.45Å; F260-V264 PolarHBondContact O-N 3.19Å; F260-S293 VanDerWaalsContact CE1-OG 3.27Å; F260-S293 WeakPolarHBondContact CE1-OG 3.49Å; F260-I306 HydrophobicContact CD1-CD1 4.32Å; F260-I306 HydrophobicContact CE1-CD1 3.52Å; F260-I306 HydrophobicContact CE1-CG1 4.12Å; F260-I306 HydrophobicContact CZ-CD1 3.71Å; F260-L623 HydrophobicContact CZ-CD1 4.29Å; F260-L623 HydrophobicContact CZ-CD2 4.5Å
261	C	94	Very high	89.1	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-60.1	-40.9	173.4	-73.7	0	0	0	0	111.4	K257 E259 V264 L265 C309 W313	K257-C261 VanDerWaalsContact O-CB 3.32Å; K257-C261 WeakPolarHBondContact O-CB 3.14Å; K257-C261 PolarHBondContact O-N 3.28Å; K257-C261 PolarHBondContact O-SG 2.8Å; E259-C261 PolarHBondContact O-N 2.94Å; C261-V264 PolarHBondContact O-N 2.81Å; C261-L265 HydrophobicContact CB-CD1 4.16Å; C261-L265 VanDerWaalsContact O-CB 3.23Å; C261-L265 WeakPolarHBondContact O-CB 3.29Å; C261-L265 WeakPolarHBondContact O-CG 3.24Å; C261-L265 PolarHBondContact O-N 2.88Å; C261-C309 HydrophobicContact CB-CB 4.1Å; C261-W313 HydrophobicContact CB-CH2 3.87Å; C261-W313 HydrophobicContact CB-CZ3 4.2Å
262	S	91.5	Very high	89.3	Confident	18 Å²	18	31.6 Å²	31.6	13%	0.126	16%	0.164	C	C	.	.	H	α-helix	trans	-60	-49.3	175.3	-53.8	0	0	0	0	111.8	P114 Q258 E259 F260 V264 I266 W313	P114-S262 WeakPolarHBondContact CG-OG 3.03Å; Q258-S262 WeakPolarHBondContact O-CB 3.45Å; Q258-S262 PolarHBondContact O-N 2.91Å; Q258-S262 PolarHBondContact O-OG 3.01Å; E259-S262 CarbonylContact O-C 3.58Å; E259-S262 WeakPolarHBondContact O-CA 3.34Å; E259-S262 VanDerWaalsContact O-CB 3.24Å; E259-S262 WeakPolarHBondContact O-CB 3.38Å; E259-S262 PolarHBondContact O-N 2.82Å; F260-S262 VanDerWaalsContact C-N 3.31Å; F260-S262 PolarHBondContact O-N 2.81Å; S262-V264 PolarHBondContact O-N 2.74Å; S262-I266 VanDerWaalsContact O-CD1 3.29Å; S262-I266 WeakPolarHBondContact O-CD1 3.42Å; S262-I266 WeakPolarHBondContact O-CG1 3.31Å; S262-I266 PolarHBondContact O-N 3.05Å; S262-W313 WeakPolarHBondContact OG-CH2 3.24Å
263	M	88.5	Confident	89.4	Confident	55 Å²	55	31.5 Å²	31.5	27%	0.271	16%	0.162	S	C	.	.	H	α-helix	trans	-58.4	-33.3	179.4	-67	172.2	78.6	0	0	112.9	H195 N249 V251 E259 F260	H195-M263 PolarHBondContact CE1-O 3.13Å; H195-M263 VanDerWaalsContact CE1-O 3.31Å; N249-M263 HydrophobicContact CB-CE 3.79Å; V251-M263 HydrophobicContact CG2-CE 4.36Å; V251-M263 HydrophobicContact CG2-SD 4.44Å; E259-M263 HydrophobicContact CG-CG 4.5Å; E259-M263 HydrophobicContact CG-SD 4.4Å; E259-M263 WeakPolarHBondContact O-CG 3.4Å; E259-M263 PolarHBondContact O-N 2.89Å; F260-M263 PolarHBondContact O-N 3.28Å
264	V	92.1	Very high	89.7	Confident	3 Å²	3	33.8 Å²	33.8	2%	0.018	17%	0.171	C	C	.	.	H	α-helix	trans	-89.7	-43.3	-176.7	175.6	0	0	0	0	112.3	F260 C261 S262 I280 I306 L623	F260-V264 HydrophobicContact CD2-CG2 4.29Å; F260-V264 HydrophobicContact CE2-CG2 3.98Å; F260-V264 HydrophobicContact CZ-CG2 4.47Å; F260-V264 WeakPolarHBondContact O-CG2 3.45Å; F260-V264 PolarHBondContact O-N 3.19Å; C261-V264 PolarHBondContact O-N 2.81Å; S262-V264 PolarHBondContact O-N 2.74Å; V264-I280 HydrophobicContact CG1-CD1 3.85Å; V264-I280 HydrophobicContact CG1-CG1 4.13Å; V264-I280 HydrophobicContact CG1-CG2 3.99Å; V264-I306 HydrophobicContact CB-CD1 4.29Å; V264-I306 HydrophobicContact CG1-CD1 4.1Å; V264-I306 HydrophobicContact CG2-CD1 4.26Å; V264-L623 HydrophobicContact CB-CD2 4.5Å; V264-L623 HydrophobicContact CG1-CD2 4.02Å; V264-L623 HydrophobicContact CG2-CD2 3.58Å
265	L	93.7	Very high	90	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-79.7	-22.5	-169.9	-70.3	168.1	0	0	0	113.9	C261 D267 A268 L269 I280 I306 C309 W313 F483 F485	C261-L265 HydrophobicContact CB-CD1 4.16Å; C261-L265 VanDerWaalsContact O-CB 3.23Å; C261-L265 WeakPolarHBondContact O-CB 3.29Å; C261-L265 WeakPolarHBondContact O-CG 3.24Å; C261-L265 PolarHBondContact O-N 2.88Å; L265-D267 PolarHBondContact O-N 3.36Å; L265-A268 PolarHBondContact O-N 3.43Å; L265-L269 HydrophobicContact CB-CD1 3.92Å; L265-L269 HydrophobicContact CB-CG 4.32Å; L265-L269 WeakPolarHBondContact O-CB 3.04Å; L265-L269 WeakPolarHBondContact O-CG 3.21Å; L265-L269 PolarHBondContact O-N 3.06Å; L265-I280 HydrophobicContact CD2-CD1 3.75Å; L265-I306 HydrophobicContact CD2-CG2 4.15Å; L265-C309 HydrophobicContact CD1-CB 3.83Å; L265-W313 HydrophobicContact CB-CE3 3.96Å; L265-W313 HydrophobicContact CB-CZ3 3.97Å; L265-W313 HydrophobicContact CD1-CD2 4.38Å; L265-W313 HydrophobicContact CD1-CE3 3.48Å; L265-W313 VanDerWaalsContact CD1-CE3 3.48Å; L265-W313 HydrophobicContact CD1-CH2 4.46Å; L265-W313 HydrophobicContact CD1-CZ3 3.54Å; L265-W313 HydrophobicContact CG-CE3 4.35Å; L265-W313 HydrophobicContact CG-CZ3 4.33Å; L265-F483 HydrophobicContact CD2-CE1 4.33Å; L265-F483 HydrophobicContact CD2-CZ 3.75Å; L265-F485 HydrophobicContact CD2-CE1 4.15Å; L265-F485 HydrophobicContact CD2-CZ 4.36Å
266	I	90	Very high	90.2	Very high	14 Å²	14	30.5 Å²	30.5	7%	0.072	16%	0.157	C	C	.	.	H	α-helix	trans	-54.3	-57.5	-176.9	-78.3	166	0	0	0	112.7	I117 Y120 L184 S262 A268 T270	I117-I266 HydrophobicContact CB-CG1 4.35Å; I117-I266 HydrophobicContact CD1-CD1 4.36Å; I117-I266 HydrophobicContact CD1-CG1 3.64Å; I117-I266 HydrophobicContact CG1-CD1 4.06Å; I117-I266 HydrophobicContact CG1-CG1 3.62Å; I117-I266 HydrophobicContact CG2-CG1 4.26Å; Y120-I266 HydrophobicContact CD1-CG2 3.51Å; Y120-I266 HydrophobicContact CE1-CG2 3.61Å; Y120-I266 HydrophobicContact CG-CG2 4.3Å; L184-I266 HydrophobicContact CD1-CD1 4.18Å; L184-I266 HydrophobicContact CD1-CG2 4.2Å; L184-I266 HydrophobicContact CD2-CG2 4.12Å; S262-I266 VanDerWaalsContact O-CD1 3.29Å; S262-I266 WeakPolarHBondContact O-CD1 3.42Å; S262-I266 WeakPolarHBondContact O-CG1 3.31Å; S262-I266 PolarHBondContact O-N 3.05Å; I266-A268 VanDerWaalsContact C-N 3.35Å; I266-T270 WeakPolarHBondContact O-CB 3.49Å; I266-T270 PolarHBondContact O-N 3.48Å; I266-T270 VanDerWaalsContact O-N 3.07Å; I266-T270 PolarHBondContact O-OG1 3.01Å
267	D	86.2	Confident	90.4	Very high	27 Å²	27	27.2 Å²	27.2	14%	0.144	14%	0.14	C	C	.	.	H	α-helix	trans	-69.3	-34.7	-178.3	-97.3	-46.6	0	0	0	111.3	S189 L265 G271	S189-D267 WeakPolarHBondContact CB-OD1 3.39Å; S189-D267 PolarHBondContact OG-OD1 3.43Å; L265-D267 PolarHBondContact O-N 3.36Å; D267-G271 PolarHBondContact O-N 3.27Å
268	A	92	Very high	90.5	Very high	5 Å²	5	26.6 Å²	26.6	4%	0.041	14%	0.137	C	C	.	.	H	α-helix	trans	-67.2	-53.4	-179.3	0	0	0	0	0	112.3	L265 I266 T270 G271 V272 S278 I280 F483	L265-A268 PolarHBondContact O-N 3.43Å; I266-A268 VanDerWaalsContact C-N 3.35Å; A268-T270 VanDerWaalsContact C-N 3.29Å; A268-T270 PolarHBondContact O-N 2.76Å; A268-G271 WeakPolarHBondContact O-CA 3.19Å; A268-G271 PolarHBondContact O-N 3.07Å; A268-V272 WeakPolarHBondContact O-CG2 3.22Å; A268-V272 PolarHBondContact O-N 2.83Å; A268-S278 WeakPolarHBondContact CA-OG 3.43Å; A268-S278 WeakPolarHBondContact CB-OG 3.44Å; A268-I280 HydrophobicContact CB-CD1 3.98Å; A268-I280 HydrophobicContact CB-CG1 4.36Å; A268-F483 HydrophobicContact CB-CE2 3.8Å; A268-F483 HydrophobicContact CB-CZ 3.92Å
269	L	94.3	Very high	90.8	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-61.7	-38.7	175.1	-68.2	170.8	0	0	0	111.1	L265 G271 V272 L273 W313 L314 L317 F483	L265-L269 HydrophobicContact CB-CD1 3.92Å; L265-L269 HydrophobicContact CB-CG 4.32Å; L265-L269 WeakPolarHBondContact O-CB 3.04Å; L265-L269 WeakPolarHBondContact O-CG 3.21Å; L265-L269 PolarHBondContact O-N 3.06Å; L269-G271 VanDerWaalsContact C-N 3.26Å; L269-G271 PolarHBondContact O-N 3.4Å; L269-V272 PolarHBondContact O-N 2.79Å; L269-L273 WeakPolarHBondContact O-CB 3.43Å; L269-L273 VanDerWaalsContact O-CG 3.25Å; L269-L273 WeakPolarHBondContact O-CG 3.49Å; L269-L273 PolarHBondContact O-N 2.9Å; L269-W313 HydrophobicContact CD1-CB 3.82Å; L269-W313 HydrophobicContact CD1-CE3 4.29Å; L269-L314 HydrophobicContact CD2-CB 3.83Å; L269-L314 HydrophobicContact CD2-CD1 3.98Å; L269-L314 HydrophobicContact CD2-CG 4.45Å; L269-L317 HydrophobicContact CB-CD1 4.25Å; L269-L317 HydrophobicContact CD1-CD1 4Å; L269-F483 HydrophobicContact CD2-CD1 4.34Å; L269-F483 HydrophobicContact CD2-CE1 3.61Å; L269-F483 HydrophobicContact CD2-CZ 4.32Å; L269-F483 HydrophobicContact CG-CE1 4.35Å
270	T	90.5	Very high	91.1	Very high	7 Å²	7	18.7 Å²	18.7	4%	0.043	10%	0.101	C	C	.	.	H	α-helix	trans	-63.7	-30.2	174.3	-62.4	0	0	0	0	112.5	Y120 I266 A268 K274	Y120-T270 HydrophobicContact CE1-CG2 4.12Å; I266-T270 WeakPolarHBondContact O-CB 3.49Å; I266-T270 PolarHBondContact O-N 3.48Å; I266-T270 VanDerWaalsContact O-N 3.07Å; I266-T270 PolarHBondContact O-OG1 3.01Å; A268-T270 VanDerWaalsContact C-N 3.29Å; A268-T270 PolarHBondContact O-N 2.76Å; T270-K274 HydrophobicContact CG2-CD 4.24Å; T270-K274 VanDerWaalsContact O-CD 3.22Å; T270-K274 WeakPolarHBondContact O-CD 3.43Å; T270-K274 WeakPolarHBondContact O-CG 3.49Å
271	G	88.5	Confident	91.3	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.01	10%	0.101	C	C	.	.	H	α-helix	trans	-70.4	-53.6	170.6	0	0	0	0	0	112.1	D267 A268 L269 L273 K274 G275 K276	D267-G271 PolarHBondContact O-N 3.27Å; A268-G271 WeakPolarHBondContact O-CA 3.19Å; A268-G271 PolarHBondContact O-N 3.07Å; L269-G271 VanDerWaalsContact C-N 3.26Å; L269-G271 PolarHBondContact O-N 3.4Å; G271-L273 VanDerWaalsContact C-N 3.34Å; G271-L273 PolarHBondContact O-N 3.28Å; G271-K274 CarbonylContact O-C 3.58Å; G271-K274 WeakPolarHBondContact O-CA 3.39Å; G271-K274 PolarHBondContact O-N 2.69Å; G271-G275 PolarHBondContact O-N 2.78Å; G271-K276 CarbonylContact C-O 3.59Å; G271-K276 VanDerWaalsContact C-O 3.3Å; G271-K276 WeakPolarHBondContact O-CB 3.22Å; G271-K276 PolarHBondContact O-N 2.9Å
272	V	92	Very high	91.3	Very high	1 Å²	1	18.8 Å²	18.8	1%	0.006	10%	0.101	C	C	.	.	H	α-helix	trans	-56.6	-46.5	-178.3	172.5	0	0	0	0	111.5	A268 L269 K274 G275 K276 L314 L462 T481 F483	A268-V272 WeakPolarHBondContact O-CG2 3.22Å; A268-V272 PolarHBondContact O-N 2.83Å; L269-V272 PolarHBondContact O-N 2.79Å; V272-K274 PolarHBondContact O-N 3.01Å; V272-K274 VanDerWaalsContact O-N 3.16Å; V272-G275 PolarHBondContact O-N 3.24Å; V272-K276 VanDerWaalsContact CA-O 3.29Å; V272-K276 WeakPolarHBondContact CA-O 3.32Å; V272-K276 PolarHBondContact N-O 2.88Å; V272-L314 HydrophobicContact CG1-CD1 4.02Å; V272-L462 HydrophobicContact CG1-CD2 3.84Å; V272-T481 HydrophobicContact CB-CG2 4.44Å; V272-T481 HydrophobicContact CG1-CG2 4.2Å; V272-F483 HydrophobicContact CG2-CB 3.78Å; V272-F483 HydrophobicContact CG2-CD1 4.2Å; V272-F483 HydrophobicContact CG2-CD2 4.07Å; V272-F483 HydrophobicContact CG2-CG 3.78Å
273	L	89.8	Confident	91.3	Very high	14 Å²	14	18 Å²	18	7%	0.073	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-5.1	177.5	-66.1	169.4	0	0	0	114.4	I121 L269 G271 L314 L317 L318	I121-L273 HydrophobicContact CD1-CD1 3.88Å; L269-L273 WeakPolarHBondContact O-CB 3.43Å; L269-L273 VanDerWaalsContact O-CG 3.25Å; L269-L273 WeakPolarHBondContact O-CG 3.49Å; L269-L273 PolarHBondContact O-N 2.9Å; G271-L273 VanDerWaalsContact C-N 3.34Å; G271-L273 PolarHBondContact O-N 3.28Å; L273-L314 HydrophobicContact CD2-CD1 4.18Å; L273-L314 HydrophobicContact CG-CD1 4.49Å; L273-L317 HydrophobicContact CD1-CB 3.77Å; L273-L317 HydrophobicContact CD1-CD1 3.83Å; L273-L317 HydrophobicContact CD1-CG 4.28Å; L273-L318 HydrophobicContact CD2-CD2 3.47Å; L273-L318 VanDerWaalsContact CD2-CD2 3.47Å; L273-L318 HydrophobicContact CD2-CG 4.05Å
274	K	86.6	Confident	91.4	Very high	107 Å²	107	15.5 Å²	15.5	47%	0.465	8%	0.083	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.4	16.8	172	-68.3	174.5	-171.9	170.6	0	111.9	T270 G271 V272 K276	T270-K274 HydrophobicContact CG2-CD 4.24Å; T270-K274 VanDerWaalsContact O-CD 3.22Å; T270-K274 WeakPolarHBondContact O-CD 3.43Å; T270-K274 WeakPolarHBondContact O-CG 3.49Å; G271-K274 CarbonylContact O-C 3.58Å; G271-K274 WeakPolarHBondContact O-CA 3.39Å; G271-K274 PolarHBondContact O-N 2.69Å; V272-K274 PolarHBondContact O-N 3.01Å; V272-K274 VanDerWaalsContact O-N 3.16Å; K274-K276 VanDerWaalsContact C-N 3.33Å; K274-K276 PolarHBondContact O-N 3.03Å
275	G	87.8	Confident	91.2	Very high	31 Å²	31	15.4 Å²	15.4	32%	0.32	8%	0.083	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.2	18.5	179.9	0	0	0	0	0	114.4	G271 V272 T481	G271-G275 PolarHBondContact O-N 2.78Å; V272-G275 PolarHBondContact O-N 3.24Å; G275-T481 VanDerWaalsContact C-OG1 3.31Å; G275-T481 VanDerWaalsContact CA-OG1 3.31Å; G275-T481 WeakPolarHBondContact CA-OG1 3.42Å; G275-T481 PolarHBondContact O-OG1 3.06Å
276	K	89.3	Confident	90.7	Very high	68 Å²	68	18.8 Å²	18.8	30%	0.296	10%	0.097	S	C	.	.			trans	-106.8	130.4	-180	-58	-177.1	-179.7	176.7	0	111.3	G271 V272 K274 T481 Q617	G271-K276 CarbonylContact C-O 3.59Å; G271-K276 VanDerWaalsContact C-O 3.3Å; G271-K276 WeakPolarHBondContact O-CB 3.22Å; G271-K276 PolarHBondContact O-N 2.9Å; V272-K276 VanDerWaalsContact CA-O 3.29Å; V272-K276 WeakPolarHBondContact CA-O 3.32Å; V272-K276 PolarHBondContact N-O 2.88Å; K274-K276 VanDerWaalsContact C-N 3.33Å; K274-K276 PolarHBondContact O-N 3.03Å; K276-T481 VanDerWaalsContact O-CG2 3.22Å; K276-T481 WeakPolarHBondContact O-CG2 3.35Å; K276-Q617 HydrophobicContact CB-CB 4.32Å; K276-Q617 HydrophobicContact CG-CB 4.21Å
277	D	91.8	Very high	90	Very high	39 Å²	39	20 Å²	20	21%	0.209	11%	0.11	C	C	.	.			trans	-58.9	141.7	172.9	-56.7	-40.5	0	0	0	110.7	T481 K482 I618 Q619	D277-T481 WeakPolarHBondContact OD1-CA 3.4Å; D277-K482 CarbonylContact C-O 3.59Å; D277-K482 VanDerWaalsContact CA-O 3.25Å; D277-K482 WeakPolarHBondContact CA-O 3.45Å; D277-K482 PolarHBondContact OD1-N 3.17Å; D277-I618 HydrophobicContact CB-CD1 4.2Å; D277-I618 HydrophobicContact CB-CG1 3.4Å; D277-I618 WeakPolarHBondContact O-CA 3.31Å; D277-Q619 PolarHBondContact O-N 3.49Å; D277-Q619 VanDerWaalsContact O-N 3.09Å
278	S	93.4	Very high	90	Very high	2 Å²	2	18.9 Å²	18.9	1%	0.014	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	151	174.6	-170.1	0	0	0	0	110.6	A268 K482 H484 Q619	A268-S278 WeakPolarHBondContact CA-OG 3.43Å; A268-S278 WeakPolarHBondContact CB-OG 3.44Å; S278-K482 PolarHBondContact N-O 2.97Å; S278-H484 PolarHBondContact O-N 2.97Å; S278-Q619 PolarHBondContact OG-O 2.89Å; S278-Q619 VanDerWaalsContact OG-O 3.08Å
279	C	94.3	Very high	89.7	Confident	0 Å²	0	19.4 Å²	19.4	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	122.8	-177.9	-178.6	0	0	0	0	109.5	H484 A612 I618 Q619 P620 C621	C279-H484 CarbonylContact C-O 3.36Å; C279-H484 WeakPolarHBondContact CA-O 3.39Å; C279-H484 HydrophobicContact CB-CB 4.06Å; C279-A612 VanDerWaalsContact CB-O 3.23Å; C279-A612 WeakPolarHBondContact CB-O 3.47Å; C279-A612 PolarHBondContact SG-O 2.98Å; C279-I618 HydrophobicContact CB-CG2 4.41Å; C279-Q619 PolarHBondContact N-O 3.42Å; C279-P620 HydrophobicContact CB-CB 4.42Å; C279-P620 CarbonylContact O-C 2.94Å; C279-P620 VanDerWaalsContact O-CA 3.25Å; C279-P620 WeakPolarHBondContact O-CA 3.18Å; C279-C621 PolarHBondContact O-N 2.89Å
280	I	95.9	Very high	89.5	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	119.1	172	-63.8	162.3	0	0	0	107.4	V264 L265 A268 M294 I306 F483 H484 F485 L486 C621 L623	V264-I280 HydrophobicContact CG1-CD1 3.85Å; V264-I280 HydrophobicContact CG1-CG1 4.13Å; V264-I280 HydrophobicContact CG1-CG2 3.99Å; L265-I280 HydrophobicContact CD2-CD1 3.75Å; A268-I280 HydrophobicContact CB-CD1 3.98Å; A268-I280 HydrophobicContact CB-CG1 4.36Å; I280-M294 HydrophobicContact CG2-CE 4.49Å; I280-M294 HydrophobicContact CG2-SD 4.34Å; I280-I306 HydrophobicContact CD1-CG2 4.09Å; I280-I306 HydrophobicContact CG2-CG2 4.23Å; I280-F483 HydrophobicContact CD1-CE2 3.65Å; I280-F483 HydrophobicContact CD1-CZ 3.81Å; I280-F483 HydrophobicContact CG1-CE2 4.22Å; I280-H484 PolarHBondContact N-O 3.08Å; I280-F485 HydrophobicContact CB-CD1 4.19Å; I280-F485 HydrophobicContact CD1-CD1 4.19Å; I280-F485 HydrophobicContact CD1-CE1 3.74Å; I280-F485 WeakPolarHBondContact O-CA 3.49Å; I280-L486 PolarHBondContact O-N 3.12Å; I280-C621 HydrophobicContact CG1-CB 4.04Å; I280-L623 HydrophobicContact CG2-CD1 3.62Å; I280-L623 HydrophobicContact CG2-CG 4.05Å
281	L	95.1	Very high	89.6	Confident	2 Å²	2	22.7 Å²	22.7	1%	0.01	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	139.1	-177.3	71.1	95.7	0	0	0	112.6	I283 L486 L588 I613 C621 I622 L623	L281-I283 HydrophobicContact CD1-CG2 3.86Å; L281-L486 WeakPolarHBondContact CA-O 3.32Å; L281-L486 HydrophobicContact CB-CB 3.88Å; L281-L486 HydrophobicContact CB-CD2 4.02Å; L281-L486 HydrophobicContact CB-CG 4.37Å; L281-L588 HydrophobicContact CD1-CD1 4.45Å; L281-L588 HydrophobicContact CD1-CD2 4.49Å; L281-L588 HydrophobicContact CD2-CD2 4.3Å; L281-I613 HydrophobicContact CD2-CD1 3.71Å; L281-I613 HydrophobicContact CD2-CG1 4.26Å; L281-C621 PolarHBondContact N-O 2.92Å; L281-I622 HydrophobicContact CD1-CB 4.43Å; L281-I622 HydrophobicContact CD1-CG1 4.06Å; L281-I622 HydrophobicContact CD1-CG2 4.03Å; L281-I622 HydrophobicContact CD2-CG1 4.26Å; L281-I622 HydrophobicContact CG-CG1 4.09Å; L281-L623 PolarHBondContact O-N 2.82Å
282	T	93.6	Very high	89.7	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	143.5	171.3	53.2	0	0	0	0	111.3	K290 M294 L486 D487 L488 L623	T282-K290 HydrophobicContact CG2-CB 4.1Å; T282-K290 HydrophobicContact CG2-CG 4.38Å; T282-M294 HydrophobicContact CG2-CG 3.49Å; T282-M294 VanDerWaalsContact CG2-CG 3.49Å; T282-M294 HydrophobicContact CG2-SD 3.76Å; T282-L486 PolarHBondContact N-O 2.98Å; T282-L486 PolarHBondContact OG1-O 2.94Å; T282-D487 WeakPolarHBondContact OG1-CA 3.37Å; T282-D487 PolarHBondContact OG1-OD1 2.96Å; T282-L488 WeakPolarHBondContact O-CB 3.23Å; T282-L488 WeakPolarHBondContact O-CD1 3.4Å; T282-L488 PolarHBondContact OG1-N 3.17Å; T282-L488 VanDerWaalsContact OG1-N 3.12Å; T282-L623 CarbonylContact C-O 3.48Å; T282-L623 WeakPolarHBondContact CA-O 3.28Å; T282-L623 HydrophobicContact CG2-CB 4.19Å; T282-L623 HydrophobicContact CG2-CD1 4.28Å
283	I	92	Very high	89.7	Confident	3 Å²	3	25.5 Å²	25.5	2%	0.015	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	143.6	160.2	59.2	177.1	0	0	0	108.1	L281 L488 L588 I622 L623 A624 H625 L642	L281-I283 HydrophobicContact CD1-CG2 3.86Å; I283-L488 HydrophobicContact CG2-CD1 4.21Å; I283-L588 HydrophobicContact CG2-CD1 3.85Å; I283-I622 HydrophobicContact CD1-CG2 3.71Å; I283-I622 HydrophobicContact CG1-CG2 3.81Å; I283-L623 PolarHBondContact N-O 3.39Å; I283-A624 HydrophobicContact CD1-CB 4.11Å; I283-A624 HydrophobicContact CG1-CB 3.85Å; I283-A624 CarbonylContact O-C 3.56Å; I283-A624 WeakPolarHBondContact O-CA 3.38Å; I283-H625 PolarHBondContact O-N 3.24Å; I283-L642 HydrophobicContact CD1-CD2 4.04Å; I283-L642 HydrophobicContact CD1-CG 4.27Å
284	G	90.7	Very high	90	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.01	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	158.4	157.5	-176.2	0	0	0	0	0	112.8	K290 C490 H625	G284-K290 WeakPolarHBondContact O-CE 3.41Å; G284-K290 PolarHBondContact O-NZ 3.06Å; G284-C490 VanDerWaalsContact O-CB 3.25Å; G284-C490 WeakPolarHBondContact O-CB 3.16Å; G284-H625 WeakPolarHBondContact CA-O 3.39Å
285	H	87.1	Confident	90.4	Very high	1 Å²	1	19.8 Å²	19.8	1%	0.005	12%	0.116	C	C	.	.			trans	-76.4	-177.1	-170.6	64.5	81.1	0	0	0	114.5	T288 K290 Y493 S627 Y632 E635 T636	H285-T288 WeakPolarHBondContact CE1-CG2 3.28Å; H285-T288 PolarHBondContact N-OG1 2.76Å; H285-T288 WeakPolarHBondContact ND1-CG2 3.17Å; H285-T288 WeakPolarHBondContact NE2-CG2 3.31Å; H285-T288 PolarHBondContact O-OG1 3.37Å; H285-K290 PolarHBondContact O-NZ 3.41Å; H285-Y493 WeakPolarHBondContact CA-OH 3.39Å; H285-Y493 HydrophobicContact CB-CE1 4.39Å; H285-Y493 WeakPolarHBondContact CB-OH 3.4Å; H285-S627 VanDerWaalsContact CE1-CB 3.47Å; H285-S627 WeakPolarHBondContact CE1-CB 2.97Å; H285-S627 WeakPolarHBondContact NE2-CB 3.35Å; H285-Y632 WeakPolarHBondContact CE1-CB 3.36Å; H285-Y632 AromaticContact CE1-CD1 3.96Å; H285-Y632 AromaticContact CE1-CD2 3.64Å; H285-Y632 AromaticContact CE1-CG 3.35Å; H285-Y632 AromaticContact ND1-CG 3.97Å; H285-Y632 WeakPolarHBondContact NE2-CB 3.29Å; H285-E635 HydrophobicContact CB-CB 3.76Å; H285-E635 HydrophobicContact CB-CG 4.2Å; H285-T636 PolarHBondContact NE2-OG1 2.92Å; H285-T636 VanDerWaalsContact NE2-OG1 3.09Å
286	K	83	Confident	90.6	Very high	71 Å²	71	18.5 Å²	18.5	31%	0.309	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	144.2	175.2	-169.6	-177.1	172.1	-169.1	0	109.4	T288 N448 Y493	K286-T288 PolarHBondContact O-N 3.26Å; K286-T288 VanDerWaalsContact O-N 3.08Å; K286-N448 PolarHBondContact NZ-O 3.14Å; K286-N448 PolarHBondContact NZ-OD1 3.27Å; K286-Y493 HydrophobicContact CB-CE2 4.1Å; K286-Y493 PolarHBondContact N-OH 2.78Å
287	A	75.8	Confident	90.8	Very high	40 Å²	40	19.9 Å²	19.9	33%	0.331	11%	0.106	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.8	-1.1	178.8	0	0	0	0	0	117.9	G289	A287-G289 VanDerWaalsContact C-N 3.26Å; A287-G289 PolarHBondContact O-N 3.47Å
288	T	85.7	Confident	90.8	Very high	4 Å²	4	19.6 Å²	19.6	3%	0.025	11%	0.105	C	C	.	.	S	Bend	trans	-81.5	62.6	173.8	55.6	0	0	0	0	113	H285 K286 K290 H625	H285-T288 WeakPolarHBondContact CE1-CG2 3.28Å; H285-T288 PolarHBondContact N-OG1 2.76Å; H285-T288 WeakPolarHBondContact ND1-CG2 3.17Å; H285-T288 WeakPolarHBondContact NE2-CG2 3.31Å; H285-T288 PolarHBondContact O-OG1 3.37Å; K286-T288 PolarHBondContact O-N 3.26Å; K286-T288 VanDerWaalsContact O-N 3.08Å; T288-K290 WeakPolarHBondContact O-CG 3.4Å; T288-K290 PolarHBondContact O-N 3.21Å; T288-H625 VanDerWaalsContact O-CB 3.32Å; T288-H625 WeakPolarHBondContact O-CB 3.38Å; T288-H625 PolarHBondContact O-ND1 2.9Å; T288-H625 PolarHBondContact OG1-O 3.38Å
289	G	87.2	Confident	90.6	Very high	15 Å²	15	26.9 Å²	26.9	16%	0.155	13%	0.133	C	C	.	.	S	Bend	trans	52.9	5.5	158.7	0	0	0	0	0	120.6	D199 A287 T291 H292 S293 H625	D199-G289 WeakPolarHBondContact OD2-CA 3.15Å; D199-G289 PolarHBondContact OD2-N 2.78Å; A287-G289 VanDerWaalsContact C-N 3.26Å; A287-G289 PolarHBondContact O-N 3.47Å; G289-T291 PolarHBondContact O-N 2.9Å; G289-H292 CarbonylContact O-C 3.56Å; G289-H292 WeakPolarHBondContact O-CA 3.29Å; G289-H292 WeakPolarHBondContact O-CB 3.41Å; G289-H292 PolarHBondContact O-N 3.18Å; G289-S293 PolarHBondContact O-N 3.27Å; G289-H625 PolarHBondContact O-CE1 3.41Å
290	K	90.5	Very high	90.5	Very high	18 Å²	18	28.3 Å²	28.3	8%	0.078	14%	0.143	C	C	.	.	H	α-helix	trans	-55.1	-57.7	-170.3	-68.8	-175.9	-60.8	-60.3	0	112.8	T282 G284 H285 T288 H292 S293 M294 L488 H625	T282-K290 HydrophobicContact CG2-CB 4.1Å; T282-K290 HydrophobicContact CG2-CG 4.38Å; G284-K290 WeakPolarHBondContact O-CE 3.41Å; G284-K290 PolarHBondContact O-NZ 3.06Å; H285-K290 PolarHBondContact O-NZ 3.41Å; T288-K290 WeakPolarHBondContact O-CG 3.4Å; T288-K290 PolarHBondContact O-N 3.21Å; K290-H292 PolarHBondContact O-N 3.2Å; K290-S293 WeakPolarHBondContact O-CB 3.16Å; K290-S293 PolarHBondContact O-N 2.9Å; K290-M294 WeakPolarHBondContact O-CG 3.25Å; K290-M294 PolarHBondContact O-N 2.82Å; K290-L488 WeakPolarHBondContact CD-O 3.35Å; K290-L488 WeakPolarHBondContact CE-O 3.26Å; K290-H625 HydrophobicContact CG-CB 3.9Å
291	T	91.3	Very high	90.3	Very high	58 Å²	58	29.4 Å²	29.4	36%	0.356	15%	0.15	S	C	.	.	H	α-helix	trans	-60.8	-34.7	176.6	-48.9	0	0	0	0	111.2	G289 M294 I295 D487	G289-T291 PolarHBondContact O-N 2.9Å; T291-M294 PolarHBondContact O-N 3.08Å; T291-I295 HydrophobicContact CG2-CD1 3.52Å; T291-I295 WeakPolarHBondContact O-CB 3.38Å; T291-I295 PolarHBondContact O-N 3.49Å; T291-D487 WeakPolarHBondContact CB-OD2 3.45Å; T291-D487 PolarHBondContact N-OD1 3.11Å; T291-D487 PolarHBondContact OG1-OD2 3.21Å
292	H	90.6	Very high	90.1	Very high	61 Å²	61	34 Å²	34	28%	0.282	17%	0.172	S	C	.	.	H	α-helix	trans	-71	-26.7	174.9	174.7	-116.9	0	0	0	113.8	K257 G289 K290 G296 Y297	K257-H292 WeakPolarHBondContact CE-NE2 3.49Å; K257-H292 PolarHBondContact NZ-CD2 2.65Å; K257-H292 PolarHBondContact NZ-NE2 3.17Å; G289-H292 CarbonylContact O-C 3.56Å; G289-H292 WeakPolarHBondContact O-CA 3.29Å; G289-H292 WeakPolarHBondContact O-CB 3.41Å; G289-H292 PolarHBondContact O-N 3.18Å; K290-H292 PolarHBondContact O-N 3.2Å; H292-G296 WeakPolarHBondContact O-CA 2.63Å; H292-G296 PolarHBondContact O-N 2.71Å; H292-Y297 AromaticContact CD2-CE2 3.43Å; H292-Y297 VanDerWaalsContact CD2-CE2 3.43Å; H292-Y297 WeakPolarHBondContact CD2-CE2 2.96Å; H292-Y297 AromaticContact CD2-CZ 3.78Å; H292-Y297 AromaticContact NE2-CD2 3.91Å; H292-Y297 AromaticContact NE2-CE2 3.31Å; H292-Y297 VanDerWaalsContact NE2-CE2 3.31Å; H292-Y297 WeakPolarHBondContact NE2-CE2 3.32Å
293	S	93.3	Very high	90	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.007	19%	0.185	C	C	.	.	H	α-helix	trans	-76.8	-39.5	167.3	-86.3	0	0	0	0	112.7	K197 F260 G289 K290 G305 I306 H625	K197-S293 WeakPolarHBondContact CD-OG 3.01Å; K197-S293 PolarHBondContact NZ-OG 2.77Å; F260-S293 VanDerWaalsContact CE1-OG 3.27Å; F260-S293 WeakPolarHBondContact CE1-OG 3.49Å; G289-S293 PolarHBondContact O-N 3.27Å; K290-S293 WeakPolarHBondContact O-CB 3.16Å; K290-S293 PolarHBondContact O-N 2.9Å; S293-G305 CarbonylContact O-C 3.6Å; S293-G305 VanDerWaalsContact O-CA 3.28Å; S293-G305 WeakPolarHBondContact O-CA 3.44Å; S293-I306 PolarHBondContact O-N 2.95Å; S293-H625 WeakPolarHBondContact CB-NE2 3.38Å; S293-H625 PolarHBondContact OG-CE1 2.88Å; S293-H625 PolarHBondContact OG-NE2 2.9Å
294	M	94.9	Very high	90.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-77	-42.2	-174.9	-67.2	-62.7	-76.4	0	0	112.1	I280 T282 K290 T291 G305 I306 I307 F485 D487 L623	I280-M294 HydrophobicContact CG2-CE 4.49Å; I280-M294 HydrophobicContact CG2-SD 4.34Å; T282-M294 HydrophobicContact CG2-CG 3.49Å; T282-M294 VanDerWaalsContact CG2-CG 3.49Å; T282-M294 HydrophobicContact CG2-SD 3.76Å; K290-M294 WeakPolarHBondContact O-CG 3.25Å; K290-M294 PolarHBondContact O-N 2.82Å; T291-M294 PolarHBondContact O-N 3.08Å; M294-G305 CarbonylContact O-C 3.48Å; M294-I306 PolarHBondContact O-N 2.84Å; M294-I306 VanDerWaalsContact O-N 3.16Å; M294-I306 HydrophobicContact SD-CB 4.44Å; M294-I306 HydrophobicContact SD-CG2 4.44Å; M294-I307 HydrophobicContact CB-CD1 4.23Å; M294-I307 HydrophobicContact CB-CG1 4.5Å; M294-I307 HydrophobicContact CE-CD1 4.27Å; M294-I307 HydrophobicContact CE-CG1 4.25Å; M294-I307 WeakPolarHBondContact O-CB 3.48Å; M294-I307 VanDerWaalsContact O-CG1 3.29Å; M294-I307 WeakPolarHBondContact O-CG1 3.45Å; M294-I307 PolarHBondContact O-N 2.82Å; M294-F485 HydrophobicContact CE-CB 3.8Å; M294-F485 HydrophobicContact CE-CD1 4.14Å; M294-F485 HydrophobicContact CE-CG 4.48Å; M294-D487 HydrophobicContact CB-CB 4.25Å; M294-D487 HydrophobicContact CG-CB 4.08Å; M294-L623 HydrophobicContact SD-CD1 4.08Å
295	I	94.4	Very high	90.3	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-106.2	-45.9	-175.7	-67.2	138.9	0	0	0	110.8	Y100 F102 T291 G305 I307 P308 L439	Y100-I295 HydrophobicContact CD1-CG2 4.23Å; Y100-I295 HydrophobicContact CE1-CG2 3.89Å; F102-I295 HydrophobicContact CE2-CG2 3.48Å; F102-I295 VanDerWaalsContact CE2-CG2 3.48Å; F102-I295 HydrophobicContact CZ-CG2 3.63Å; F102-I295 VanDerWaalsContact CZ-O 3.3Å; F102-I295 WeakPolarHBondContact CZ-O 3.39Å; T291-I295 HydrophobicContact CG2-CD1 3.52Å; T291-I295 WeakPolarHBondContact O-CB 3.38Å; T291-I295 PolarHBondContact O-N 3.49Å; I295-G305 WeakPolarHBondContact O-CA 3.34Å; I295-G305 PolarHBondContact O-N 2.84Å; I295-I307 HydrophobicContact CG1-CD1 4.4Å; I295-P308 WeakPolarHBondContact O-CG 3.44Å; I295-L439 HydrophobicContact CD1-CD2 3.48Å; I295-L439 VanDerWaalsContact CD1-CD2 3.48Å; I295-L439 HydrophobicContact CG1-CD1 4.3Å; I295-L439 HydrophobicContact CG1-CD2 3.88Å; I295-L439 HydrophobicContact CG2-CD1 3.67Å; I295-L439 HydrophobicContact CG2-CD2 4.49Å
296	G	92.9	Very high	90.8	Very high	3 Å²	3	36.5 Å²	36.5	3%	0.031	18%	0.184	C	C	.	.	B	Isolated β-bridge	trans	68.9	-141.1	-176	0	0	0	0	0	111.9	H292 E303	H292-G296 WeakPolarHBondContact O-CA 2.63Å; H292-G296 PolarHBondContact O-N 2.71Å; G296-E303 WeakPolarHBondContact CA-O 3.4Å
297	Y	92.7	Very high	91.5	Very high	97 Å²	97	33.2 Å²	33.2	38%	0.38	17%	0.17	S	C	.	.			trans	-132.8	157.2	177	-56.8	-67.1	0	0	0	111.3	F102 H292 Y299 E303 C304	F102-Y297 VanDerWaalsContact CE1-C 3.49Å; F102-Y297 WeakPolarHBondContact CE1-O 3.4Å; H292-Y297 AromaticContact CD2-CE2 3.43Å; H292-Y297 VanDerWaalsContact CD2-CE2 3.43Å; H292-Y297 WeakPolarHBondContact CD2-CE2 2.96Å; H292-Y297 AromaticContact CD2-CZ 3.78Å; H292-Y297 AromaticContact NE2-CD2 3.91Å; H292-Y297 AromaticContact NE2-CE2 3.31Å; H292-Y297 VanDerWaalsContact NE2-CE2 3.31Å; H292-Y297 WeakPolarHBondContact NE2-CE2 3.32Å; Y297-Y299 HydrophobicContact CD1-CE1 4.31Å; Y297-Y299 AromaticContact CD2-CE1 3.68Å; Y297-Y299 HydrophobicContact CD2-CE1 3.68Å; Y297-Y299 HydrophobicContact CG-CD1 4.18Å; Y297-Y299 AromaticContact CG-CE1 3.53Å; Y297-Y299 HydrophobicContact CG-CE1 3.53Å; Y297-E303 PolarHBondContact N-O 3.26Å; Y297-E303 CarbonylContact O-C 3.55Å; Y297-C304 PolarHBondContact O-N 2.86Å
298	D	92.4	Very high	92.5	Very high	34 Å²	34	31.3 Å²	31.3	18%	0.182	15%	0.154	C	C	.	.	S	Bend	trans	-100	-8.7	-171.7	56.7	-28.1	0	0	0	114.2	T101 F102 L105 S300	T101-D298 WeakPolarHBondContact CA-OD2 3.36Å; T101-D298 PolarHBondContact N-OD2 3.37Å; T101-D298 PolarHBondContact OG1-OD2 3.38Å; F102-D298 HydrophobicContact CD1-CB 3.8Å; F102-D298 HydrophobicContact CE1-CB 3.77Å; F102-D298 HydrophobicContact CE2-CB 4.49Å; F102-D298 HydrophobicContact CG-CB 4.2Å; F102-D298 HydrophobicContact CZ-CB 4.12Å; L105-D298 WeakPolarHBondContact CD2-O 3.37Å; D298-S300 VanDerWaalsContact C-N 3.27Å; D298-S300 PolarHBondContact O-N 3.12Å
299	Y	89.6	Confident	93.1	Very high	154 Å²	154	31.2 Å²	31.2	60%	0.604	15%	0.153	S	C	*	.	S	Bend	trans	-74.3	-9.6	178.7	64.4	-102.7	0	0	0	114.7	Y297 E303	Y297-Y299 HydrophobicContact CD1-CE1 4.31Å; Y297-Y299 AromaticContact CD2-CE1 3.68Å; Y297-Y299 HydrophobicContact CD2-CE1 3.68Å; Y297-Y299 HydrophobicContact CG-CD1 4.18Å; Y297-Y299 AromaticContact CG-CE1 3.53Å; Y297-Y299 HydrophobicContact CG-CE1 3.53Å; Y299-E303 HydrophobicContact CE2-CB 4.1Å; Y299-E303 HydrophobicContact CE2-CG 3.74Å
300	S	91.7	Very high	93.6	Very high	31 Å²	31	30.5 Å²	30.5	22%	0.217	15%	0.146	C	C	.	.			trans	-156.2	141.6	178.8	171.7	0	0	0	0	112.1	D298 M302 E303 C304	D298-S300 VanDerWaalsContact C-N 3.27Å; D298-S300 PolarHBondContact O-N 3.12Å; S300-M302 PolarHBondContact O-N 3.42Å; S300-M302 PolarHBondContact OG-N 2.85Å; S300-E303 PolarHBondContact O-N 2.86Å; S300-C304 PolarHBondContact O-N 3.19Å
301	P	91.4	Very high	93.9	Very high	22 Å²	22	29.6 Å²	29.6	14%	0.143	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-23.3	175.7	-8.1	20.4	0	0	0	112.8	L105 N109 P111 E303	L105-P301 HydrophobicContact CD1-CG 4.18Å; N109-P301 HydrophobicContact CB-CG 3.98Å; N109-P301 WeakPolarHBondContact ND2-CG 3.43Å; N109-P301 VanDerWaalsContact O-CG 3.31Å; N109-P301 WeakPolarHBondContact O-CG 3.29Å; N109-P301 WeakPolarHBondContact OD1-CG 3.4Å; P111-P301 HydrophobicContact CG-CB 4.3Å; P301-E303 VanDerWaalsContact C-N 3.33Å
302	M	91.2	Very high	94.2	Very high	98 Å²	98	27 Å²	27	48%	0.483	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-22	176	-58.3	-172.1	76.4	0	0	112.3	K257 S300	K257-M302 WeakPolarHBondContact CB-O 3.36Å; S300-M302 PolarHBondContact O-N 3.42Å; S300-M302 PolarHBondContact OG-N 2.85Å
303	E	91.9	Very high	94.5	Very high	57 Å²	57	24 Å²	24	27%	0.266	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-3	-176.4	-75.2	-66.3	127.1	0	0	114	K257 G296 Y297 Y299 S300 P301	K257-E303 VanDerWaalsContact CD-O 3.32Å; K257-E303 WeakPolarHBondContact CD-O 3.35Å; K257-E303 WeakPolarHBondContact CE-O 3.34Å; K257-E303 PolarHBondContact NZ-O 3.13Å; K257-E303 IonicContact NZ-OE2 3.39Å; K257-E303 PolarHBondContact NZ-OE2 3.46Å; G296-E303 WeakPolarHBondContact CA-O 3.4Å; Y297-E303 PolarHBondContact N-O 3.26Å; Y297-E303 CarbonylContact O-C 3.55Å; Y299-E303 HydrophobicContact CE2-CB 4.1Å; Y299-E303 HydrophobicContact CE2-CG 3.74Å; S300-E303 PolarHBondContact O-N 2.86Å; P301-E303 VanDerWaalsContact C-N 3.33Å
304	C	94.1	Very high	94.7	Very high	1 Å²	1	24 Å²	24	1%	0.007	11%	0.112	C	C	.	.	B	Isolated β-bridge	trans	-54.6	138.2	167.7	-85.9	0	0	0	0	112.8	L105 P111 Y297 S300 P308 C309	L105-C304 WeakPolarHBondContact CD2-SG 3.45Å; P111-C304 HydrophobicContact CG-CB 3.95Å; Y297-C304 PolarHBondContact O-N 2.86Å; S300-C304 PolarHBondContact O-N 3.19Å; C304-P308 HydrophobicContact CB-CB 4.08Å; C304-C309 VanDerWaalsContact CB-SG 3.57Å
305	G	94.8	Very high	94.8	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.01	12%	0.115	C	C	.	.			trans	-81.2	-173.8	168.8	0	0	0	0	0	113.3	S293 M294 I295 I307 P308 C309	S293-G305 CarbonylContact O-C 3.6Å; S293-G305 VanDerWaalsContact O-CA 3.28Å; S293-G305 WeakPolarHBondContact O-CA 3.44Å; M294-G305 CarbonylContact O-C 3.48Å; I295-G305 WeakPolarHBondContact O-CA 3.34Å; I295-G305 PolarHBondContact O-N 2.84Å; G305-I307 VanDerWaalsContact C-N 3.34Å; G305-I307 PolarHBondContact O-N 2.81Å; G305-P308 WeakPolarHBondContact O-CD 3.45Å; G305-C309 WeakPolarHBondContact O-CB 3.5Å; G305-C309 PolarHBondContact O-N 2.88Å; G305-C309 VanDerWaalsContact O-N 3.12Å; G305-C309 PolarHBondContact O-SG 2.77Å; G305-C309 VanDerWaalsContact O-SG 3.38Å
306	I	97	Very high	94.8	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-63.9	-33.1	-175.6	-74.6	171.4	0	0	0	113.3	F260 V264 L265 I280 S293 M294 G310 F485 L623	F260-I306 HydrophobicContact CD1-CD1 4.32Å; F260-I306 HydrophobicContact CE1-CD1 3.52Å; F260-I306 HydrophobicContact CE1-CG1 4.12Å; F260-I306 HydrophobicContact CZ-CD1 3.71Å; V264-I306 HydrophobicContact CB-CD1 4.29Å; V264-I306 HydrophobicContact CG1-CD1 4.1Å; V264-I306 HydrophobicContact CG2-CD1 4.26Å; L265-I306 HydrophobicContact CD2-CG2 4.15Å; I280-I306 HydrophobicContact CD1-CG2 4.09Å; I280-I306 HydrophobicContact CG2-CG2 4.23Å; S293-I306 PolarHBondContact O-N 2.95Å; M294-I306 PolarHBondContact O-N 2.84Å; M294-I306 VanDerWaalsContact O-N 3.16Å; M294-I306 HydrophobicContact SD-CB 4.44Å; M294-I306 HydrophobicContact SD-CG2 4.44Å; I306-G310 WeakPolarHBondContact O-CA 3.49Å; I306-G310 PolarHBondContact O-N 3.06Å; I306-F485 HydrophobicContact CG2-CD1 3.91Å; I306-F485 HydrophobicContact CG2-CE1 3.6Å; I306-L623 HydrophobicContact CD1-CD1 3.36Å
307	I	98	Very high	94.9	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.01	13%	0.127	C	C	.	.	H	α-helix	trans	-73.5	-53.3	179.9	-54.8	172.2	0	0	0	110.9	M294 I295 G305 C309 G310 I311 L435 F458 F485	M294-I307 HydrophobicContact CB-CD1 4.23Å; M294-I307 HydrophobicContact CB-CG1 4.5Å; M294-I307 HydrophobicContact CE-CD1 4.27Å; M294-I307 HydrophobicContact CE-CG1 4.25Å; M294-I307 WeakPolarHBondContact O-CB 3.48Å; M294-I307 VanDerWaalsContact O-CG1 3.29Å; M294-I307 WeakPolarHBondContact O-CG1 3.45Å; M294-I307 PolarHBondContact O-N 2.82Å; I295-I307 HydrophobicContact CG1-CD1 4.4Å; G305-I307 VanDerWaalsContact C-N 3.34Å; G305-I307 PolarHBondContact O-N 2.81Å; I307-C309 PolarHBondContact O-N 2.92Å; I307-G310 PolarHBondContact O-N 2.78Å; I307-I311 HydrophobicContact CG2-CD1 4.02Å; I307-I311 HydrophobicContact CG2-CG1 4.49Å; I307-I311 WeakPolarHBondContact O-CG1 3.28Å; I307-I311 PolarHBondContact O-N 2.84Å; I307-L435 HydrophobicContact CB-CD2 4.35Å; I307-L435 HydrophobicContact CG2-CD1 4.05Å; I307-L435 HydrophobicContact CG2-CD2 3.87Å; I307-F458 HydrophobicContact CD1-CB 4.42Å; I307-F458 HydrophobicContact CG2-CD1 3.64Å; I307-F458 HydrophobicContact CG2-CE1 3.77Å; I307-F458 HydrophobicContact CG2-CG 4.34Å; I307-F485 HydrophobicContact CD1-CB 3.85Å; I307-F485 HydrophobicContact CD1-CG 4.39Å; I307-F485 HydrophobicContact CG1-CB 3.7Å; I307-F485 HydrophobicContact CG1-CD1 3.84Å; I307-F485 HydrophobicContact CG1-CD2 4.26Å; I307-F485 HydrophobicContact CG1-CE1 4.47Å; I307-F485 HydrophobicContact CG1-CG 3.7Å; I307-F485 HydrophobicContact CG2-CD2 4.29Å
308	P	97.5	Very high	94.9	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-58.4	-43.6	174.6	-25	33.7	0	0	0	113.6	F102 L106 I295 C304 G305 I311 S312 L435	F102-P308 HydrophobicContact CD1-CB 3.81Å; F102-P308 HydrophobicContact CD1-CG 3.47Å; F102-P308 VanDerWaalsContact CD1-CG 3.47Å; F102-P308 HydrophobicContact CD2-CG 4.33Å; F102-P308 HydrophobicContact CE1-CB 4.15Å; F102-P308 HydrophobicContact CE1-CG 3.48Å; F102-P308 VanDerWaalsContact CE1-CG 3.48Å; F102-P308 HydrophobicContact CE2-CG 4.35Å; F102-P308 HydrophobicContact CG-CB 4.4Å; F102-P308 HydrophobicContact CG-CG 3.92Å; F102-P308 HydrophobicContact CZ-CG 3.95Å; L106-P308 HydrophobicContact CD1-CB 4.25Å; I295-P308 WeakPolarHBondContact O-CG 3.44Å; C304-P308 HydrophobicContact CB-CB 4.08Å; G305-P308 WeakPolarHBondContact O-CD 3.45Å; P308-I311 PolarHBondContact O-N 2.81Å; P308-S312 WeakPolarHBondContact O-CB 3.16Å; P308-S312 PolarHBondContact O-N 2.98Å; P308-L435 HydrophobicContact CG-CD2 3.96Å
309	C	97	Very high	94.9	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.007	13%	0.125	C	C	.	.	H	α-helix	trans	-62.7	-43.4	174.6	-70.7	0	0	0	0	111.7	C261 L265 C304 G305 I307 I311 S312 W313	C261-C309 HydrophobicContact CB-CB 4.1Å; L265-C309 HydrophobicContact CD1-CB 3.83Å; C304-C309 VanDerWaalsContact CB-SG 3.57Å; G305-C309 WeakPolarHBondContact O-CB 3.5Å; G305-C309 PolarHBondContact O-N 2.88Å; G305-C309 VanDerWaalsContact O-N 3.12Å; G305-C309 PolarHBondContact O-SG 2.77Å; G305-C309 VanDerWaalsContact O-SG 3.38Å; I307-C309 PolarHBondContact O-N 2.92Å; C309-I311 VanDerWaalsContact C-N 3.35Å; C309-I311 PolarHBondContact O-N 2.72Å; C309-S312 PolarHBondContact O-N 3.49Å; C309-W313 HydrophobicContact CB-CD2 4.48Å; C309-W313 HydrophobicContact CB-CZ2 4.35Å; C309-W313 VanDerWaalsContact O-CB 3.29Å; C309-W313 WeakPolarHBondContact O-CB 3.32Å; C309-W313 PolarHBondContact O-N 3.1Å
310	G	97.8	Very high	94.8	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-63.9	-35.8	178.1	0	0	0	0	0	113.6	I306 I307 L314	I306-G310 WeakPolarHBondContact O-CA 3.49Å; I306-G310 PolarHBondContact O-N 3.06Å; I307-G310 PolarHBondContact O-N 2.78Å; G310-L314 WeakPolarHBondContact O-CB 3.21Å; G310-L314 PolarHBondContact O-N 3.02Å; G310-L314 VanDerWaalsContact O-N 3.13Å
311	I	98.3	Very high	94.4	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-64	-59.5	170.3	-67.9	164.5	0	0	0	109.4	L106 I307 P308 C309 W313 L314 Y315 A428 A431 L435 F458 L460	L106-I311 HydrophobicContact CD2-CB 4.27Å; L106-I311 HydrophobicContact CD2-CG2 3.84Å; I307-I311 HydrophobicContact CG2-CD1 4.02Å; I307-I311 HydrophobicContact CG2-CG1 4.49Å; I307-I311 WeakPolarHBondContact O-CG1 3.28Å; I307-I311 PolarHBondContact O-N 2.84Å; P308-I311 PolarHBondContact O-N 2.81Å; C309-I311 VanDerWaalsContact C-N 3.35Å; C309-I311 PolarHBondContact O-N 2.72Å; I311-W313 PolarHBondContact O-N 3.16Å; I311-L314 PolarHBondContact O-N 2.95Å; I311-Y315 HydrophobicContact CG2-CD2 4.05Å; I311-Y315 HydrophobicContact CG2-CE2 4.14Å; I311-Y315 WeakPolarHBondContact O-CD2 3.33Å; I311-Y315 PolarHBondContact O-N 2.92Å; I311-Y315 VanDerWaalsContact O-N 3.12Å; I311-A428 HydrophobicContact CG2-CB 4.22Å; I311-A431 HydrophobicContact CG2-CB 3.81Å; I311-L435 HydrophobicContact CD1-CB 4.46Å; I311-L435 HydrophobicContact CD1-CD2 4.2Å; I311-F458 HydrophobicContact CD1-CE1 4.01Å; I311-F458 HydrophobicContact CD1-CZ 4.19Å; I311-F458 HydrophobicContact CG1-CE1 4.48Å; I311-L460 HydrophobicContact CG1-CD2 4.25Å
312	S	97.4	Very high	94.1	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.014	12%	0.121	C	C	.	.	H	α-helix	trans	-49.5	-55.2	-178.3	-179.3	0	0	0	0	111.8	P111 P308 C309 L314 Y315 Q316	P111-S312 PolarHBondContact O-OG 3.36Å; P308-S312 WeakPolarHBondContact O-CB 3.16Å; P308-S312 PolarHBondContact O-N 2.98Å; C309-S312 PolarHBondContact O-N 3.49Å; S312-L314 PolarHBondContact O-N 2.87Å; S312-Y315 PolarHBondContact O-N 3.25Å; S312-Q316 VanDerWaalsContact O-CG 3.27Å; S312-Q316 WeakPolarHBondContact O-CG 3.23Å; S312-Q316 PolarHBondContact O-N 3.11Å; S312-Q316 PolarHBondContact O-OE1 2.65Å; S312-Q316 PolarHBondContact OG-NE2 3.03Å
313	W	97.2	Very high	93.7	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-69.8	-34.1	-174.3	-63.8	-5.3	0	0	0	112.7	P111 I112 L113 P114 I117 Q258 C261 S262 L265 L269 C309 I311 L317	P111-W313 PolarHBondContact O-NE1 2.69Å; I112-W313 PolarHBondContact O-NE1 3.16Å; L113-W313 HydrophobicContact CB-CG 4.48Å; L113-W313 HydrophobicContact CD1-CB 3.77Å; L113-W313 HydrophobicContact CD1-CD2 4.03Å; L113-W313 HydrophobicContact CD1-CG 3.65Å; P114-W313 HydrophobicContact CG-CH2 4.13Å; P114-W313 HydrophobicContact CG-CZ2 4.23Å; I117-W313 HydrophobicContact CD1-CE3 3.76Å; I117-W313 HydrophobicContact CD1-CH2 4.46Å; I117-W313 HydrophobicContact CD1-CZ3 3.72Å; Q258-W313 HydrophobicContact CG-CZ2 4.37Å; C261-W313 HydrophobicContact CB-CH2 3.87Å; C261-W313 HydrophobicContact CB-CZ3 4.2Å; S262-W313 WeakPolarHBondContact OG-CH2 3.24Å; L265-W313 HydrophobicContact CB-CE3 3.96Å; L265-W313 HydrophobicContact CB-CZ3 3.97Å; L265-W313 HydrophobicContact CD1-CD2 4.38Å; L265-W313 HydrophobicContact CD1-CE3 3.48Å; L265-W313 VanDerWaalsContact CD1-CE3 3.48Å; L265-W313 HydrophobicContact CD1-CH2 4.46Å; L265-W313 HydrophobicContact CD1-CZ3 3.54Å; L265-W313 HydrophobicContact CG-CE3 4.35Å; L265-W313 HydrophobicContact CG-CZ3 4.33Å; L269-W313 HydrophobicContact CD1-CB 3.82Å; L269-W313 HydrophobicContact CD1-CE3 4.29Å; C309-W313 HydrophobicContact CB-CD2 4.48Å; C309-W313 HydrophobicContact CB-CZ2 4.35Å; C309-W313 VanDerWaalsContact O-CB 3.29Å; C309-W313 WeakPolarHBondContact O-CB 3.32Å; C309-W313 PolarHBondContact O-N 3.1Å; I311-W313 PolarHBondContact O-N 3.16Å; W313-L317 VanDerWaalsContact O-CB 3.31Å; W313-L317 WeakPolarHBondContact O-CB 3.35Å; W313-L317 WeakPolarHBondContact O-CD1 3.47Å; W313-L317 WeakPolarHBondContact O-CG 3.3Å; W313-L317 PolarHBondContact O-N 2.72Å
314	L	96.9	Very high	93.1	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-64.6	-48.2	174.3	-178.1	64.3	0	0	0	111.2	L269 V272 L273 G310 I311 S312 Q316 L317 L318 I331 L460 F483	L269-L314 HydrophobicContact CD2-CB 3.83Å; L269-L314 HydrophobicContact CD2-CD1 3.98Å; L269-L314 HydrophobicContact CD2-CG 4.45Å; V272-L314 HydrophobicContact CG1-CD1 4.02Å; L273-L314 HydrophobicContact CD2-CD1 4.18Å; L273-L314 HydrophobicContact CG-CD1 4.49Å; G310-L314 WeakPolarHBondContact O-CB 3.21Å; G310-L314 PolarHBondContact O-N 3.02Å; G310-L314 VanDerWaalsContact O-N 3.13Å; I311-L314 PolarHBondContact O-N 2.95Å; S312-L314 PolarHBondContact O-N 2.87Å; L314-Q316 PolarHBondContact O-N 2.85Å; L314-L317 PolarHBondContact O-N 2.86Å; L314-L318 HydrophobicContact CD1-CD1 3.97Å; L314-L318 HydrophobicContact CD1-CG 4.07Å; L314-L318 HydrophobicContact CD2-CD1 4.37Å; L314-L318 HydrophobicContact CG-CD1 3.76Å; L314-L318 HydrophobicContact CG-CG 4.27Å; L314-L318 WeakPolarHBondContact O-CB 3.46Å; L314-L318 VanDerWaalsContact O-CG 3.23Å; L314-L318 WeakPolarHBondContact O-CG 3.42Å; L314-L318 PolarHBondContact O-N 2.85Å; L314-I331 HydrophobicContact CD2-CD1 4.11Å; L314-L460 HydrophobicContact CD2-CD2 3.66Å; L314-F483 HydrophobicContact CD2-CD1 4.47Å
315	Y	96.7	Very high	92.2	Very high	15 Å²	15	37 Å²	37	6%	0.059	16%	0.163	C	C	.	.	H	α-helix	trans	-63.6	-41	179	-84.3	-89	0	0	0	112.1	I311 S312 L318 N319 I331 A425 T427 A428 A431	I311-Y315 HydrophobicContact CG2-CD2 4.05Å; I311-Y315 HydrophobicContact CG2-CE2 4.14Å; I311-Y315 WeakPolarHBondContact O-CD2 3.33Å; I311-Y315 PolarHBondContact O-N 2.92Å; I311-Y315 VanDerWaalsContact O-N 3.12Å; S312-Y315 PolarHBondContact O-N 3.25Å; Y315-L318 PolarHBondContact O-N 1.85Å; Y315-N319 WeakPolarHBondContact O-CB 3.5Å; Y315-N319 VanDerWaalsContact O-CG 3.25Å; Y315-N319 PolarHBondContact O-N 3.01Å; Y315-N319 PolarHBondContact O-ND2 2.74Å; Y315-I331 HydrophobicContact CD1-CD1 4.33Å; Y315-I331 HydrophobicContact CD2-CD1 4.25Å; Y315-I331 HydrophobicContact CE1-CD1 3.83Å; Y315-I331 HydrophobicContact CE2-CD1 3.73Å; Y315-I331 VanDerWaalsContact CZ-CD1 3.5Å; Y315-I331 WeakPolarHBondContact OH-CB 3.42Å; Y315-I331 WeakPolarHBondContact OH-CG2 3.29Å; Y315-A425 VanDerWaalsContact OH-CB 3.29Å; Y315-A425 WeakPolarHBondContact OH-CB 3.27Å; Y315-A425 PolarHBondContact OH-O 3.21Å; Y315-T427 VanDerWaalsContact CE1-C 3.46Å; Y315-T427 PolarHBondContact OH-O 3.31Å; Y315-A428 HydrophobicContact CD2-CB 3.79Å; Y315-A428 HydrophobicContact CE2-CB 4.47Å; Y315-A428 HydrophobicContact CG-CB 3.83Å; Y315-A431 HydrophobicContact CE2-CB 3.74Å
316	Q	95.1	Very high	91.5	Very high	58 Å²	58	43.4 Å²	43.4	27%	0.271	20%	0.197	S	C	.	.	H	α-helix	trans	-60.2	-45.6	174.8	-71.1	162.9	-14.3	0	0	111.8	L113 S312 L314 N319 Y320	L113-Q316 HydrophobicContact CD2-CB 4.3Å; S312-Q316 VanDerWaalsContact O-CG 3.27Å; S312-Q316 WeakPolarHBondContact O-CG 3.23Å; S312-Q316 PolarHBondContact O-N 3.11Å; S312-Q316 PolarHBondContact O-OE1 2.65Å; S312-Q316 PolarHBondContact OG-NE2 3.03Å; L314-Q316 PolarHBondContact O-N 2.85Å; Q316-N319 PolarHBondContact O-N 2.79Å; Q316-Y320 PolarHBondContact O-N 2.91Å; Q316-Y320 VanDerWaalsContact O-N 3.12Å
317	L	94.3	Very high	90.7	Very high	3 Å²	3	43.7 Å²	43.7	2%	0.016	20%	0.199	C	C	.	.	H	α-helix	trans	-68.5	-34.8	177.7	-71.2	166.9	0	0	0	113.2	L113 I117 L118 I121 L269 L273 W313 L314 Q321	L113-L317 HydrophobicContact CD1-CD1 4.4Å; L113-L317 HydrophobicContact CD1-CG 4.46Å; L113-L317 HydrophobicContact CD2-CD2 3.91Å; L113-L317 HydrophobicContact CD2-CG 4.02Å; I117-L317 HydrophobicContact CG2-CD1 4.29Å; L118-L317 HydrophobicContact CD2-CD2 3.62Å; L118-L317 HydrophobicContact CG-CD2 4.32Å; I121-L317 HydrophobicContact CD1-CD1 3.73Å; I121-L317 HydrophobicContact CD1-CD2 3.69Å; I121-L317 HydrophobicContact CD1-CG 4.34Å; L269-L317 HydrophobicContact CB-CD1 4.25Å; L269-L317 HydrophobicContact CD1-CD1 4Å; L273-L317 HydrophobicContact CD1-CB 3.77Å; L273-L317 HydrophobicContact CD1-CD1 3.83Å; L273-L317 HydrophobicContact CD1-CG 4.28Å; W313-L317 VanDerWaalsContact O-CB 3.31Å; W313-L317 WeakPolarHBondContact O-CB 3.35Å; W313-L317 WeakPolarHBondContact O-CD1 3.47Å; W313-L317 WeakPolarHBondContact O-CG 3.3Å; W313-L317 PolarHBondContact O-N 2.72Å; L314-L317 PolarHBondContact O-N 2.86Å; L317-Q321 PolarHBondContact O-N 2.76Å
318	L	93	Very high	90	Very high	7 Å²	7	51.8 Å²	51.8	4%	0.037	23%	0.229	C	C	.	.	H	α-helix	trans	-71.3	-38.3	175.6	-71.3	172.4	0	0	0	112.2	L273 L314 Y315 Y320 Q321 K322 F329 I331 L462	L273-L318 HydrophobicContact CD2-CD2 3.47Å; L273-L318 VanDerWaalsContact CD2-CD2 3.47Å; L273-L318 HydrophobicContact CD2-CG 4.05Å; L314-L318 HydrophobicContact CD1-CD1 3.97Å; L314-L318 HydrophobicContact CD1-CG 4.07Å; L314-L318 HydrophobicContact CD2-CD1 4.37Å; L314-L318 HydrophobicContact CG-CD1 3.76Å; L314-L318 HydrophobicContact CG-CG 4.27Å; L314-L318 WeakPolarHBondContact O-CB 3.46Å; L314-L318 VanDerWaalsContact O-CG 3.23Å; L314-L318 WeakPolarHBondContact O-CG 3.42Å; L314-L318 PolarHBondContact O-N 2.85Å; Y315-L318 PolarHBondContact O-N 1.85Å; L318-Y320 VanDerWaalsContact C-N 3.33Å; L318-Y320 PolarHBondContact O-N 2.79Å; L318-Q321 PolarHBondContact O-N 3.15Å; L318-K322 WeakPolarHBondContact O-CB 3.33Å; L318-K322 PolarHBondContact O-N 2.68Å; L318-F329 HydrophobicContact CB-CD2 4.23Å; L318-F329 HydrophobicContact CD2-CD1 3.65Å; L318-F329 HydrophobicContact CD2-CD2 3.92Å; L318-F329 HydrophobicContact CD2-CE1 3.61Å; L318-F329 HydrophobicContact CD2-CE2 3.9Å; L318-F329 HydrophobicContact CD2-CG 3.79Å; L318-F329 HydrophobicContact CD2-CZ 3.74Å; L318-I331 HydrophobicContact CD1-CD1 3.57Å; L318-I331 HydrophobicContact CD1-CG1 4.35Å; L318-L462 HydrophobicContact CD1-CD1 3.68Å; L318-L462 HydrophobicContact CD1-CD2 4.49Å; L318-L462 HydrophobicContact CD2-CD1 4.06Å; L318-L462 HydrophobicContact CD2-CD2 3.99Å
319	N	91.4	Very high	89.7	Confident	89 Å²	89	53.9 Å²	53.9	48%	0.476	24%	0.238	S	C	.	.	H	α-helix	trans	-60.9	-43.9	172.7	-74.3	-17.5	0	0	0	111	Y315 Q316 Q321 K322 Q323	Y315-N319 WeakPolarHBondContact O-CB 3.5Å; Y315-N319 VanDerWaalsContact O-CG 3.25Å; Y315-N319 PolarHBondContact O-N 3.01Å; Y315-N319 PolarHBondContact O-ND2 2.74Å; Q316-N319 PolarHBondContact O-N 2.79Å; N319-Q321 PolarHBondContact O-N 3.19Å; N319-K322 PolarHBondContact O-N 3.16Å; N319-Q323 WeakPolarHBondContact O-CG 3.41Å; N319-Q323 PolarHBondContact O-N 3.42Å; N319-Q323 VanDerWaalsContact O-N 3.07Å
320	Y	88.1	Confident	89.5	Confident	61 Å²	61	54.6 Å²	54.6	24%	0.239	24%	0.243	C	C	.	.	H	α-helix	trans	-60.1	-41.1	173.8	-170.8	-111.4	0	0	0	112.6	L118 E122 Q316 L318 R324	L118-Y320 HydrophobicContact CD2-CD1 4.06Å; L118-Y320 HydrophobicContact CD2-CE1 4.22Å; L118-Y320 HydrophobicContact CD2-CG 4.33Å; E122-Y320 HydrophobicContact CG-CE1 4.46Å; E122-Y320 PolarHBondContact OE2-OH 2.69Å; Q316-Y320 PolarHBondContact O-N 2.91Å; Q316-Y320 VanDerWaalsContact O-N 3.12Å; L318-Y320 VanDerWaalsContact C-N 3.33Å; L318-Y320 PolarHBondContact O-N 2.79Å; Y320-R324 WeakPolarHBondContact O-CB 3.35Å; Y320-R324 WeakPolarHBondContact O-CG 3.32Å; Y320-R324 PolarHBondContact O-N 3.26Å; Y320-R324 VanDerWaalsContact O-N 3.13Å; Y320-R324 VanDerWaalsContact OH-CZ 3.25Å; Y320-R324 PolarHBondContact OH-NH1 3.45Å; Y320-R324 VanDerWaalsContact OH-NH1 3.08Å; Y320-R324 PolarHBondContact OH-NH2 3.25Å
321	Q	84.3	Confident	89.4	Confident	21 Å²	21	55 Å²	55	10%	0.098	25%	0.245	C	C	.	.	H	α-helix	trans	-71.3	-37	175.1	-72.4	-159.7	19.4	0	0	113.6	L317 L318 N319 Q323 R324 Y325 F329	L317-Q321 PolarHBondContact O-N 2.76Å; L318-Q321 PolarHBondContact O-N 3.15Å; N319-Q321 PolarHBondContact O-N 3.19Å; Q321-Q323 VanDerWaalsContact C-N 3.33Å; Q321-Q323 PolarHBondContact O-N 3.41Å; Q321-R324 PolarHBondContact O-N 2.97Å; Q321-Y325 HydrophobicContact CB-CD2 4.19Å; Q321-Y325 HydrophobicContact CG-CD2 4.33Å; Q321-Y325 HydrophobicContact CG-CE2 4.4Å; Q321-Y325 WeakPolarHBondContact O-CD2 3.34Å; Q321-Y325 PolarHBondContact O-N 3.42Å; Q321-F329 HydrophobicContact CB-CE2 3.86Å; Q321-F329 HydrophobicContact CB-CZ 3.97Å
322	K	85	Confident	89.3	Confident	127 Å²	127	56.2 Å²	56.2	55%	0.552	25%	0.25	S	S	*	.	H	α-helix	trans	-58.6	-47.2	176.4	-177.2	-175.5	176	-171.3	0	110.3	L318 N319 N326 F329	L318-K322 WeakPolarHBondContact O-CB 3.33Å; L318-K322 PolarHBondContact O-N 2.68Å; N319-K322 PolarHBondContact O-N 3.16Å; K322-N326 WeakPolarHBondContact O-CA 3.36Å; K322-N326 PolarHBondContact O-N 2.76Å; K322-N326 VanDerWaalsContact O-N 3.17Å; K322-F329 HydrophobicContact CB-CD2 4.43Å
323	Q	81.7	Confident	89.3	Confident	160 Å²	160	56.1 Å²	56.1	75%	0.748	25%	0.249	S	C	*	.	H	α-helix	trans	-63.2	-42.3	175.8	-70.2	170	-14.7	0	0	112.8	N319 Q321	N319-Q323 WeakPolarHBondContact O-CG 3.41Å; N319-Q323 PolarHBondContact O-N 3.42Å; N319-Q323 VanDerWaalsContact O-N 3.07Å; Q321-Q323 VanDerWaalsContact C-N 3.33Å; Q321-Q323 PolarHBondContact O-N 3.41Å
324	R	79.2	Confident	89.3	Confident	126 Å²	126	56.3 Å²	56.3	48%	0.475	25%	0.251	S	S	.	.	H	α-helix	trans	-80.6	-24.6	-175.6	-78.8	-80	-174.7	80.2	0.6	115.6	E122 Y320 Q321	E122-R324 IonicContact OE1-NH1 2.79Å; E122-R324 PolarHBondContact OE1-NH1 3.28Å; E122-R324 IonicContact OE2-NH1 2.69Å; E122-R324 PolarHBondContact OE2-NH1 2.71Å; E122-R324 IonicContact OE2-NH2 3.36Å; Y320-R324 WeakPolarHBondContact O-CB 3.35Å; Y320-R324 WeakPolarHBondContact O-CG 3.32Å; Y320-R324 PolarHBondContact O-N 3.26Å; Y320-R324 VanDerWaalsContact O-N 3.13Å; Y320-R324 VanDerWaalsContact OH-CZ 3.25Å; Y320-R324 PolarHBondContact OH-NH1 3.45Å; Y320-R324 VanDerWaalsContact OH-NH1 3.08Å; Y320-R324 PolarHBondContact OH-NH2 3.25Å; Q321-R324 PolarHBondContact O-N 2.97Å
325	Y	75.8	Confident	89.3	Confident	105 Å²	105	56.3 Å²	56.3	41%	0.412	25%	0.251	S	S	.	.	H	α-helix	trans	-136.6	11.2	-167.4	-54.2	-66.9	0	0	0	115.2	K125 Q321 T327	K125-Y325 WeakPolarHBondContact CD-OH 3.32Å; K125-Y325 WeakPolarHBondContact CE-OH 3.38Å; K125-Y325 PolarHBondContact NZ-OH 3.24Å; Q321-Y325 HydrophobicContact CB-CD2 4.19Å; Q321-Y325 HydrophobicContact CG-CD2 4.33Å; Q321-Y325 HydrophobicContact CG-CE2 4.4Å; Q321-Y325 WeakPolarHBondContact O-CD2 3.34Å; Q321-Y325 PolarHBondContact O-N 3.42Å; Y325-T327 PolarHBondContact O-N 3.4Å; Y325-T327 PolarHBondContact O-OG1 3.02Å; Y325-T327 VanDerWaalsContact O-OG1 3.13Å
326	N	79.1	Confident	89.2	Confident	134 Å²	134	55.7 Å²	55.7	72%	0.717	25%	0.249	S	C	*	.			trans	43.7	34.7	-175.9	-162.9	13	0	0	0	113.8	K322	K322-N326 WeakPolarHBondContact O-CA 3.36Å; K322-N326 PolarHBondContact O-N 2.76Å; K322-N326 VanDerWaalsContact O-N 3.17Å
327	T	80.5	Confident	89.2	Confident	7 Å²	7	53 Å²	53	4%	0.043	24%	0.236	C	C	.	.			trans	-90.6	128.7	-177.1	-63.5	0	0	0	0	108.6	Y325 F329 Q464	Y325-T327 PolarHBondContact O-N 3.4Å; Y325-T327 PolarHBondContact O-OG1 3.02Å; Y325-T327 VanDerWaalsContact O-OG1 3.13Å; T327-F329 HydrophobicContact CG2-CD1 4.27Å; T327-F329 HydrophobicContact CG2-CD2 4.49Å; T327-F329 HydrophobicContact CG2-CE1 3.68Å; T327-F329 HydrophobicContact CG2-CE2 3.91Å; T327-F329 HydrophobicContact CG2-CZ 3.48Å; T327-F329 VanDerWaalsContact CG2-CZ 3.48Å; T327-Q464 HydrophobicContact CG2-CG 3.67Å
328	R	84	Confident	89.2	Confident	172 Å²	172	52.9 Å²	52.9	65%	0.649	24%	0.235	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-87.1	129.6	177.9	-70.1	-178.2	174.6	147	-2.1	109.2	C465	R328-C465 PolarHBondContact N-O 3.27Å; R328-C465 PolarHBondContact O-N 3.37Å
329	F	91.3	Very high	89.1	Confident	43 Å²	43	52.8 Å²	52.8	19%	0.189	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	143.8	177.3	-60	-72.5	0	0	0	109.7	L318 Q321 K322 T327 L462 Y463 Q464	L318-F329 HydrophobicContact CB-CD2 4.23Å; L318-F329 HydrophobicContact CD2-CD1 3.65Å; L318-F329 HydrophobicContact CD2-CD2 3.92Å; L318-F329 HydrophobicContact CD2-CE1 3.61Å; L318-F329 HydrophobicContact CD2-CE2 3.9Å; L318-F329 HydrophobicContact CD2-CG 3.79Å; L318-F329 HydrophobicContact CD2-CZ 3.74Å; Q321-F329 HydrophobicContact CB-CE2 3.86Å; Q321-F329 HydrophobicContact CB-CZ 3.97Å; K322-F329 HydrophobicContact CB-CD2 4.43Å; T327-F329 HydrophobicContact CG2-CD1 4.27Å; T327-F329 HydrophobicContact CG2-CD2 4.49Å; T327-F329 HydrophobicContact CG2-CE1 3.68Å; T327-F329 HydrophobicContact CG2-CE2 3.91Å; T327-F329 HydrophobicContact CG2-CZ 3.48Å; T327-F329 VanDerWaalsContact CG2-CZ 3.48Å; F329-L462 HydrophobicContact CB-CD1 4.15Å; F329-L462 HydrophobicContact CD1-CD1 3.93Å; F329-L462 HydrophobicContact CG-CD1 4.4Å; F329-Y463 WeakPolarHBondContact CA-O 3.26Å; F329-Q464 HydrophobicContact CD1-CB 4.11Å; F329-Q464 HydrophobicContact CD1-CG 4.07Å; F329-Q464 HydrophobicContact CE1-CB 4.12Å; F329-Q464 HydrophobicContact CE1-CG 3.68Å
330	S	92.5	Very high	88.9	Confident	17 Å²	17	49.1 Å²	49.1	12%	0.119	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	133	168.8	175.3	0	0	0	0	108.4	R424 Y463	S330-R424 PolarHBondContact OG-NH1 2.95Å; S330-Y463 PolarHBondContact N-O 3.07Å; S330-Y463 PolarHBondContact O-N 2.87Å
331	I	95.8	Very high	88.7	Confident	8 Å²	8	50 Å²	50	4%	0.041	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	135.3	175.8	-71.7	170.5	0	0	0	109.2	L314 Y315 L318 I333 A425 H461 L462	L314-I331 HydrophobicContact CD2-CD1 4.11Å; Y315-I331 HydrophobicContact CD1-CD1 4.33Å; Y315-I331 HydrophobicContact CD2-CD1 4.25Å; Y315-I331 HydrophobicContact CE1-CD1 3.83Å; Y315-I331 HydrophobicContact CE2-CD1 3.73Å; Y315-I331 VanDerWaalsContact CZ-CD1 3.5Å; Y315-I331 WeakPolarHBondContact OH-CB 3.42Å; Y315-I331 WeakPolarHBondContact OH-CG2 3.29Å; L318-I331 HydrophobicContact CD1-CD1 3.57Å; L318-I331 HydrophobicContact CD1-CG1 4.35Å; I331-I333 HydrophobicContact CG2-CD1 3.73Å; I331-A425 HydrophobicContact CG2-CB 4.49Å; I331-A425 PolarHBondContact O-N 3.32Å; I331-H461 WeakPolarHBondContact CA-O 3.43Å; I331-L462 HydrophobicContact CD1-CD1 4.42Å; I331-L462 HydrophobicContact CG1-CD1 3.87Å
332	R	96.1	Very high	88.9	Confident	26 Å²	26	53.3 Å²	53.3	10%	0.098	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	144.2	164.9	-69	169.1	137.4	-95.1	-11.3	109.9	D362 E422 L423 R424 H461 Y463	R332-D362 PolarHBondContact NH2-O 3.44Å; R332-E422 HydrophobicContact CB-CB 4.27Å; R332-E422 PolarHBondContact NH1-O 3.21Å; R332-E422 IonicContact NH1-OE2 2.95Å; R332-L423 CarbonylContact C-O 3.13Å; R332-L423 WeakPolarHBondContact CA-O 3.45Å; R332-L423 WeakPolarHBondContact CB-O 3.37Å; R332-R424 HydrophobicContact CG-CB 4.37Å; R332-H461 HydrophobicContact CB-CB 4.42Å; R332-H461 PolarHBondContact N-O 2.92Å; R332-H461 WeakPolarHBondContact O-CB 3.46Å; R332-H461 PolarHBondContact O-CD2 3.44Å; R332-H461 PolarHBondContact O-N 3.38Å; R332-Y463 HydrophobicContact CB-CE2 4.13Å; R332-Y463 HydrophobicContact CG-CE2 4.12Å
333	I	97.4	Very high	89.1	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	143.4	-179.4	-49.8	-60.4	0	0	0	108.8	I331 L349 E422 L423 A425 A431 L434 F458 L460	I331-I333 HydrophobicContact CG2-CD1 3.73Å; I333-L349 HydrophobicContact CG2-CD1 4.21Å; I333-E422 CarbonylContact O-C 3.57Å; I333-E422 WeakPolarHBondContact O-CA 3.42Å; I333-L423 PolarHBondContact N-O 3.32Å; I333-L423 PolarHBondContact O-N 3.39Å; I333-A425 HydrophobicContact CD1-CB 4.31Å; I333-A425 HydrophobicContact CG1-CB 3.82Å; I333-A431 HydrophobicContact CD1-CB 3.92Å; I333-A431 HydrophobicContact CG1-CB 4.24Å; I333-L434 HydrophobicContact CB-CB 4.47Å; I333-L434 HydrophobicContact CB-CD1 3.9Å; I333-L434 HydrophobicContact CG1-CD1 3.85Å; I333-L434 HydrophobicContact CG2-CB 4.23Å; I333-F458 HydrophobicContact CG2-CD2 4.41Å; I333-F458 HydrophobicContact CG2-CE1 4.16Å; I333-F458 HydrophobicContact CG2-CE2 3.6Å; I333-F458 HydrophobicContact CG2-CZ 3.45Å; I333-F458 VanDerWaalsContact CG2-CZ 3.45Å; I333-L460 HydrophobicContact CD1-CB 4.39Å; I333-L460 HydrophobicContact CD1-CG 3.79Å
334	S	96.6	Very high	89.5	Confident	4 Å²	4	44.9 Å²	44.9	3%	0.028	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	140.2	164.5	64.7	0	0	0	0	110.2	T459 H461	S334-T459 PolarHBondContact N-O 3.14Å; S334-T459 PolarHBondContact O-N 3.48Å; S334-H461 WeakPolarHBondContact CB-NE2 3.2Å; S334-H461 PolarHBondContact OG-NE2 2.94Å
335	A	97.3	Very high	90.1	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	129.3	177.4	0	0	0	0	0	110.8	L348 L349 A438 L457 F458	A335-L348 HydrophobicContact CB-CB 4.07Å; A335-L348 HydrophobicContact CB-CD1 4.24Å; A335-L348 WeakPolarHBondContact O-CB 3.37Å; A335-L348 PolarHBondContact O-N 2.86Å; A335-L349 HydrophobicContact CB-CD1 4.29Å; A335-L349 HydrophobicContact CB-CG 4.1Å; A335-A438 HydrophobicContact CB-CB 3.59Å; A335-L457 WeakPolarHBondContact CA-O 3.32Å; A335-F458 HydrophobicContact CB-CD2 3.72Å; A335-F458 HydrophobicContact CB-CE2 4.34Å
336	V	95.8	Very high	90.9	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.012	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	152.4	-179.1	-59.2	0	0	0	0	111.4	F345 R346 I420 M456 L457 L608	V336-F345 HydrophobicContact CB-CE2 3.8Å; V336-F345 HydrophobicContact CB-CZ 4.05Å; V336-F345 HydrophobicContact CG1-CE2 4.05Å; V336-F345 HydrophobicContact CG1-CZ 3.79Å; V336-F345 HydrophobicContact CG2-CE2 3.93Å; V336-F345 HydrophobicContact CG2-CZ 4.48Å; V336-R346 CarbonylContact C-O 3.42Å; V336-R346 WeakPolarHBondContact CA-O 3.33Å; V336-I420 HydrophobicContact CG1-CD1 3.76Å; V336-I420 HydrophobicContact CG1-CG1 3.9Å; V336-I420 HydrophobicContact CG1-CG2 3.74Å; V336-M456 WeakPolarHBondContact O-CA 3.41Å; V336-L457 HydrophobicContact CG2-CB 3.85Å; V336-L457 HydrophobicContact CG2-CD2 4.35Å; V336-L457 HydrophobicContact CG2-CG 4.44Å; V336-L457 PolarHBondContact N-O 3.13Å; V336-L457 PolarHBondContact O-N 2.73Å; V336-L608 HydrophobicContact CG2-CD1 3.85Å
337	E	95	Very high	91.7	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	142.5	177.4	-173.9	179.9	-159	0	0	110.5	F345 R346 L348 R442 T443 S454 H455	E337-F345 CarbonylContact O-C 3.55Å; E337-F345 WeakPolarHBondContact O-CA 3.47Å; E337-R346 PolarHBondContact N-O 3.33Å; E337-R346 PolarHBondContact O-N 2.86Å; E337-R346 IonicContact OE2-CZ 2.63Å; E337-R346 IonicContact OE2-NE 2.55Å; E337-R346 IonicContact OE2-NH2 3.45Å; E337-R346 PolarHBondContact OE2-NH2 2.87Å; E337-L348 HydrophobicContact CB-CD1 4.13Å; E337-L348 HydrophobicContact CB-CD2 3.9Å; E337-L348 HydrophobicContact CB-CG 4.08Å; E337-R442 WeakPolarHBondContact OE1-CG 3.35Å; E337-T443 WeakPolarHBondContact OE1-CB 3.2Å; E337-T443 PolarHBondContact OE1-N 2.94Å; E337-T443 PolarHBondContact OE1-OG1 3.17Å; E337-T443 PolarHBondContact OE2-N 2.95Å; E337-T443 VanDerWaalsContact OE2-N 3.16Å; E337-T443 PolarHBondContact OE2-OG1 3.09Å; E337-S454 WeakPolarHBondContact OE1-CB 3.13Å; E337-S454 PolarHBondContact OE1-OG 2.85Å; E337-H455 CarbonylContact C-O 3.58Å; E337-H455 WeakPolarHBondContact CA-O 3.34Å
338	I	93.1	Very high	92.4	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	123.2	157.6	-65.9	177	0	0	0	107.1	E343 E344 F345 M413 H455 L605 L608	I338-E343 HydrophobicContact CG2-CB 3.63Å; I338-E343 HydrophobicContact CG2-CG 4.05Å; I338-E344 WeakPolarHBondContact CA-O 3.47Å; I338-F345 HydrophobicContact CG1-CB 4.46Å; I338-F345 HydrophobicContact CG1-CD2 4.08Å; I338-M413 HydrophobicContact CD1-CE 3.76Å; I338-M413 HydrophobicContact CG1-CE 4.38Å; I338-H455 HydrophobicContact CB-CB 4.5Å; I338-H455 PolarHBondContact N-O 2.71Å; I338-H455 PolarHBondContact O-N 3.11Å; I338-L605 HydrophobicContact CD1-CB 4.34Å; I338-L608 HydrophobicContact CD1-CB 3.79Å; I338-L608 HydrophobicContact CD1-CD2 3.69Å; I338-L608 HydrophobicContact CD1-CG 4.29Å; I338-L608 HydrophobicContact CG1-CD2 4.11Å
339	T	91.1	Very high	93	Very high	6 Å²	6	26.4 Å²	26.4	4%	0.037	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	158.8	-172.1	-167	0	0	0	0	113.6	E344 T443 H445 L453	T339-E344 HydrophobicContact CG2-CB 4.2Å; T339-E344 PolarHBondContact N-O 2.91Å; T339-E344 PolarHBondContact O-N 2.95Å; T339-T443 WeakPolarHBondContact CB-OG1 3.49Å; T339-T443 PolarHBondContact OG1-OG1 3.19Å; T339-H445 PolarHBondContact OG1-NE2 3.05Å; T339-H445 VanDerWaalsContact OG1-NE2 3.09Å; T339-L453 WeakPolarHBondContact CA-O 3.38Å
340	G	86.9	Confident	93	Very high	12 Å²	12	26.3 Å²	26.3	12%	0.124	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.7	-176.2	171	0	0	0	0	0	115.4	N342 A578	G340-N342 VanDerWaalsContact C-N 3.26Å; G340-N342 PolarHBondContact O-N 3.21Å; G340-A578 WeakPolarHBondContact O-CB 3.22Å
341	L	85.4	Confident	92.8	Very high	78 Å²	78	31.8 Å²	31.8	41%	0.408	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-23.9	-178.3	-65.6	170.8	0	0	0	113.2	L450 L453 R492 K577 A578	L341-L450 HydrophobicContact CD1-CD2 4.44Å; L341-L450 HydrophobicContact CG-CD2 4.09Å; L341-L453 HydrophobicContact CD2-CD1 3.59Å; L341-L453 HydrophobicContact CG-CD1 4.23Å; L341-R492 VanDerWaalsContact CD2-NE 3.31Å; L341-R492 VanDerWaalsContact CD2-NH2 3.3Å; L341-R492 PolarHBondContact O-NH2 3.16Å; L341-K577 PolarHBondContact O-N 3.37Å; L341-A578 PolarHBondContact O-N 2.94Å; L341-A578 VanDerWaalsContact O-N 3.11Å
342	N	86.7	Confident	92.3	Very high	92 Å²	92	31.9 Å²	31.9	49%	0.492	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-3.4	-174	-62.5	-16.1	0	0	0	113.4	G340 E344	G340-N342 VanDerWaalsContact C-N 3.26Å; G340-N342 PolarHBondContact O-N 3.21Å; N342-E344 HydrophobicContact CB-CG 4.28Å
343	E	89.2	Confident	91.6	Very high	6 Å²	6	34.7 Å²	34.7	3%	0.028	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	55.1	-171.6	-62	-167.9	160.3	0	0	113.1	I338 F345 K577 A578 L579 S603 S604 L605	I338-E343 HydrophobicContact CG2-CB 3.63Å; I338-E343 HydrophobicContact CG2-CG 4.05Å; E343-F345 PolarHBondContact O-N 3.45Å; E343-K577 HydrophobicContact CG-CB 4.05Å; E343-A578 HydrophobicContact CG-CB 4.06Å; E343-A578 WeakPolarHBondContact OE1-CA 3.45Å; E343-L579 PolarHBondContact OE1-N 3.12Å; E343-S603 PolarHBondContact OE1-OG 3.25Å; E343-S603 VanDerWaalsContact OE2-C 3.29Å; E343-S603 WeakPolarHBondContact OE2-CA 3.49Å; E343-S603 VanDerWaalsContact OE2-CB 3.23Å; E343-S603 WeakPolarHBondContact OE2-CB 3.47Å; E343-S603 PolarHBondContact OE2-OG 2.83Å; E343-S604 PolarHBondContact OE2-N 2.67Å; E343-L605 PolarHBondContact OE2-N 3.03Å
344	E	90.7	Very high	90.2	Very high	103 Å²	103	38.1 Å²	38.1	48%	0.481	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	113.4	177.1	-74.2	171.4	-154.5	0	0	110.5	I338 T339 N342	I338-E344 WeakPolarHBondContact CA-O 3.47Å; T339-E344 HydrophobicContact CG2-CB 4.2Å; T339-E344 PolarHBondContact N-O 2.91Å; T339-E344 PolarHBondContact O-N 2.95Å; N342-E344 HydrophobicContact CB-CG 4.28Å
345	F	92.7	Very high	89	Confident	27 Å²	27	42 Å²	42	12%	0.118	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	128	173.7	176.7	-92.9	0	0	0	111.1	V336 E337 I338 E343 M413 K416 L417 I420	V336-F345 HydrophobicContact CB-CE2 3.8Å; V336-F345 HydrophobicContact CB-CZ 4.05Å; V336-F345 HydrophobicContact CG1-CE2 4.05Å; V336-F345 HydrophobicContact CG1-CZ 3.79Å; V336-F345 HydrophobicContact CG2-CE2 3.93Å; V336-F345 HydrophobicContact CG2-CZ 4.48Å; E337-F345 CarbonylContact O-C 3.55Å; E337-F345 WeakPolarHBondContact O-CA 3.47Å; I338-F345 HydrophobicContact CG1-CB 4.46Å; I338-F345 HydrophobicContact CG1-CD2 4.08Å; E343-F345 PolarHBondContact O-N 3.45Å; F345-M413 HydrophobicContact CB-CE 4.05Å; F345-M413 HydrophobicContact CB-SD 4.35Å; F345-M413 HydrophobicContact CD2-CE 3.31Å; F345-M413 HydrophobicContact CD2-SD 4.41Å; F345-M413 HydrophobicContact CE2-CE 3.9Å; F345-M413 HydrophobicContact CG-CE 3.85Å; F345-M413 HydrophobicContact CG-SD 4.42Å; F345-K416 HydrophobicContact CB-CD 4.35Å; F345-K416 HydrophobicContact CD1-CB 3.89Å; F345-K416 HydrophobicContact CD1-CD 3.89Å; F345-K416 HydrophobicContact CD1-CG 4.26Å; F345-K416 HydrophobicContact CE1-CB 3.78Å; F345-K416 HydrophobicContact CG-CD 4.38Å; F345-K416 HydrophobicContact CZ-CB 4.48Å; F345-L417 HydrophobicContact CE2-CD2 3.88Å; F345-L417 HydrophobicContact CZ-CD2 4.07Å; F345-I420 HydrophobicContact CZ-CD1 4.26Å; F345-I420 HydrophobicContact CZ-CG1 4.1Å
346	R	93	Very high	87.4	Confident	90 Å²	90	43.2 Å²	43.2	34%	0.34	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	143.5	178.4	-52.2	-168.8	-56.4	-172.5	9.7	111	V336 E337 T443	V336-R346 CarbonylContact C-O 3.42Å; V336-R346 WeakPolarHBondContact CA-O 3.33Å; E337-R346 PolarHBondContact N-O 3.33Å; E337-R346 PolarHBondContact O-N 2.86Å; E337-R346 IonicContact OE2-CZ 2.63Å; E337-R346 IonicContact OE2-NE 2.55Å; E337-R346 IonicContact OE2-NH2 3.45Å; E337-R346 PolarHBondContact OE2-NH2 2.87Å; R346-T443 PolarHBondContact NH2-OG1 3.31Å
347	D	94.9	Very high	85.6	Confident	36 Å²	36	47.4 Å²	47.4	19%	0.193	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	123.7	168.8	-177.1	-19.2	0	0	0	108.9	L349 A350 C421	D347-L349 VanDerWaalsContact C-N 3.32Å; D347-L349 PolarHBondContact OD1-N 3.01Å; D347-A350 HydrophobicContact CB-CB 4.06Å; D347-A350 PolarHBondContact OD1-N 3.17Å; D347-C421 VanDerWaalsContact OD2-CB 3.29Å; D347-C421 WeakPolarHBondContact OD2-CB 3.37Å; D347-C421 PolarHBondContact OD2-N 3.41Å; D347-C421 PolarHBondContact OD2-SG 3.26Å
348	L	95.7	Very high	83.4	Confident	3 Å²	3	56 Å²	56	2%	0.016	30%	0.302	C	S	.	.	S	Bend	trans	-83.1	-9.5	-176.5	-62.3	173.2	0	0	0	112.9	A335 E337 A438 N441 R442 M456	A335-L348 HydrophobicContact CB-CB 4.07Å; A335-L348 HydrophobicContact CB-CD1 4.24Å; A335-L348 WeakPolarHBondContact O-CB 3.37Å; A335-L348 PolarHBondContact O-N 2.86Å; E337-L348 HydrophobicContact CB-CD1 4.13Å; E337-L348 HydrophobicContact CB-CD2 3.9Å; E337-L348 HydrophobicContact CB-CG 4.08Å; L348-A438 HydrophobicContact CB-CB 3.94Å; L348-A438 HydrophobicContact CD1-CB 4.27Å; L348-N441 HydrophobicContact CB-CB 4.48Å; L348-N441 HydrophobicContact CD2-CB 4.14Å; L348-N441 PolarHBondContact O-ND2 3.12Å; L348-R442 HydrophobicContact CD2-CB 4.43Å; L348-M456 HydrophobicContact CD1-CE 4.04Å; L348-M456 HydrophobicContact CD1-CG 4.09Å; L348-M456 HydrophobicContact CD1-SD 4.47Å
349	L	96	Very high	81.4	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	33%	0.33	C	S	.	.	S	Bend	trans	-112.4	0.1	179.7	-59.9	-176.5	0	0	0	113.5	I333 A335 D347 N351 T352 K353 C421 L423 L434 A438	I333-L349 HydrophobicContact CG2-CD1 4.21Å; A335-L349 HydrophobicContact CB-CD1 4.29Å; A335-L349 HydrophobicContact CB-CG 4.1Å; D347-L349 VanDerWaalsContact C-N 3.32Å; D347-L349 PolarHBondContact OD1-N 3.01Å; L349-N351 PolarHBondContact O-N 2.9Å; L349-T352 WeakPolarHBondContact O-CA 3.25Å; L349-T352 VanDerWaalsContact O-CB 3.27Å; L349-T352 WeakPolarHBondContact O-CB 3.31Å; L349-T352 PolarHBondContact O-N 2.98Å; L349-T352 PolarHBondContact O-OG1 2.88Å; L349-K353 PolarHBondContact O-N 3.16Å; L349-C421 HydrophobicContact CB-CB 4.27Å; L349-L423 HydrophobicContact CB-CD1 4.07Å; L349-L423 HydrophobicContact CD1-CD1 4.39Å; L349-L434 HydrophobicContact CD2-CB 4.39Å; L349-L434 HydrophobicContact CD2-CD2 4.18Å; L349-L434 WeakPolarHBondContact CD2-O 3.49Å; L349-A438 HydrophobicContact CD2-CB 4.04Å
350	A	92.2	Very high	79.5	Confident	42 Å²	42	67.7 Å²	67.7	35%	0.347	35%	0.352	S	S	.	.	H	α-helix	trans	-55.1	-46.9	-179.3	0	0	0	0	0	113.1	D347 T352 K353	D347-A350 HydrophobicContact CB-CB 4.06Å; D347-A350 PolarHBondContact OD1-N 3.17Å; A350-T352 VanDerWaalsContact C-N 3.28Å; A350-T352 PolarHBondContact O-N 3.01Å; A350-K353 WeakPolarHBondContact O-CB 3.22Å; A350-K353 PolarHBondContact O-N 3.3Å
351	N	86.8	Confident	77.5	Confident	131 Å²	131	70.9 Å²	70.9	70%	0.701	37%	0.372	S	S	*	.	H	α-helix	trans	-66.8	-32.2	177.3	-62.6	4.3	0	0	0	111.9	L349 K353	L349-N351 PolarHBondContact O-N 2.9Å; N351-K353 VanDerWaalsContact C-N 3.33Å
352	T	86.2	Confident	76.1	Confident	10 Å²	10	70.2 Å²	70.2	6%	0.061	37%	0.369	C	S	.	.	H	α-helix	trans	-69.1	-32.6	178.6	-36.3	0	0	0	0	111.9	L349 A350 A354 S355 Y356 L423 L434 T437	L349-T352 WeakPolarHBondContact O-CA 3.25Å; L349-T352 VanDerWaalsContact O-CB 3.27Å; L349-T352 WeakPolarHBondContact O-CB 3.31Å; L349-T352 PolarHBondContact O-N 2.98Å; L349-T352 PolarHBondContact O-OG1 2.88Å; A350-T352 VanDerWaalsContact C-N 3.28Å; A350-T352 PolarHBondContact O-N 3.01Å; T352-A354 VanDerWaalsContact C-N 3.34Å; T352-A354 PolarHBondContact O-N 3.19Å; T352-S355 PolarHBondContact O-N 2.85Å; T352-Y356 HydrophobicContact CG2-CD2 4.06Å; T352-Y356 HydrophobicContact CG2-CE2 4Å; T352-Y356 PolarHBondContact O-N 3.41Å; T352-L423 HydrophobicContact CG2-CD1 4.06Å; T352-L434 HydrophobicContact CG2-CD2 3.8Å; T352-T437 HydrophobicContact CG2-CG2 4.06Å; T352-T437 WeakPolarHBondContact OG1-CG2 3.37Å
353	K	80.3	Confident	74.6	Confident	85 Å²	85	70.8 Å²	70.8	37%	0.37	37%	0.367	S	S	.	.	H	α-helix	trans	-60	-41.3	-179.6	-178.5	178.9	164.4	-172.7	0	112.6	L349 A350 N351 S355 Y356 D357 C421 L423	L349-K353 PolarHBondContact O-N 3.16Å; A350-K353 WeakPolarHBondContact O-CB 3.22Å; A350-K353 PolarHBondContact O-N 3.3Å; N351-K353 VanDerWaalsContact C-N 3.33Å; K353-S355 PolarHBondContact O-N 3.07Å; K353-Y356 PolarHBondContact O-N 3.37Å; K353-D357 WeakPolarHBondContact CE-OD2 3.43Å; K353-D357 IonicContact NZ-OD2 3.27Å; K353-D357 PolarHBondContact O-N 3.49Å; K353-C421 HydrophobicContact CB-CB 4.38Å; K353-C421 HydrophobicContact CD-CB 4.32Å; K353-C421 VanDerWaalsContact CD-SG 3.59Å; K353-L423 HydrophobicContact CB-CD2 3.96Å; K353-L423 HydrophobicContact CG-CD2 3.98Å
354	A	69.4	Low	73	Confident	73 Å²	73	71.7 Å²	71.7	60%	0.603	37%	0.374	S	S	*	.	H	α-helix	trans	-56.9	-38.4	178.1	0	0	0	0	0	112.1	T352 Y356	T352-A354 VanDerWaalsContact C-N 3.34Å; T352-A354 PolarHBondContact O-N 3.19Å; A354-Y356 VanDerWaalsContact C-N 3.31Å; A354-Y356 PolarHBondContact O-N 3.34Å
355	S	70	Confident	71.4	Confident	86 Å²	86	68.1 Å²	68.1	60%	0.601	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-0	176.2	-172.5	0	0	0	0	114.3	T352 K353	T352-S355 PolarHBondContact O-N 2.85Å; K353-S355 PolarHBondContact O-N 3.07Å
356	Y	65.3	Low	69.6	Low	24 Å²	24	67.7 Å²	67.7	9%	0.094	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.7	-35.6	-179.4	-104.7	-118.1	0	0	0	112.3	T352 K353 A354 E358 E359 Y360 L423 K430 Y433 L434	T352-Y356 HydrophobicContact CG2-CD2 4.06Å; T352-Y356 HydrophobicContact CG2-CE2 4Å; T352-Y356 PolarHBondContact O-N 3.41Å; K353-Y356 PolarHBondContact O-N 3.37Å; A354-Y356 VanDerWaalsContact C-N 3.31Å; A354-Y356 PolarHBondContact O-N 3.34Å; Y356-E358 PolarHBondContact O-N 2.93Å; Y356-E359 PolarHBondContact O-N 3.07Å; Y356-E359 VanDerWaalsContact O-N 3.15Å; Y356-Y360 PolarHBondContact O-N 3.33Å; Y356-L423 HydrophobicContact CD1-CB 4.23Å; Y356-L423 HydrophobicContact CD1-CD1 4.36Å; Y356-L423 HydrophobicContact CD1-CD2 4.25Å; Y356-L423 HydrophobicContact CE1-CB 4.25Å; Y356-L423 HydrophobicContact CG-CD1 4.3Å; Y356-L423 HydrophobicContact CG-CD2 4.37Å; Y356-K430 VanDerWaalsContact OH-CE 3.24Å; Y356-K430 WeakPolarHBondContact OH-CE 3.22Å; Y356-K430 WeakPolarHBondContact OH-CG 3.14Å; Y356-Y433 HydrophobicContact CE2-CE1 4.26Å; Y356-L434 HydrophobicContact CE2-CD2 4.15Å
357	D	57	Low	67.3	Low	90 Å²	90	70.7 Å²	70.7	48%	0.481	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-18.6	-178.1	-77.4	-4.4	0	0	0	112.5	K353	K353-D357 WeakPolarHBondContact CE-OD2 3.43Å; K353-D357 IonicContact NZ-OD2 3.27Å; K353-D357 PolarHBondContact O-N 3.49Å
358	E	49.9	Very low	64.6	Low	182 Å²	182	75.9 Å²	75.9	85%	0.85	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-26.9	171.5	-65.7	-173.2	159.7	0	0	113.7	Y356	Y356-E358 PolarHBondContact O-N 2.93Å
359	E	50.7	Low	62	Low	124 Å²	124	77.9 Å²	77.9	58%	0.579	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-36.9	-173.5	-166	-167.3	-133.5	0	0	113.1	Y356 K430	Y356-E359 PolarHBondContact O-N 3.07Å; Y356-E359 VanDerWaalsContact O-N 3.15Å; E359-K430 IonicContact OE2-NZ 2.68Å; E359-K430 PolarHBondContact OE2-NZ 2.8Å
360	Y	50.3	Low	59.3	Low	128 Å²	128	82.7 Å²	82.7	50%	0.502	43%	0.428	S	S	.	.			trans	-147	96.7	-176.4	-95.9	-79.2	0	0	0	112.6	Y356 D362	Y356-Y360 PolarHBondContact O-N 3.33Å; Y360-D362 PolarHBondContact O-N 3.34Å
361	S	44.8	Very low	56.2	Low	78 Å²	78	84.6 Å²	84.6	55%	0.545	44%	0.436	S	S	.	.			trans	-74.1	37.6	-179.2	85.7	0	0	0	0	114.8	K363 N885	S361-K363 PolarHBondContact O-N 3.03Å; S361-N885 PolarHBondContact OG-ND2 3.41Å
362	D	56.2	Low	53.5	Low	64 Å²	64	82.2 Å²	82.2	34%	0.342	43%	0.426	S	S	.	.			trans	-83.7	85.5	-167.5	-166.2	46.9	0	0	0	111.9	R332 Y360 S364 R424	R332-D362 PolarHBondContact NH2-O 3.44Å; Y360-D362 PolarHBondContact O-N 3.34Å; D362-S364 PolarHBondContact O-N 3.38Å; D362-R424 WeakPolarHBondContact OD2-CD 3.41Å; D362-R424 IonicContact OD2-CZ 3.16Å; D362-R424 VanDerWaalsContact OD2-CZ 3.3Å; D362-R424 IonicContact OD2-NE 3.28Å; D362-R424 PolarHBondContact OD2-NE 3.32Å; D362-R424 IonicContact OD2-NH1 3.51Å; D362-R424 PolarHBondContact OD2-NH1 2.96Å
363	K	55.4	Low	51	Low	105 Å²	105	87.6 Å²	87.6	46%	0.457	46%	0.455	S	S	.	.			trans	-46.9	133.2	-177.1	-72.8	168.1	179.3	155.2	0	111.8	S361 Y368 N885	S361-K363 PolarHBondContact O-N 3.03Å; K363-Y368 HydrophobicContact CB-CE2 4.2Å; K363-N885 PolarHBondContact NZ-OD1 3.1Å
364	S	56.3	Low	48.6	Very low	24 Å²	24	91.2 Å²	91.2	17%	0.168	47%	0.466	C	S	.	.			trans	-55.5	128.6	-171.8	-175.3	0	0	0	0	112.4	D362 S366 H367 E422 Y463	D362-S364 PolarHBondContact O-N 3.38Å; S364-S366 PolarHBondContact O-N 3.16Å; S364-S366 PolarHBondContact OG-N 2.96Å; S364-H367 VanDerWaalsContact O-CB 3.24Å; S364-H367 WeakPolarHBondContact O-CB 3.44Å; S364-H367 PolarHBondContact O-N 2.96Å; S364-E422 PolarHBondContact OG-OE2 3.36Å; S364-Y463 PolarHBondContact OG-OH 3.31Å
365	P	56.7	Low	46.7	Very low	29 Å²	29	91.4 Å²	91.4	19%	0.188	46%	0.463	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-22.6	175.1	-29.1	36.7	0	0	0	114.2	H367 Y368 L369 Y463	P365-H367 PolarHBondContact O-N 3.05Å; P365-Y368 PolarHBondContact O-N 3.05Å; P365-Y368 VanDerWaalsContact O-N 3.14Å; P365-L369 HydrophobicContact CB-CD1 4.38Å; P365-L369 WeakPolarHBondContact O-CB 3.41Å; P365-L369 WeakPolarHBondContact O-CG 3.36Å; P365-L369 PolarHBondContact O-N 3.44Å; P365-Y463 HydrophobicContact CB-CD1 3.81Å; P365-Y463 HydrophobicContact CB-CE1 4.02Å; P365-Y463 HydrophobicContact CB-CG 4.09Å; P365-Y463 HydrophobicContact CG-CG 4.39Å
366	S	54.6	Low	44.9	Very low	18 Å²	18	94.2 Å²	94.2	13%	0.126	47%	0.47	C	S	.	.	H	α-helix	trans	-55.5	-33.9	169.5	-76.5	0	0	0	0	113.6	S364 Y368 L369 Q370 Y463 R480	S364-S366 PolarHBondContact O-N 3.16Å; S364-S366 PolarHBondContact OG-N 2.96Å; S366-Y368 PolarHBondContact O-N 3.36Å; S366-L369 PolarHBondContact O-N 2.8Å; S366-Q370 WeakPolarHBondContact O-CB 3.46Å; S366-Q370 WeakPolarHBondContact O-CG 3.35Å; S366-Q370 PolarHBondContact O-N 2.93Å; S366-Y463 WeakPolarHBondContact OG-CE1 3.21Å; S366-Y463 PolarHBondContact OG-OH 2.84Å; S366-R480 PolarHBondContact OG-NH1 2.87Å
367	H	45.1	Very low	43.2	Very low	152 Å²	152	101.1 Å²	101.1	70%	0.704	50%	0.503	S	S	*	.	H	α-helix	trans	-67	-27.5	-179.7	-152.9	-55.7	0	0	0	112.4	S364 P365	S364-H367 VanDerWaalsContact O-CB 3.24Å; S364-H367 WeakPolarHBondContact O-CB 3.44Å; S364-H367 PolarHBondContact O-N 2.96Å; P365-H367 PolarHBondContact O-N 3.05Å
368	Y	36.8	Very low	41.8	Very low	145 Å²	145	103.9 Å²	103.9	57%	0.569	51%	0.513	S	S	*	.	H	α-helix	trans	-90.8	-37.7	175.8	-58.9	-85.9	0	0	0	111.5	K363 P365 S366 T371	K363-Y368 HydrophobicContact CB-CE2 4.2Å; P365-Y368 PolarHBondContact O-N 3.05Å; P365-Y368 VanDerWaalsContact O-N 3.14Å; S366-Y368 PolarHBondContact O-N 3.36Å; Y368-T371 WeakPolarHBondContact O-CG2 3.34Å; Y368-T371 PolarHBondContact O-OG1 2.74Å
369	L	41.4	Very low	40.7	Very low	46 Å²	46	104 Å²	104	24%	0.241	51%	0.511	C	S	.	.	H	α-helix	trans	-75.2	-21.8	-179	-69.1	168.3	0	0	0	114.4	P365 S366 T371 T372 Y463	P365-L369 HydrophobicContact CB-CD1 4.38Å; P365-L369 WeakPolarHBondContact O-CB 3.41Å; P365-L369 WeakPolarHBondContact O-CG 3.36Å; P365-L369 PolarHBondContact O-N 3.44Å; S366-L369 PolarHBondContact O-N 2.8Å; L369-T371 PolarHBondContact O-N 2.77Å; L369-T371 VanDerWaalsContact O-N 3.15Å; L369-T372 PolarHBondContact O-N 2.9Å; L369-T372 PolarHBondContact O-OG1 3.28Å; L369-Y463 HydrophobicContact CD1-CD1 3.69Å; L369-Y463 HydrophobicContact CD1-CE1 4.21Å
370	Q	39.6	Very low	39.6	Very low	100 Å²	100	106.2 Å²	106.2	47%	0.467	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-23.9	177.1	-90.5	-172.4	28	0	0	113.8	S366 T372 N373 R374	S366-Q370 WeakPolarHBondContact O-CB 3.46Å; S366-Q370 WeakPolarHBondContact O-CG 3.35Å; S366-Q370 PolarHBondContact O-N 2.93Å; Q370-T372 VanDerWaalsContact C-N 3.27Å; Q370-T372 PolarHBondContact O-N 2.91Å; Q370-N373 PolarHBondContact O-N 2.86Å; Q370-R374 PolarHBondContact O-N 2.78Å; Q370-R374 VanDerWaalsContact O-N 3.14Å
371	T	28.2	Very low	38.5	Very low	83 Å²	83	104 Å²	104	51%	0.509	53%	0.53	S	S	.	.	H	α-helix	trans	-51.1	-45.8	173.4	53.3	0	0	0	0	111.8	Y368 L369 N373 R374 S375	Y368-T371 WeakPolarHBondContact O-CG2 3.34Å; Y368-T371 PolarHBondContact O-OG1 2.74Å; L369-T371 PolarHBondContact O-N 2.77Å; L369-T371 VanDerWaalsContact O-N 3.15Å; T371-N373 VanDerWaalsContact C-N 3.28Å; T371-N373 PolarHBondContact O-N 2.87Å; T371-R374 PolarHBondContact O-N 2.88Å; T371-S375 WeakPolarHBondContact O-CB 3.43Å; T371-S375 PolarHBondContact O-N 2.79Å; T371-S375 PolarHBondContact O-OG 3.37Å
372	T	30.1	Very low	37.6	Very low	80 Å²	80	107.8 Å²	107.8	49%	0.491	55%	0.549	S	S	.	.	H	α-helix	trans	-59.2	-32.4	-176.3	61.4	0	0	0	0	114.5	L369 Q370	L369-T372 PolarHBondContact O-N 2.9Å; L369-T372 PolarHBondContact O-OG1 3.28Å; Q370-T372 VanDerWaalsContact C-N 3.27Å; Q370-T372 PolarHBondContact O-N 2.91Å
373	N	32.2	Very low	36.4	Very low	123 Å²	123	109.2 Å²	109.2	66%	0.658	57%	0.565	S	S	*	*	H	α-helix	trans	-95.8	-29.1	179.8	-80.8	-69.3	0	0	0	113.5	Q370 T371	Q370-N373 PolarHBondContact O-N 2.86Å; T371-N373 VanDerWaalsContact C-N 3.28Å; T371-N373 PolarHBondContact O-N 2.87Å
374	R	31.3	Very low	34.9	Very low	162 Å²	162	109.9 Å²	109.9	61%	0.611	58%	0.582	S	S	*	*	H	α-helix	trans	-73.6	-38.7	174	-77.4	-174.3	172.4	173.3	-0.4	112.2	Q370 T371 I376 Q377 Q378	Q370-R374 PolarHBondContact O-N 2.78Å; Q370-R374 VanDerWaalsContact O-N 3.14Å; T371-R374 PolarHBondContact O-N 2.88Å; R374-I376 PolarHBondContact O-N 3.21Å; R374-I376 VanDerWaalsContact O-N 3.1Å; R374-Q377 PolarHBondContact O-N 2.85Å; R374-Q378 PolarHBondContact O-N 2.94Å
375	S	28	Very low	33.7	Very low	77 Å²	77	114.5 Å²	114.5	54%	0.538	62%	0.615	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.5	-15.9	-179.8	-62.2	0	0	0	0	114.8	T371	T371-S375 WeakPolarHBondContact O-CB 3.43Å; T371-S375 PolarHBondContact O-N 2.79Å; T371-S375 PolarHBondContact O-OG 3.37Å
376	I	32.5	Very low	32.4	Very low	144 Å²	144	118.7 Å²	118.7	74%	0.738	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-9.9	175.2	-63.2	177.8	0	0	0	112	R374	R374-I376 PolarHBondContact O-N 3.21Å; R374-I376 VanDerWaalsContact O-N 3.1Å
377	Q	29.9	Very low	31	Very low	169 Å²	169	123.8 Å²	123.8	79%	0.79	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108	-4.9	173.6	-67.9	-168.7	-7.1	0	0	114.5	R374	R374-Q377 PolarHBondContact O-N 2.85Å
378	Q	28.7	Very low	30.3	Very low	149 Å²	149	122 Å²	122	70%	0.696	69%	0.685	S	S	*	*	S	Bend	trans	-111.6	10.6	-179.5	-74	-175.2	-51.3	0	0	115.6	R374	R374-Q378 PolarHBondContact O-N 2.94Å
379	K	26.7	Very low	29.8	Very low	185 Å²	185	120.6 Å²	120.6	80%	0.804	70%	0.697	S	S	*	*	S	Bend	trans	-114.4	58.2	168.8	-76.9	-170.5	173.9	-179.6	0	112.4
380	N	26.1	Very low	29.2	Very low	169 Å²	169	127 Å²	127	90%	0.904	73%	0.73	S	S	*	*	S	Bend	trans	-168.8	42	159.1	-102.4	-16	0	0	0	113.9
381	S	28.7	Very low	28.7	Very low	83 Å²	83	127.4 Å²	127.4	58%	0.58	74%	0.744	S	S	*	*			trans	-161.9	78.1	169.5	57	0	0	0	0	112.5	S383	S381-S383 PolarHBondContact O-N 2.81Å
382	T	25.5	Very low	28.9	Very low	156 Å²	156	129.3 Å²	129.3	96%	0.957	76%	0.761	S	S	*	*			trans	-75.6	80	161.5	44.7	0	0	0	0	109.2
383	S	29.7	Very low	28.7	Very low	95 Å²	95	130.9 Å²	130.9	66%	0.664	78%	0.775	S	S	*	*			trans	-150.1	109.1	174.4	56.5	0	0	0	0	109.5	S381	S381-S383 PolarHBondContact O-N 2.81Å
384	S	25.4	Very low	28.5	Very low	118 Å²	118	131.5 Å²	131.5	83%	0.825	78%	0.776	S	S	*	*			trans	-63.6	135.6	179.4	46.4	0	0	0	0	112.7
385	S	30.6	Very low	28.4	Very low	122 Å²	122	130.7 Å²	130.7	85%	0.853	78%	0.783	S	S	*	*			trans	-153.4	113.8	157	-65.6	0	0	0	0	108.1
386	S	29.3	Very low	28.6	Very low	116 Å²	116	135.5 Å²	135.5	81%	0.811	79%	0.794	S	S	*	*			trans	-76.2	157.4	176.5	39	0	0	0	0	111.4
387	S	25.3	Very low	28.6	Very low	125 Å²	125	134.7 Å²	134.7	87%	0.874	80%	0.797	S	S	*	*			trans	-78.2	118.3	170.1	52.7	0	0	0	0	110.9
388	S	30.3	Very low	28.7	Very low	116 Å²	116	132.1 Å²	132.1	81%	0.811	80%	0.797	S	S	*	*			trans	-134.9	128.9	157.5	53.9	0	0	0	0	109.8
389	S	25.5	Very low	28.8	Very low	115 Å²	115	133.4 Å²	133.4	80%	0.804	81%	0.808	S	S	*	*			trans	-97.8	123.1	173.3	51.3	0	0	0	0	109.2
390	L	30.3	Very low	29.3	Very low	180 Å²	180	126.7 Å²	126.7	94%	0.942	79%	0.791	S	S	*	*			trans	-152.6	152	162.9	-108.5	163.6	0	0	0	109.4
391	S	28.4	Very low	30.2	Very low	108 Å²	108	123.4 Å²	123.4	76%	0.755	78%	0.777	S	S	*	*			trans	-128.6	129.3	-164.9	54.2	0	0	0	0	112.4
392	S	31.9	Very low	31.2	Very low	124 Å²	124	124.3 Å²	124.3	87%	0.867	78%	0.775	S	S	*	*			trans	-153.5	156.8	163.2	50.7	0	0	0	0	111.2
393	S	26.4	Very low	32.3	Very low	112 Å²	112	123.4 Å²	123.4	78%	0.783	76%	0.755	S	S	*	*			trans	-59.1	152.4	179.3	-59.9	0	0	0	0	111.9
394	M	28.3	Very low	33.4	Very low	137 Å²	137	124.2 Å²	124.2	68%	0.675	75%	0.749	S	S	*	*				-155.7	157.2	67.8	-80	-159.5	-176.5	0	0	115.9
395	N	28.4	Very low	34.8	Very low	145 Å²	145	125.3 Å²	125.3	78%	0.775	74%	0.738	S	S	*	*			trans	53.2	74.3	145	-60.5	-19.8	0	0	0	119.2
396	K	32.9	Very low	36.2	Very low	177 Å²	177	120.1 Å²	120.1	77%	0.77	70%	0.703	S	S	*	*			trans	-98	109.6	154	-80.1	-179.4	-179.4	170	0	110.9	S398 E404	K396-S398 PolarHBondContact O-N 3.25Å; K396-E404 IonicContact NZ-OE1 2.77Å; K396-E404 PolarHBondContact NZ-OE1 2.94Å
397	T	33.1	Very low	37.9	Very low	128 Å²	128	120.7 Å²	120.7	79%	0.785	69%	0.693	S	S	*	*			trans	-75.4	106.2	170.7	33.9	0	0	0	0	112.4	L399	T397-L399 PolarHBondContact O-N 2.95Å
398	S	30.4	Very low	40.2	Very low	114 Å²	114	118.1 Å²	118.1	80%	0.797	67%	0.672	S	S	*	*	S	Bend	trans	50.3	36	136.3	55.9	0	0	0	0	120.8	K396	K396-S398 PolarHBondContact O-N 3.25Å
399	L	31.6	Very low	42.1	Very low	177 Å²	177	114 Å²	114	93%	0.927	64%	0.642	S	S	*	*			trans	-156.3	73.7	170.5	-112.8	157.6	0	0	0	114.4	T397	T397-L399 PolarHBondContact O-N 2.95Å
400	G	37.6	Very low	44.4	Very low	43 Å²	43	109.5 Å²	109.5	44%	0.443	61%	0.611	S	S	.	*			trans	-167.4	-20	179.8	0	0	0	0	0	121.3	N402 Y403 E404	G400-N402 VanDerWaalsContact C-N 3.32Å; G400-N402 PolarHBondContact O-N 3.06Å; G400-Y403 PolarHBondContact O-N 2.85Å; G400-E404 PolarHBondContact O-N 2.58Å
401	T	45.7	Very low	46.7	Very low	100 Å²	100	103.7 Å²	103.7	61%	0.613	59%	0.589	S	S	*	*	H	α-helix	trans	-49.7	-38.5	-163.1	51.9	0	0	0	0	116.8	K405	T401-K405 WeakPolarHBondContact O-CG 3.34Å; T401-K405 PolarHBondContact O-N 2.88Å
402	N	48.7	Very low	49.2	Very low	102 Å²	102	104.1 Å²	104.1	55%	0.545	58%	0.578	S	S	.	*	H	α-helix	trans	-75.1	-26	-178.9	-68.6	-14.2	0	0	0	113.7	G400 A406	G400-N402 VanDerWaalsContact C-N 3.32Å; G400-N402 PolarHBondContact O-N 3.06Å; N402-A406 PolarHBondContact O-N 2.88Å
403	Y	48.9	Very low	51.5	Low	137 Å²	137	98.4 Å²	98.4	54%	0.537	54%	0.538	S	S	.	.	H	α-helix	trans	-83	-25.6	-179.1	-136.6	-81.4	0	0	0	112.4	G400 A406 Q407	G400-Y403 PolarHBondContact O-N 2.85Å; Y403-A406 WeakPolarHBondContact O-CB 3.46Å; Y403-Q407 PolarHBondContact O-N 3.37Å
404	E	51.5	Low	54	Low	112 Å²	112	97.7 Å²	97.7	52%	0.523	53%	0.525	S	S	.	.	H	α-helix	trans	-72.7	-50.7	175.1	-145.8	149.7	-138.3	0	0	109.4	K396 G400 A406 Q407 T408	K396-E404 IonicContact NZ-OE1 2.77Å; K396-E404 PolarHBondContact NZ-OE1 2.94Å; G400-E404 PolarHBondContact O-N 2.58Å; E404-A406 PolarHBondContact O-N 3.14Å; E404-Q407 PolarHBondContact O-N 2.99Å; E404-T408 PolarHBondContact O-N 3Å; E404-T408 PolarHBondContact O-OG1 3.1Å
405	K	56.8	Low	56.6	Low	141 Å²	141	95.4 Å²	95.4	61%	0.613	52%	0.515	S	S	*	.	H	α-helix	trans	-52.6	-39.3	171.4	-70.5	179.2	178.2	-175.9	0	113.2	T401 Q407 T408 V409	T401-K405 WeakPolarHBondContact O-CG 3.34Å; T401-K405 PolarHBondContact O-N 2.88Å; K405-Q407 VanDerWaalsContact C-N 3.3Å; K405-Q407 PolarHBondContact O-N 3.09Å; K405-T408 PolarHBondContact O-N 2.86Å; K405-V409 PolarHBondContact O-N 2.58Å; K405-V409 VanDerWaalsContact O-N 3.07Å
406	A	59.5	Low	59.3	Low	13 Å²	13	93.2 Å²	93.2	11%	0.107	50%	0.499	C	S	.	.	H	α-helix	trans	-58.9	-39.9	175.6	0	0	0	0	0	113.1	N402 Y403 E404 S410 Y601 Y607	N402-A406 PolarHBondContact O-N 2.88Å; Y403-A406 WeakPolarHBondContact O-CB 3.46Å; E404-A406 PolarHBondContact O-N 3.14Å; A406-S410 WeakPolarHBondContact O-CB 3.37Å; A406-S410 PolarHBondContact O-N 3.22Å; A406-S410 VanDerWaalsContact O-N 3.13Å; A406-Y601 HydrophobicContact CB-CD2 3.3Å; A406-Y601 HydrophobicContact CB-CE2 3.31Å; A406-Y601 HydrophobicContact CB-CG 4.27Å; A406-Y607 PolarHBondContact O-OH 3.35Å
407	Q	64.7	Low	61.5	Low	128 Å²	128	86.3 Å²	86.3	60%	0.598	47%	0.47	S	S	*	.	H	α-helix	trans	-75.4	-36.1	178.6	-66.9	-179	17	0	0	111.1	Y403 E404 K405 S410 A411	Y403-Q407 PolarHBondContact O-N 3.37Å; E404-Q407 PolarHBondContact O-N 2.99Å; K405-Q407 VanDerWaalsContact C-N 3.3Å; K405-Q407 PolarHBondContact O-N 3.09Å; Q407-S410 PolarHBondContact O-N 2.92Å; Q407-A411 WeakPolarHBondContact O-CB 3.36Å; Q407-A411 PolarHBondContact O-N 2.98Å
408	T	73	Confident	63.5	Low	71 Å²	71	84.1 Å²	84.1	44%	0.436	46%	0.46	S	S	.	.	H	α-helix	trans	-58.5	-50.6	174	-42.8	0	0	0	0	111.9	E404 K405 S410 A411 Q412	E404-T408 PolarHBondContact O-N 3Å; E404-T408 PolarHBondContact O-OG1 3.1Å; K405-T408 PolarHBondContact O-N 2.86Å; T408-S410 PolarHBondContact O-N 2.9Å; T408-A411 PolarHBondContact O-N 3.29Å; T408-Q412 WeakPolarHBondContact O-CB 3.12Å; T408-Q412 WeakPolarHBondContact O-CG 3.47Å; T408-Q412 PolarHBondContact O-N 3.36Å
409	V	70.9	Confident	66	Low	29 Å²	29	85 Å²	85	18%	0.176	45%	0.451	C	S	.	.	H	α-helix	trans	-64.9	-40.6	177.9	-179.6	0	0	0	0	111	K405 A411 M413 Y607	K405-V409 PolarHBondContact O-N 2.58Å; K405-V409 VanDerWaalsContact O-N 3.07Å; V409-A411 VanDerWaalsContact C-N 3.32Å; V409-A411 PolarHBondContact O-N 2.94Å; V409-M413 WeakPolarHBondContact O-CB 3.33Å; V409-M413 PolarHBondContact O-N 3.14Å; V409-Y607 HydrophobicContact CG1-CD2 4.43Å; V409-Y607 HydrophobicContact CG1-CE2 3.95Å
410	S	73.2	Confident	68.7	Low	22 Å²	22	78.3 Å²	78.3	15%	0.154	42%	0.416	C	S	.	.	H	α-helix	trans	-59.4	-42	174.6	-166.9	0	0	0	0	112.7	A406 Q407 T408 I414 Y607	A406-S410 WeakPolarHBondContact O-CB 3.37Å; A406-S410 PolarHBondContact O-N 3.22Å; A406-S410 VanDerWaalsContact O-N 3.13Å; Q407-S410 PolarHBondContact O-N 2.92Å; T408-S410 PolarHBondContact O-N 2.9Å; S410-I414 WeakPolarHBondContact O-CB 3.38Å; S410-I414 WeakPolarHBondContact O-CD1 3.23Å; S410-I414 WeakPolarHBondContact O-CG1 3.38Å; S410-I414 PolarHBondContact O-N 3.18Å; S410-I414 VanDerWaalsContact O-N 3.07Å; S410-Y607 VanDerWaalsContact CB-OH 3.31Å; S410-Y607 WeakPolarHBondContact CB-OH 3.41Å; S410-Y607 WeakPolarHBondContact OG-CE1 3.23Å
411	A	78.1	Confident	71.2	Confident	58 Å²	58	77.1 Å²	77.1	48%	0.479	40%	0.4	S	S	.	.	H	α-helix	trans	-69.5	-51.7	-179.3	0	0	0	0	0	110.4	Q407 T408 V409 M413 I414 D415	Q407-A411 WeakPolarHBondContact O-CB 3.36Å; Q407-A411 PolarHBondContact O-N 2.98Å; T408-A411 PolarHBondContact O-N 3.29Å; V409-A411 VanDerWaalsContact C-N 3.32Å; V409-A411 PolarHBondContact O-N 2.94Å; A411-M413 PolarHBondContact O-N 3.32Å; A411-I414 PolarHBondContact O-N 3.33Å; A411-I414 VanDerWaalsContact O-N 3.14Å; A411-D415 VanDerWaalsContact O-CB 3.23Å; A411-D415 WeakPolarHBondContact O-CB 3.36Å; A411-D415 PolarHBondContact O-N 3.03Å
412	Q	81.8	Confident	73.5	Confident	116 Å²	116	74.3 Å²	74.3	54%	0.542	38%	0.381	S	S	.	.	H	α-helix	trans	-55.5	-37.5	176.8	-73.3	174.8	-13.6	0	0	112.9	T408 K416	T408-Q412 WeakPolarHBondContact O-CB 3.12Å; T408-Q412 WeakPolarHBondContact O-CG 3.47Å; T408-Q412 PolarHBondContact O-N 3.36Å; Q412-K416 WeakPolarHBondContact O-CB 3.41Å; Q412-K416 VanDerWaalsContact O-CG 3.25Å; Q412-K416 WeakPolarHBondContact O-CG 3.41Å; Q412-K416 PolarHBondContact O-N 2.95Å
413	M	81.2	Confident	75.7	Confident	4 Å²	4	69.8 Å²	69.8	2%	0.02	36%	0.356	C	S	.	.	H	α-helix	trans	-77.6	-37.5	178.5	-157.8	70.9	-178.2	0	0	112.4	I338 F345 V409 A411 D415 L417 Y607	I338-M413 HydrophobicContact CD1-CE 3.76Å; I338-M413 HydrophobicContact CG1-CE 4.38Å; F345-M413 HydrophobicContact CB-CE 4.05Å; F345-M413 HydrophobicContact CB-SD 4.35Å; F345-M413 HydrophobicContact CD2-CE 3.31Å; F345-M413 HydrophobicContact CD2-SD 4.41Å; F345-M413 HydrophobicContact CE2-CE 3.9Å; F345-M413 HydrophobicContact CG-CE 3.85Å; F345-M413 HydrophobicContact CG-SD 4.42Å; V409-M413 WeakPolarHBondContact O-CB 3.33Å; V409-M413 PolarHBondContact O-N 3.14Å; A411-M413 PolarHBondContact O-N 3.32Å; M413-D415 VanDerWaalsContact C-N 3.32Å; M413-L417 HydrophobicContact CG-CD1 4.33Å; M413-L417 WeakPolarHBondContact O-CB 3.35Å; M413-L417 WeakPolarHBondContact O-CD1 3.25Å; M413-L417 WeakPolarHBondContact O-CG 3.41Å; M413-L417 PolarHBondContact O-N 3.3Å; M413-Y607 HydrophobicContact CB-CD2 4.23Å; M413-Y607 HydrophobicContact CB-CG 4.2Å; M413-Y607 HydrophobicContact CG-CD2 4.46Å; M413-Y607 HydrophobicContact CG-CG 4.3Å
414	I	78.1	Confident	77.8	Confident	98 Å²	98	67.7 Å²	67.7	50%	0.503	35%	0.347	S	S	.	.	H	α-helix	trans	-64.2	-40.2	173.9	-72.1	166.3	0	0	0	110.8	S410 A411 L417 S418	S410-I414 WeakPolarHBondContact O-CB 3.38Å; S410-I414 WeakPolarHBondContact O-CD1 3.23Å; S410-I414 WeakPolarHBondContact O-CG1 3.38Å; S410-I414 PolarHBondContact O-N 3.18Å; S410-I414 VanDerWaalsContact O-N 3.07Å; A411-I414 PolarHBondContact O-N 3.33Å; A411-I414 VanDerWaalsContact O-N 3.14Å; I414-L417 PolarHBondContact O-N 3.21Å; I414-S418 PolarHBondContact O-N 3.47Å
415	D	82.2	Confident	80	Confident	88 Å²	88	62.5 Å²	62.5	47%	0.471	32%	0.324	S	S	.	.	H	α-helix	trans	-60	-54.7	175.1	-177	82.2	0	0	0	111.3	A411 M413 L417 S418 H419	A411-D415 VanDerWaalsContact O-CB 3.23Å; A411-D415 WeakPolarHBondContact O-CB 3.36Å; A411-D415 PolarHBondContact O-N 3.03Å; M413-D415 VanDerWaalsContact C-N 3.32Å; D415-L417 VanDerWaalsContact C-N 3.3Å; D415-L417 PolarHBondContact O-N 2.96Å; D415-S418 WeakPolarHBondContact O-CA 3.29Å; D415-S418 WeakPolarHBondContact O-CB 3.19Å; D415-S418 PolarHBondContact O-N 2.97Å; D415-S418 PolarHBondContact O-OG 3.16Å; D415-H419 PolarHBondContact O-CD2 3.12Å; D415-H419 VanDerWaalsContact O-CD2 3.28Å; D415-H419 PolarHBondContact O-N 3.14Å; D415-H419 IonicContact OD1-NE2 3.18Å; D415-H419 IonicContact OD2-CD2 3.2Å
416	K	84.7	Confident	81.7	Confident	99 Å²	99	59.6 Å²	59.6	43%	0.43	32%	0.321	S	S	.	.	H	α-helix	trans	-54.9	-41.1	172.4	-77.6	178.8	175.9	-163.3	0	113.5	F345 Q412 S418 H419	F345-K416 HydrophobicContact CB-CD 4.35Å; F345-K416 HydrophobicContact CD1-CB 3.89Å; F345-K416 HydrophobicContact CD1-CD 3.89Å; F345-K416 HydrophobicContact CD1-CG 4.26Å; F345-K416 HydrophobicContact CE1-CB 3.78Å; F345-K416 HydrophobicContact CG-CD 4.38Å; F345-K416 HydrophobicContact CZ-CB 4.48Å; Q412-K416 WeakPolarHBondContact O-CB 3.41Å; Q412-K416 VanDerWaalsContact O-CG 3.25Å; Q412-K416 WeakPolarHBondContact O-CG 3.41Å; Q412-K416 PolarHBondContact O-N 2.95Å; K416-S418 VanDerWaalsContact C-N 3.25Å; K416-S418 PolarHBondContact O-N 3.04Å; K416-H419 PolarHBondContact O-N 2.85Å
417	L	80.8	Confident	83.4	Confident	32 Å²	32	62.1 Å²	62.1	17%	0.168	34%	0.335	C	S	.	.	H	α-helix	trans	-70	-20.6	176.2	-69.5	169.3	0	0	0	112.8	F345 M413 I414 D415 I420 L608 E611	F345-L417 HydrophobicContact CE2-CD2 3.88Å; F345-L417 HydrophobicContact CZ-CD2 4.07Å; M413-L417 HydrophobicContact CG-CD1 4.33Å; M413-L417 WeakPolarHBondContact O-CB 3.35Å; M413-L417 WeakPolarHBondContact O-CD1 3.25Å; M413-L417 WeakPolarHBondContact O-CG 3.41Å; M413-L417 PolarHBondContact O-N 3.3Å; I414-L417 PolarHBondContact O-N 3.21Å; D415-L417 VanDerWaalsContact C-N 3.3Å; D415-L417 PolarHBondContact O-N 2.96Å; L417-I420 HydrophobicContact CB-CD1 4.39Å; L417-I420 HydrophobicContact CD2-CD1 3.85Å; L417-I420 WeakPolarHBondContact O-CD1 3.42Å; L417-L608 HydrophobicContact CD2-CD1 4.02Å; L417-E611 HydrophobicContact CD1-CB 4.21Å; L417-E611 HydrophobicContact CD1-CG 4.3Å
418	S	75.1	Confident	85	Confident	82 Å²	82	57 Å²	57	57%	0.573	32%	0.315	S	S	*	.	H	α-helix	trans	-83	-20.9	176.6	82	0	0	0	0	113.7	I414 D415 K416	I414-S418 PolarHBondContact O-N 3.47Å; D415-S418 WeakPolarHBondContact O-CA 3.29Å; D415-S418 WeakPolarHBondContact O-CB 3.19Å; D415-S418 PolarHBondContact O-N 2.97Å; D415-S418 PolarHBondContact O-OG 3.16Å; K416-S418 VanDerWaalsContact C-N 3.25Å; K416-S418 PolarHBondContact O-N 3.04Å
419	H	82	Confident	86.1	Confident	134 Å²	134	56.5 Å²	56.5	62%	0.62	31%	0.308	S	S	*	.	S	Bend	trans	-97.7	7.7	-179.3	-69.5	-57.6	0	0	0	114.6	D415 K416	D415-H419 PolarHBondContact O-CD2 3.12Å; D415-H419 VanDerWaalsContact O-CD2 3.28Å; D415-H419 PolarHBondContact O-N 3.14Å; D415-H419 IonicContact OD1-NE2 3.18Å; D415-H419 IonicContact OD2-CD2 3.2Å; K416-H419 PolarHBondContact O-N 2.85Å
420	I	88.6	Confident	87.3	Confident	36 Å²	36	57.5 Å²	57.5	19%	0.185	31%	0.31	C	S	.	.			trans	-63.2	139	178.8	-55.4	167.8	0	0	0	111.3	V336 F345 L417 E422	V336-I420 HydrophobicContact CG1-CD1 3.76Å; V336-I420 HydrophobicContact CG1-CG1 3.9Å; V336-I420 HydrophobicContact CG1-CG2 3.74Å; F345-I420 HydrophobicContact CZ-CD1 4.26Å; F345-I420 HydrophobicContact CZ-CG1 4.1Å; L417-I420 HydrophobicContact CB-CD1 4.39Å; L417-I420 HydrophobicContact CD2-CD1 3.85Å; L417-I420 WeakPolarHBondContact O-CD1 3.42Å; I420-E422 PolarHBondContact O-N 3.28Å
421	C	90.8	Very high	88.5	Confident	17 Å²	17	56.4 Å²	56.4	12%	0.115	30%	0.302	C	S	.	.			trans	-67.5	95.9	171.1	-60.4	0	0	0	0	111.2	D347 L349 K353	D347-C421 VanDerWaalsContact OD2-CB 3.29Å; D347-C421 WeakPolarHBondContact OD2-CB 3.37Å; D347-C421 PolarHBondContact OD2-N 3.41Å; D347-C421 PolarHBondContact OD2-SG 3.26Å; L349-C421 HydrophobicContact CB-CB 4.27Å; K353-C421 HydrophobicContact CB-CB 4.38Å; K353-C421 HydrophobicContact CD-CB 4.32Å; K353-C421 VanDerWaalsContact CD-SG 3.59Å
422	E	92.4	Very high	89.4	Confident	42 Å²	42	53.7 Å²	53.7	20%	0.196	28%	0.279	C	S	.	.			trans	-77.2	114.9	157.6	-71.1	-175.5	-163.1	0	0	109.3	R332 I333 S364 I420 Y463 R480	R332-E422 HydrophobicContact CB-CB 4.27Å; R332-E422 PolarHBondContact NH1-O 3.21Å; R332-E422 IonicContact NH1-OE2 2.95Å; I333-E422 CarbonylContact O-C 3.57Å; I333-E422 WeakPolarHBondContact O-CA 3.42Å; S364-E422 PolarHBondContact OG-OE2 3.36Å; I420-E422 PolarHBondContact O-N 3.28Å; E422-Y463 PolarHBondContact OE2-OH 3.29Å; E422-R480 IonicContact OE1-CZ 3.96Å; E422-R480 IonicContact OE1-NH1 3.89Å; E422-R480 PolarHBondContact OE1-NH1 2.94Å; E422-R480 IonicContact OE1-NH2 3.79Å; E422-R480 PolarHBondContact OE1-NH2 2.81Å; E422-R480 IonicContact OE2-NH1 2.69Å
423	L	94.9	Very high	90.2	Very high	7 Å²	7	53.3 Å²	53.3	4%	0.037	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	142.6	175.9	-62.5	-178.2	0	0	0	111.3	R332 I333 L349 T352 K353 Y356 L434	R332-L423 CarbonylContact C-O 3.13Å; R332-L423 WeakPolarHBondContact CA-O 3.45Å; R332-L423 WeakPolarHBondContact CB-O 3.37Å; I333-L423 PolarHBondContact N-O 3.32Å; I333-L423 PolarHBondContact O-N 3.39Å; L349-L423 HydrophobicContact CB-CD1 4.07Å; L349-L423 HydrophobicContact CD1-CD1 4.39Å; T352-L423 HydrophobicContact CG2-CD1 4.06Å; K353-L423 HydrophobicContact CB-CD2 3.96Å; K353-L423 HydrophobicContact CG-CD2 3.98Å; Y356-L423 HydrophobicContact CD1-CB 4.23Å; Y356-L423 HydrophobicContact CD1-CD1 4.36Å; Y356-L423 HydrophobicContact CD1-CD2 4.25Å; Y356-L423 HydrophobicContact CE1-CB 4.25Å; Y356-L423 HydrophobicContact CG-CD1 4.3Å; Y356-L423 HydrophobicContact CG-CD2 4.37Å; L423-L434 HydrophobicContact CB-CD1 3.91Å; L423-L434 HydrophobicContact CB-CD2 4.5Å; L423-L434 HydrophobicContact CD1-CD2 3.79Å
424	R	94.6	Very high	91	Very high	93 Å²	93	53.1 Å²	53.1	35%	0.351	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	132.8	-177.5	-177.9	173.7	176.9	116.1	1.9	111.7	S330 R332 D362	S330-R424 PolarHBondContact OG-NH1 2.95Å; R332-R424 HydrophobicContact CG-CB 4.37Å; D362-R424 WeakPolarHBondContact OD2-CD 3.41Å; D362-R424 IonicContact OD2-CZ 3.16Å; D362-R424 VanDerWaalsContact OD2-CZ 3.3Å; D362-R424 IonicContact OD2-NE 3.28Å; D362-R424 PolarHBondContact OD2-NE 3.32Å; D362-R424 IonicContact OD2-NH1 3.51Å; D362-R424 PolarHBondContact OD2-NH1 2.96Å
425	A	95.9	Very high	91.9	Very high	3 Å²	3	48.4 Å²	48.4	3%	0.025	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	106	172.3	0	0	0	0	0	110.2	Y315 I331 I333 A431	Y315-A425 VanDerWaalsContact OH-CB 3.29Å; Y315-A425 WeakPolarHBondContact OH-CB 3.27Å; Y315-A425 PolarHBondContact OH-O 3.21Å; I331-A425 HydrophobicContact CG2-CB 4.49Å; I331-A425 PolarHBondContact O-N 3.32Å; I333-A425 HydrophobicContact CD1-CB 4.31Å; I333-A425 HydrophobicContact CG1-CB 3.82Å; A425-A431 HydrophobicContact CB-CB 3.83Å
426	S	93.7	Very high	92.5	Very high	80 Å²	80	44.6 Å²	44.6	56%	0.559	23%	0.229	S	C	*	.	S	Bend	trans	-75.6	-27.5	177.2	44.3	0	0	0	0	113.2
427	T	95.5	Very high	93	Very high	65 Å²	65	41 Å²	41	40%	0.399	22%	0.215	S	C	.	.	S	Bend	trans	-129	160.2	-175.8	64	0	0	0	0	111.7	Y315 E429 K430 A431	Y315-T427 VanDerWaalsContact CE1-C 3.46Å; Y315-T427 PolarHBondContact OH-O 3.31Å; T427-E429 PolarHBondContact O-N 3.14Å; T427-K430 PolarHBondContact O-N 3.45Å; T427-K430 PolarHBondContact OG1-N 3.22Å; T427-A431 PolarHBondContact O-N 3.35Å
428	A	97	Very high	93.7	Very high	22 Å²	22	39.5 Å²	39.5	18%	0.182	21%	0.207	C	C	.	.	H	α-helix	trans	-59.3	-37	173.5	0	0	0	0	0	112	L106 I311 Y315 A431 A432	L106-A428 HydrophobicContact CD2-CB 4.26Å; I311-A428 HydrophobicContact CG2-CB 4.22Å; Y315-A428 HydrophobicContact CD2-CB 3.79Å; Y315-A428 HydrophobicContact CE2-CB 4.47Å; Y315-A428 HydrophobicContact CG-CB 3.83Å; A428-A431 PolarHBondContact O-N 2.78Å; A428-A432 WeakPolarHBondContact O-CB 3.19Å; A428-A432 PolarHBondContact O-N 2.86Å
429	E	97	Very high	94.6	Very high	59 Å²	59	36.1 Å²	36.1	28%	0.276	18%	0.182	S	C	.	.	H	α-helix	trans	-60.8	-51.7	172.9	-177.4	-169.6	147.8	0	0	112.2	R107 T427 A431 A432 Y433	R107-E429 HydrophobicContact CB-CG 4.3Å; R107-E429 IonicContact CZ-OE1 2.65Å; R107-E429 VanDerWaalsContact CZ-OE1 3.28Å; R107-E429 IonicContact CZ-OE2 3.44Å; R107-E429 IonicContact NE-OE1 2.67Å; R107-E429 PolarHBondContact NE-OE1 3.46Å; R107-E429 VanDerWaalsContact NE-OE1 3.16Å; R107-E429 IonicContact NE-OE2 3.7Å; R107-E429 PolarHBondContact NE-OE2 2.95Å; R107-E429 IonicContact NH2-OE1 2.79Å; R107-E429 PolarHBondContact NH2-OE1 3.3Å; R107-E429 IonicContact NH2-OE2 3.7Å; R107-E429 PolarHBondContact NH2-OE2 3.01Å; T427-E429 PolarHBondContact O-N 3.14Å; E429-A431 PolarHBondContact O-N 2.76Å; E429-A432 CarbonylContact O-C 3.08Å; E429-A432 PolarHBondContact O-N 3.02Å; E429-Y433 PolarHBondContact O-N 3.14Å
430	K	96.6	Very high	95.1	Very high	50 Å²	50	33.1 Å²	33.1	22%	0.217	18%	0.176	C	C	.	.	H	α-helix	trans	-65.4	-26.7	179.6	-162.4	155.8	-174.2	161.5	0	111.3	Y356 E359 T427 L434	Y356-K430 VanDerWaalsContact OH-CE 3.24Å; Y356-K430 WeakPolarHBondContact OH-CE 3.22Å; Y356-K430 WeakPolarHBondContact OH-CG 3.14Å; E359-K430 IonicContact OE2-NZ 2.68Å; E359-K430 PolarHBondContact OE2-NZ 2.8Å; T427-K430 PolarHBondContact O-N 3.45Å; T427-K430 PolarHBondContact OG1-N 3.22Å; K430-L434 WeakPolarHBondContact O-CG 3.21Å; K430-L434 PolarHBondContact O-N 2.69Å
431	A	98	Very high	95.3	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-73.2	-37.1	169.9	0	0	0	0	0	113.4	I311 Y315 I333 A425 T427 A428 E429 L434 L435	I311-A431 HydrophobicContact CG2-CB 3.81Å; Y315-A431 HydrophobicContact CE2-CB 3.74Å; I333-A431 HydrophobicContact CD1-CB 3.92Å; I333-A431 HydrophobicContact CG1-CB 4.24Å; A425-A431 HydrophobicContact CB-CB 3.83Å; T427-A431 PolarHBondContact O-N 3.35Å; A428-A431 PolarHBondContact O-N 2.78Å; E429-A431 PolarHBondContact O-N 2.76Å; A431-L434 PolarHBondContact O-N 2.97Å; A431-L435 PolarHBondContact O-N 2.93Å
432	A	97.6	Very high	95.4	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-74.7	-33.3	176.5	0	0	0	0	0	112.7	F102 L106 A428 E429 L434 L435 D436	F102-A432 HydrophobicContact CB-CB 4.17Å; L106-A432 HydrophobicContact CB-CB 4.44Å; L106-A432 HydrophobicContact CD2-CB 4.23Å; A428-A432 WeakPolarHBondContact O-CB 3.19Å; A428-A432 PolarHBondContact O-N 2.86Å; E429-A432 CarbonylContact O-C 3.08Å; E429-A432 PolarHBondContact O-N 3.02Å; A432-L434 VanDerWaalsContact C-N 3.28Å; A432-L434 PolarHBondContact O-N 3.48Å; A432-L435 CarbonylContact O-C 3.38Å; A432-L435 WeakPolarHBondContact O-CA 3.32Å; A432-L435 VanDerWaalsContact O-CB 3.28Å; A432-L435 WeakPolarHBondContact O-CB 3.5Å; A432-L435 PolarHBondContact O-N 2.73Å; A432-D436 PolarHBondContact O-N 3.45Å
433	Y	96.9	Very high	95	Very high	108 Å²	108	34.7 Å²	34.7	42%	0.424	18%	0.184	S	C	.	.	H	α-helix	trans	-59.5	-39.4	169.6	174	-99.7	0	0	0	111.9	Y356 E429 L435 D436 T437	Y356-Y433 HydrophobicContact CE2-CE1 4.26Å; E429-Y433 PolarHBondContact O-N 3.14Å; Y433-L435 VanDerWaalsContact C-N 3.29Å; Y433-L435 PolarHBondContact O-N 3.21Å; Y433-D436 PolarHBondContact O-N 3.41Å; Y433-T437 WeakPolarHBondContact O-CB 3.38Å; Y433-T437 PolarHBondContact O-N 3.08Å; Y433-T437 PolarHBondContact O-OG1 3.37Å
434	L	97.7	Very high	93.9	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-69.8	-25.1	173.2	-66.8	175	0	0	0	112.5	I333 L349 T352 Y356 L423 K430 A431 A432 A438	I333-L434 HydrophobicContact CB-CB 4.47Å; I333-L434 HydrophobicContact CB-CD1 3.9Å; I333-L434 HydrophobicContact CG1-CD1 3.85Å; I333-L434 HydrophobicContact CG2-CB 4.23Å; L349-L434 HydrophobicContact CD2-CB 4.39Å; L349-L434 HydrophobicContact CD2-CD2 4.18Å; L349-L434 WeakPolarHBondContact CD2-O 3.49Å; T352-L434 HydrophobicContact CG2-CD2 3.8Å; Y356-L434 HydrophobicContact CE2-CD2 4.15Å; L423-L434 HydrophobicContact CB-CD1 3.91Å; L423-L434 HydrophobicContact CB-CD2 4.5Å; L423-L434 HydrophobicContact CD1-CD2 3.79Å; K430-L434 WeakPolarHBondContact O-CG 3.21Å; K430-L434 PolarHBondContact O-N 2.69Å; A431-L434 PolarHBondContact O-N 2.97Å; A432-L434 VanDerWaalsContact C-N 3.28Å; A432-L434 PolarHBondContact O-N 3.48Å; L434-A438 VanDerWaalsContact O-CB 3.23Å; L434-A438 WeakPolarHBondContact O-CB 3.25Å; L434-A438 PolarHBondContact O-N 3.49Å
435	L	97.5	Very high	92.1	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-71.1	-50.2	167.8	179.5	64.3	0	0	0	111.2	F102 I307 P308 I311 A431 A432 Y433 T437 A438 L439 M456 F458	F102-L435 HydrophobicContact CD2-CD2 4.13Å; F102-L435 HydrophobicContact CG-CD2 4.5Å; I307-L435 HydrophobicContact CB-CD2 4.35Å; I307-L435 HydrophobicContact CG2-CD1 4.05Å; I307-L435 HydrophobicContact CG2-CD2 3.87Å; P308-L435 HydrophobicContact CG-CD2 3.96Å; I311-L435 HydrophobicContact CD1-CB 4.46Å; I311-L435 HydrophobicContact CD1-CD2 4.2Å; A431-L435 PolarHBondContact O-N 2.93Å; A432-L435 CarbonylContact O-C 3.38Å; A432-L435 WeakPolarHBondContact O-CA 3.32Å; A432-L435 VanDerWaalsContact O-CB 3.28Å; A432-L435 WeakPolarHBondContact O-CB 3.5Å; A432-L435 PolarHBondContact O-N 2.73Å; Y433-L435 VanDerWaalsContact C-N 3.29Å; Y433-L435 PolarHBondContact O-N 3.21Å; L435-T437 VanDerWaalsContact C-N 3.25Å; L435-T437 PolarHBondContact O-N 3.2Å; L435-A438 PolarHBondContact O-N 2.93Å; L435-A438 VanDerWaalsContact O-N 3.12Å; L435-L439 HydrophobicContact CD1-CD1 4.08Å; L435-L439 HydrophobicContact CD1-CD2 4.49Å; L435-L439 HydrophobicContact CD1-CG 4.06Å; L435-L439 HydrophobicContact CG-CD1 3.9Å; L435-L439 HydrophobicContact CG-CG 4.3Å; L435-L439 WeakPolarHBondContact O-CB 3.23Å; L435-L439 VanDerWaalsContact O-CG 3.27Å; L435-L439 WeakPolarHBondContact O-CG 3.33Å; L435-L439 PolarHBondContact O-N 3.02Å; L435-M456 HydrophobicContact CD1-CE 4.31Å; L435-F458 HydrophobicContact CB-CE2 3.95Å; L435-F458 HydrophobicContact CB-CZ 3.96Å; L435-F458 HydrophobicContact CD1-CD2 3.9Å; L435-F458 HydrophobicContact CD1-CE2 3.82Å; L435-F458 HydrophobicContact CD1-CG 4.38Å; L435-F458 HydrophobicContact CD1-CZ 4.21Å
436	D	96	Very high	89.5	Confident	8 Å²	8	43.6 Å²	43.6	4%	0.043	24%	0.236	C	C	.	.	H	α-helix	trans	-55	-43.1	177.5	-64.6	-30.5	0	0	0	111.3	T101 F102 S103 A432 Y433 L439 S440	T101-D436 PolarHBondContact N-OD1 3.45Å; F102-D436 WeakPolarHBondContact CB-OD1 2.89Å; F102-D436 VanDerWaalsContact CD2-OD1 3.31Å; F102-D436 WeakPolarHBondContact CD2-OD1 3.43Å; F102-D436 VanDerWaalsContact N-CG 3.34Å; F102-D436 PolarHBondContact N-OD1 2.97Å; F102-D436 PolarHBondContact N-OD2 2.66Å; F102-D436 VanDerWaalsContact N-OD2 3.14Å; S103-D436 VanDerWaalsContact CB-OD2 3.26Å; S103-D436 WeakPolarHBondContact CB-OD2 3.33Å; S103-D436 PolarHBondContact N-OD2 3.08Å; S103-D436 PolarHBondContact OG-OD2 2.87Å; A432-D436 PolarHBondContact O-N 3.45Å; Y433-D436 PolarHBondContact O-N 3.41Å; D436-L439 PolarHBondContact O-N 2.67Å; D436-S440 WeakPolarHBondContact O-CB 3.39Å; D436-S440 PolarHBondContact O-N 2.94Å; D436-S440 PolarHBondContact O-OG 2.76Å
437	T	95.1	Very high	86.8	Confident	23 Å²	23	43.9 Å²	43.9	14%	0.141	24%	0.237	C	C	.	.	H	α-helix	trans	-66.5	-45.6	176.2	-52.5	0	0	0	0	111.9	T352 Y433 L435 L439 S440 N441	T352-T437 HydrophobicContact CG2-CG2 4.06Å; T352-T437 WeakPolarHBondContact OG1-CG2 3.37Å; Y433-T437 WeakPolarHBondContact O-CB 3.38Å; Y433-T437 PolarHBondContact O-N 3.08Å; Y433-T437 PolarHBondContact O-OG1 3.37Å; L435-T437 VanDerWaalsContact C-N 3.25Å; L435-T437 PolarHBondContact O-N 3.2Å; T437-L439 VanDerWaalsContact C-N 3.33Å; T437-L439 PolarHBondContact O-N 3.34Å; T437-S440 PolarHBondContact O-N 3.29Å; T437-N441 PolarHBondContact O-N 2.73Å; T437-N441 PolarHBondContact O-ND2 3Å
438	A	95.6	Very high	84.6	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-64.7	-35.6	177.6	0	0	0	0	0	112.8	A335 L348 L349 L434 L435 N441 R442 M456	A335-A438 HydrophobicContact CB-CB 3.59Å; L348-A438 HydrophobicContact CB-CB 3.94Å; L348-A438 HydrophobicContact CD1-CB 4.27Å; L349-A438 HydrophobicContact CD2-CB 4.04Å; L434-A438 VanDerWaalsContact O-CB 3.23Å; L434-A438 WeakPolarHBondContact O-CB 3.25Å; L434-A438 PolarHBondContact O-N 3.49Å; L435-A438 PolarHBondContact O-N 2.93Å; L435-A438 VanDerWaalsContact O-N 3.12Å; A438-N441 PolarHBondContact O-N 2.97Å; A438-R442 PolarHBondContact O-N 3.46Å; A438-R442 VanDerWaalsContact O-N 3.13Å; A438-M456 HydrophobicContact CB-CE 3.99Å
439	L	94.1	Very high	82.4	Confident	11 Å²	11	52.5 Å²	52.5	6%	0.058	28%	0.278	C	S	.	.	H	α-helix	trans	-69.2	-39.6	174.6	-67.7	173.5	0	0	0	111.6	Y100 F102 I295 L435 D436 T437 N441 R442 M456	Y100-L439 HydrophobicContact CD1-CD1 4.39Å; Y100-L439 HydrophobicContact CD2-CB 3.78Å; Y100-L439 HydrophobicContact CD2-CD1 3.77Å; Y100-L439 HydrophobicContact CD2-CG 4.36Å; Y100-L439 HydrophobicContact CE2-CB 4.19Å; Y100-L439 HydrophobicContact CE2-CD1 4.21Å; Y100-L439 HydrophobicContact CG-CD1 3.85Å; F102-L439 HydrophobicContact CD2-CD1 4.27Å; F102-L439 HydrophobicContact CE2-CD1 3.98Å; I295-L439 HydrophobicContact CD1-CD2 3.48Å; I295-L439 VanDerWaalsContact CD1-CD2 3.48Å; I295-L439 HydrophobicContact CG1-CD1 4.3Å; I295-L439 HydrophobicContact CG1-CD2 3.88Å; I295-L439 HydrophobicContact CG2-CD1 3.67Å; I295-L439 HydrophobicContact CG2-CD2 4.49Å; L435-L439 HydrophobicContact CD1-CD1 4.08Å; L435-L439 HydrophobicContact CD1-CD2 4.49Å; L435-L439 HydrophobicContact CD1-CG 4.06Å; L435-L439 HydrophobicContact CG-CD1 3.9Å; L435-L439 HydrophobicContact CG-CG 4.3Å; L435-L439 WeakPolarHBondContact O-CB 3.23Å; L435-L439 VanDerWaalsContact O-CG 3.27Å; L435-L439 WeakPolarHBondContact O-CG 3.33Å; L435-L439 PolarHBondContact O-N 3.02Å; D436-L439 PolarHBondContact O-N 2.67Å; T437-L439 VanDerWaalsContact C-N 3.33Å; T437-L439 PolarHBondContact O-N 3.34Å; L439-N441 PolarHBondContact O-N 3.32Å; L439-R442 PolarHBondContact O-N 3.06Å; L439-M456 HydrophobicContact CD2-CE 4.02Å; L439-M456 HydrophobicContact CD2-SD 4.01Å
440	S	92.5	Very high	80.6	Confident	71 Å²	71	52.3 Å²	52.3	50%	0.497	28%	0.278	S	S	.	.	H	α-helix	trans	-63.9	-27.8	174.9	-61.2	0	0	0	0	113.2	D436 T437	D436-S440 WeakPolarHBondContact O-CB 3.39Å; D436-S440 PolarHBondContact O-N 2.94Å; D436-S440 PolarHBondContact O-OG 2.76Å; T437-S440 PolarHBondContact O-N 3.29Å
441	N	92.5	Very high	79	Confident	59 Å²	59	52.6 Å²	52.6	32%	0.316	29%	0.286	S	S	.	.	H	α-helix	trans	-92.4	-10.9	177.9	-69.3	-23.4	0	0	0	114.1	L348 T437 A438 L439	L348-N441 HydrophobicContact CB-CB 4.48Å; L348-N441 HydrophobicContact CD2-CB 4.14Å; L348-N441 PolarHBondContact O-ND2 3.12Å; T437-N441 PolarHBondContact O-N 2.73Å; T437-N441 PolarHBondContact O-ND2 3Å; A438-N441 PolarHBondContact O-N 2.97Å; L439-N441 PolarHBondContact O-N 3.32Å
442	R	91.7	Very high	77.9	Confident	32 Å²	32	53 Å²	53	12%	0.121	29%	0.291	C	S	.	.	S	Bend	trans	-70.6	148.7	179.9	-172.3	179.2	179.9	179.6	-1.8	111.1	E337 L348 A438 L439 I444 S454 D487	E337-R442 WeakPolarHBondContact OE1-CG 3.35Å; L348-R442 HydrophobicContact CD2-CB 4.43Å; A438-R442 PolarHBondContact O-N 3.46Å; A438-R442 VanDerWaalsContact O-N 3.13Å; L439-R442 PolarHBondContact O-N 3.06Å; R442-I444 PolarHBondContact O-N 3.18Å; R442-S454 PolarHBondContact NE-OG 3.09Å; R442-S454 PolarHBondContact NH2-O 3.41Å; R442-S454 VanDerWaalsContact NH2-O 3.14Å; R442-D487 IonicContact CZ-OD2 2.66Å; R442-D487 IonicContact NH1-OD2 3.62Å; R442-D487 PolarHBondContact NH1-OD2 3.02Å; R442-D487 IonicContact NH2-OD2 3.74Å; R442-D487 PolarHBondContact NH2-OD2 3.03Å
443	T	85.7	Confident	77.3	Confident	37 Å²	37	53.4 Å²	53.4	23%	0.227	29%	0.293	C	S	.	.			trans	-65.9	106.9	179.4	-23.4	0	0	0	0	112.7	E337 T339 R346 H445	E337-T443 WeakPolarHBondContact OE1-CB 3.2Å; E337-T443 PolarHBondContact OE1-N 2.94Å; E337-T443 PolarHBondContact OE1-OG1 3.17Å; E337-T443 PolarHBondContact OE2-N 2.95Å; E337-T443 VanDerWaalsContact OE2-N 3.16Å; E337-T443 PolarHBondContact OE2-OG1 3.09Å; T339-T443 WeakPolarHBondContact CB-OG1 3.49Å; T339-T443 PolarHBondContact OG1-OG1 3.19Å; R346-T443 PolarHBondContact NH2-OG1 3.31Å; T443-H445 WeakPolarHBondContact CG2-NE2 3.48Å; T443-H445 PolarHBondContact O-N 3.17Å; T443-H445 VanDerWaalsContact O-N 3.16Å
444	I	70.6	Confident	76.9	Confident	100 Å²	100	48.5 Å²	48.5	51%	0.513	28%	0.275	S	S	.	.			trans	-81.1	88.4	165.7	-52.9	179.1	0	0	0	108.6	R442 N446	R442-I444 PolarHBondContact O-N 3.18Å; I444-N446 WeakPolarHBondContact CG2-OD1 3.44Å; I444-N446 PolarHBondContact O-N 2.77Å; I444-N446 VanDerWaalsContact O-N 3.1Å
445	H	56.9	Low	76.7	Confident	43 Å²	43	48.6 Å²	48.6	20%	0.199	28%	0.275	C	S	.	.			trans	-76.6	89.7	171.6	-71.5	-83.1	0	0	0	110.1	T339 T443 C447 L450	T339-H445 PolarHBondContact OG1-NE2 3.05Å; T339-H445 VanDerWaalsContact OG1-NE2 3.09Å; T443-H445 WeakPolarHBondContact CG2-NE2 3.48Å; T443-H445 PolarHBondContact O-N 3.17Å; T443-H445 VanDerWaalsContact O-N 3.16Å; H445-C447 PolarHBondContact O-N 3.38Å; H445-C447 VanDerWaalsContact O-N 3.11Å; H445-L450 HydrophobicContact CB-CB 4.41Å
446	N	42.2	Very low	76.6	Confident	148 Å²	148	48.7 Å²	48.7	79%	0.791	28%	0.276	S	S	*	.			trans	-62.4	-11.7	171.1	-85.8	6.1	0	0	0	113.5	I444	I444-N446 WeakPolarHBondContact CG2-OD1 3.44Å; I444-N446 PolarHBondContact O-N 2.77Å; I444-N446 VanDerWaalsContact O-N 3.1Å
447	C	37.3	Very low	76.6	Confident	85 Å²	85	48.6 Å²	48.6	57%	0.574	28%	0.275	S	S	*	.	S	Bend	trans	-85.8	124.2	-179	-55	0	0	0	0	111.2	H445 N449 L450	H445-C447 PolarHBondContact O-N 3.38Å; H445-C447 VanDerWaalsContact O-N 3.11Å; C447-N449 PolarHBondContact O-N 2.9Å; C447-L450 PolarHBondContact O-N 3.38Å
448	N	48.3	Very low	76.7	Confident	121 Å²	121	47.6 Å²	47.6	65%	0.647	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-8.9	-166.9	-116.4	-39.9	0	0	0	116.8	K286	K286-N448 PolarHBondContact NZ-O 3.14Å; K286-N448 PolarHBondContact NZ-OD1 3.27Å
449	N	51.2	Low	76.8	Confident	147 Å²	147	47.6 Å²	47.6	79%	0.786	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.1	-13.4	-174.9	-64.6	-15.7	0	0	0	115	C447	C447-N449 PolarHBondContact O-N 2.9Å
450	L	58	Low	77	Confident	55 Å²	55	47.1 Å²	47.1	29%	0.288	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.2	-15.9	-174.4	-73.5	106.3	0	0	0	115.9	L341 H445 C447 G452 L453	L341-L450 HydrophobicContact CD1-CD2 4.44Å; L341-L450 HydrophobicContact CG-CD2 4.09Å; H445-L450 HydrophobicContact CB-CB 4.41Å; C447-L450 PolarHBondContact O-N 3.38Å; L450-G452 PolarHBondContact O-N 3.33Å; L450-L453 HydrophobicContact CD2-CD1 4.44Å; L450-L453 WeakPolarHBondContact O-CB 3.39Å; L450-L453 PolarHBondContact O-N 3.07Å
451	S	63.3	Low	77.1	Confident	56 Å²	56	44.2 Å²	44.2	39%	0.392	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-59	-21.5	176.6	54.4	0	0	0	0	114.4	L453	S451-L453 PolarHBondContact O-N 3.16Å
452	G	74.8	Confident	77.2	Confident	10 Å²	10	41.6 Å²	41.6	10%	0.103	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-68.5	-6.6	171.8	0	0	0	0	0	116	L450 G489 C490 G491	L450-G452 PolarHBondContact O-N 3.33Å; G452-G489 CarbonylContact O-C 3.49Å; G452-G489 WeakPolarHBondContact O-CA 3.23Å; G452-C490 WeakPolarHBondContact CA-SG 3.35Å; G452-C490 PolarHBondContact O-N 2.86Å; G452-G491 PolarHBondContact O-N 2.91Å
453	L	84.9	Confident	77.3	Confident	7 Å²	7	40.2 Å²	40.2	4%	0.037	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-113.3	7.8	-170.4	-52.2	-179.8	0	0	0	114.3	T339 L341 L450 S451 H455 G491 R492 A578	T339-L453 WeakPolarHBondContact CA-O 3.38Å; L341-L453 HydrophobicContact CD2-CD1 3.59Å; L341-L453 HydrophobicContact CG-CD1 4.23Å; L450-L453 HydrophobicContact CD2-CD1 4.44Å; L450-L453 WeakPolarHBondContact O-CB 3.39Å; L450-L453 PolarHBondContact O-N 3.07Å; S451-L453 PolarHBondContact O-N 3.16Å; L453-H455 PolarHBondContact O-CD2 3.29Å; L453-G491 VanDerWaalsContact CD2-C 3.49Å; L453-R492 HydrophobicContact CD2-CG 3.84Å; L453-A578 HydrophobicContact CD1-CB 4.47Å; L453-A578 HydrophobicContact CD2-CB 4.21Å
454	S	90	Very high	77.4	Confident	5 Å²	5	40.8 Å²	40.8	4%	0.035	23%	0.226	C	C	.	.			trans	-90.5	113	170.8	172.3	0	0	0	0	110.2	E337 R442 G489	E337-S454 WeakPolarHBondContact OE1-CB 3.13Å; E337-S454 PolarHBondContact OE1-OG 2.85Å; R442-S454 PolarHBondContact NE-OG 3.09Å; R442-S454 PolarHBondContact NH2-O 3.41Å; R442-S454 VanDerWaalsContact NH2-O 3.14Å; S454-G489 WeakPolarHBondContact O-CA 3.39Å; S454-G489 PolarHBondContact O-N 3Å; S454-G489 VanDerWaalsContact O-N 3.1Å
455	H	93.2	Very high	77.9	Confident	3 Å²	3	38.2 Å²	38.2	1%	0.014	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	117.4	176	-55	-92.2	0	0	0	109.2	E337 I338 L453 L488 G489 L605	E337-H455 CarbonylContact C-O 3.58Å; E337-H455 WeakPolarHBondContact CA-O 3.34Å; I338-H455 HydrophobicContact CB-CB 4.5Å; I338-H455 PolarHBondContact N-O 2.71Å; I338-H455 PolarHBondContact O-N 3.11Å; L453-H455 PolarHBondContact O-CD2 3.29Å; H455-L488 HydrophobicContact CB-CD2 4.13Å; H455-L488 WeakPolarHBondContact ND1-CD2 3.18Å; H455-G489 PolarHBondContact CE1-O 2.76Å; H455-G489 PolarHBondContact ND1-N 3.09Å; H455-G489 VanDerWaalsContact ND1-N 3.19Å; H455-L605 HydrophobicContact CB-CD1 4Å
456	M	94.7	Very high	78.9	Confident	2 Å²	2	40.2 Å²	40.2	1%	0.01	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	126.5	-176.3	179.6	-176.9	-176.3	0	0	110.9	V336 L348 L435 A438 L439 F458 L486 D487	V336-M456 WeakPolarHBondContact O-CA 3.41Å; L348-M456 HydrophobicContact CD1-CE 4.04Å; L348-M456 HydrophobicContact CD1-CG 4.09Å; L348-M456 HydrophobicContact CD1-SD 4.47Å; L435-M456 HydrophobicContact CD1-CE 4.31Å; A438-M456 HydrophobicContact CB-CE 3.99Å; L439-M456 HydrophobicContact CD2-CE 4.02Å; L439-M456 HydrophobicContact CD2-SD 4.01Å; M456-F458 HydrophobicContact CE-CB 4.37Å; M456-F458 HydrophobicContact CE-CD2 4.23Å; M456-L486 CarbonylContact O-C 3.48Å; M456-L486 WeakPolarHBondContact O-CA 3.33Å; M456-D487 PolarHBondContact N-O 2.86Å; M456-D487 PolarHBondContact O-N 2.89Å
457	L	96.2	Very high	80.3	Confident	6 Å²	6	37 Å²	37	3%	0.031	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	111.8	168	175.1	63.1	0	0	0	109.3	A335 V336 H484 F485 L486 L608 A612	A335-L457 WeakPolarHBondContact CA-O 3.32Å; V336-L457 HydrophobicContact CG2-CB 3.85Å; V336-L457 HydrophobicContact CG2-CD2 4.35Å; V336-L457 HydrophobicContact CG2-CG 4.44Å; V336-L457 PolarHBondContact N-O 3.13Å; V336-L457 PolarHBondContact O-N 2.73Å; L457-H484 HydrophobicContact CD1-CB 3.92Å; L457-F485 WeakPolarHBondContact CA-O 3.32Å; L457-L486 HydrophobicContact CB-CD1 3.79Å; L457-L486 HydrophobicContact CD1-CB 4.32Å; L457-L486 HydrophobicContact CD1-CD1 4.07Å; L457-L486 HydrophobicContact CG-CD1 4.47Å; L457-L608 HydrophobicContact CB-CD1 4.19Å; L457-L608 HydrophobicContact CB-CD2 4.17Å; L457-L608 HydrophobicContact CB-CG 4.39Å; L457-L608 HydrophobicContact CD2-CD1 3.55Å; L457-L608 HydrophobicContact CD2-CG 4.12Å; L457-A612 HydrophobicContact CD1-CB 4.09Å; L457-A612 HydrophobicContact CD2-CB 4.21Å
458	F	97.6	Very high	81.6	Confident	1 Å²	1	36.2 Å²	36.2	0%	0.004	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	127.9	170.3	-172.2	-93	0	0	0	108.3	I307 I311 I333 A335 L435 M456 L460 F485	I307-F458 HydrophobicContact CD1-CB 4.42Å; I307-F458 HydrophobicContact CG2-CD1 3.64Å; I307-F458 HydrophobicContact CG2-CE1 3.77Å; I307-F458 HydrophobicContact CG2-CG 4.34Å; I311-F458 HydrophobicContact CD1-CE1 4.01Å; I311-F458 HydrophobicContact CD1-CZ 4.19Å; I311-F458 HydrophobicContact CG1-CE1 4.48Å; I333-F458 HydrophobicContact CG2-CD2 4.41Å; I333-F458 HydrophobicContact CG2-CE1 4.16Å; I333-F458 HydrophobicContact CG2-CE2 3.6Å; I333-F458 HydrophobicContact CG2-CZ 3.45Å; I333-F458 VanDerWaalsContact CG2-CZ 3.45Å; A335-F458 HydrophobicContact CB-CD2 3.72Å; A335-F458 HydrophobicContact CB-CE2 4.34Å; L435-F458 HydrophobicContact CB-CE2 3.95Å; L435-F458 HydrophobicContact CB-CZ 3.96Å; L435-F458 HydrophobicContact CD1-CD2 3.9Å; L435-F458 HydrophobicContact CD1-CE2 3.82Å; L435-F458 HydrophobicContact CD1-CG 4.38Å; L435-F458 HydrophobicContact CD1-CZ 4.21Å; M456-F458 HydrophobicContact CE-CB 4.37Å; M456-F458 HydrophobicContact CE-CD2 4.23Å; F458-L460 HydrophobicContact CD1-CD1 3.84Å; F458-L460 HydrophobicContact CE1-CD1 3.61Å; F458-F485 HydrophobicContact CB-CB 4.42Å; F458-F485 HydrophobicContact CD1-CD2 4.24Å; F458-F485 PolarHBondContact N-O 3.04Å; F458-F485 PolarHBondContact O-N 2.85Å
459	T	97.4	Very high	82.2	Confident	1 Å²	1	36 Å²	36	1%	0.006	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	131.6	-176	-50.8	0	0	0	0	111.8	S334 H461 K482 F483 H484	S334-T459 PolarHBondContact N-O 3.14Å; S334-T459 PolarHBondContact O-N 3.48Å; T459-H461 VanDerWaalsContact CB-CE1 3.4Å; T459-H461 WeakPolarHBondContact CB-CE1 3.45Å; T459-H461 WeakPolarHBondContact CG2-CE1 3.33Å; T459-K482 HydrophobicContact CG2-CB 4.09Å; T459-F483 WeakPolarHBondContact CA-O 3.37Å; T459-H484 VanDerWaalsContact CG2-ND1 3.34Å; T459-H484 WeakPolarHBondContact CG2-ND1 3.44Å; T459-H484 PolarHBondContact OG1-ND1 3.14Å
460	L	97.6	Very high	82.6	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.005	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	124	167.9	-62.8	68.7	0	0	0	108.2	I311 L314 I333 F458 F483 F485	I311-L460 HydrophobicContact CG1-CD2 4.25Å; L314-L460 HydrophobicContact CD2-CD2 3.66Å; I333-L460 HydrophobicContact CD1-CB 4.39Å; I333-L460 HydrophobicContact CD1-CG 3.79Å; F458-L460 HydrophobicContact CD1-CD1 3.84Å; F458-L460 HydrophobicContact CE1-CD1 3.61Å; L460-F483 HydrophobicContact CB-CB 4.34Å; L460-F483 PolarHBondContact N-O 3.1Å; L460-F483 PolarHBondContact O-N 2.97Å; L460-F485 HydrophobicContact CD1-CD2 3.87Å; L460-F485 HydrophobicContact CD1-CE2 3.61Å
461	H	95.5	Very high	82.3	Confident	10 Å²	10	37.5 Å²	37.5	5%	0.046	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	98.9	175.6	-53.2	-62.8	0	0	0	108.3	I331 R332 S334 T459 Y463 R480	I331-H461 WeakPolarHBondContact CA-O 3.43Å; R332-H461 HydrophobicContact CB-CB 4.42Å; R332-H461 PolarHBondContact N-O 2.92Å; R332-H461 WeakPolarHBondContact O-CB 3.46Å; R332-H461 PolarHBondContact O-CD2 3.44Å; R332-H461 PolarHBondContact O-N 3.38Å; S334-H461 WeakPolarHBondContact CB-NE2 3.2Å; S334-H461 PolarHBondContact OG-NE2 2.94Å; T459-H461 VanDerWaalsContact CB-CE1 3.4Å; T459-H461 WeakPolarHBondContact CB-CE1 3.45Å; T459-H461 WeakPolarHBondContact CG2-CE1 3.33Å; H461-Y463 HydrophobicContact CB-CE2 3.89Å; H461-Y463 WeakPolarHBondContact O-CD2 3.22Å; H461-R480 PolarHBondContact ND1-NH2 3.23Å
462	L	94.9	Very high	82	Confident	3 Å²	3	40.2 Å²	40.2	2%	0.016	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	123.1	174.3	179.6	61.4	0	0	0	109.1	V272 L318 F329 I331 R480 T481	V272-L462 HydrophobicContact CG1-CD2 3.84Å; L318-L462 HydrophobicContact CD1-CD1 3.68Å; L318-L462 HydrophobicContact CD1-CD2 4.49Å; L318-L462 HydrophobicContact CD2-CD1 4.06Å; L318-L462 HydrophobicContact CD2-CD2 3.99Å; F329-L462 HydrophobicContact CB-CD1 4.15Å; F329-L462 HydrophobicContact CD1-CD1 3.93Å; F329-L462 HydrophobicContact CG-CD1 4.4Å; I331-L462 HydrophobicContact CD1-CD1 4.42Å; I331-L462 HydrophobicContact CG1-CD1 3.87Å; L462-R480 CarbonylContact O-C 3.54Å; L462-R480 WeakPolarHBondContact O-CA 3.1Å; L462-T481 PolarHBondContact N-O 3.41Å; L462-T481 PolarHBondContact O-N 3.14Å
463	Y	93.2	Very high	81	Confident	3 Å²	3	46.1 Å²	46.1	1%	0.012	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	120.4	169.6	-61.7	-90.4	0	0	0	108	F329 S330 R332 S364 P365 S366 L369 E422 H461 R480	F329-Y463 WeakPolarHBondContact CA-O 3.26Å; S330-Y463 PolarHBondContact N-O 3.07Å; S330-Y463 PolarHBondContact O-N 2.87Å; R332-Y463 HydrophobicContact CB-CE2 4.13Å; R332-Y463 HydrophobicContact CG-CE2 4.12Å; S364-Y463 PolarHBondContact OG-OH 3.31Å; P365-Y463 HydrophobicContact CB-CD1 3.81Å; P365-Y463 HydrophobicContact CB-CE1 4.02Å; P365-Y463 HydrophobicContact CB-CG 4.09Å; P365-Y463 HydrophobicContact CG-CG 4.39Å; S366-Y463 WeakPolarHBondContact OG-CE1 3.21Å; S366-Y463 PolarHBondContact OG-OH 2.84Å; L369-Y463 HydrophobicContact CD1-CD1 3.69Å; L369-Y463 HydrophobicContact CD1-CE1 4.21Å; E422-Y463 PolarHBondContact OE2-OH 3.29Å; H461-Y463 HydrophobicContact CB-CE2 3.89Å; H461-Y463 WeakPolarHBondContact O-CD2 3.22Å; Y463-R480 HydrophobicContact CD1-CB 3.99Å; Y463-R480 HydrophobicContact CD1-CG 4.07Å; Y463-R480 HydrophobicContact CE1-CB 4.02Å; Y463-R480 HydrophobicContact CE1-CG 3.79Å; Y463-R480 PolarHBondContact OH-NH1 2.96Å; Y463-R480 VanDerWaalsContact OH-NH1 3.16Å
464	Q	88.5	Confident	79.8	Confident	50 Å²	50	52 Å²	52	23%	0.234	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	128.6	178.6	-179.5	175.4	8.2	0	0	109.4	T327 F329 G478 G479	T327-Q464 HydrophobicContact CG2-CG 3.67Å; F329-Q464 HydrophobicContact CD1-CB 4.11Å; F329-Q464 HydrophobicContact CD1-CG 4.07Å; F329-Q464 HydrophobicContact CE1-CB 4.12Å; F329-Q464 HydrophobicContact CE1-CG 3.68Å; Q464-G478 CarbonylContact O-C 3.6Å; Q464-G478 WeakPolarHBondContact O-CA 3.16Å; Q464-G479 PolarHBondContact N-O 3.26Å; Q464-G479 PolarHBondContact O-N 3.06Å
465	C	80.6	Confident	78.6	Confident	46 Å²	46	53.9 Å²	53.9	31%	0.311	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	132.4	173.6	-62.9	0	0	0	0	110	R328 I476	R328-C465 PolarHBondContact N-O 3.27Å; R328-C465 PolarHBondContact O-N 3.37Å; C465-I476 HydrophobicContact CB-CG2 4.23Å
466	K	76.7	Confident	77.3	Confident	85 Å²	85	59.5 Å²	59.5	37%	0.37	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	135.7	179.1	178.9	-169	164	-149.7	0	108.4	E468 I476 S477	K466-E468 HydrophobicContact CD-CG 4.24Å; K466-E468 IonicContact NZ-OE1 3.3Å; K466-E468 PolarHBondContact NZ-OE1 3.11Å; K466-I476 CarbonylContact O-C 2.89Å; K466-I476 WeakPolarHBondContact O-CA 3.31Å; K466-S477 PolarHBondContact N-O 2.89Å; K466-S477 PolarHBondContact O-N 2.79Å
467	L	71.4	Confident	76.2	Confident	80 Å²	80	61.1 Å²	61.1	42%	0.419	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	126.1	166.4	-106.7	65.1	0	0	0	109	M474 I476	L467-M474 HydrophobicContact CD2-CG 4.04Å; L467-M474 HydrophobicContact CD2-SD 3.59Å; L467-M474 VanDerWaalsContact CD2-SD 3.59Å; L467-M474 HydrophobicContact CG-CG 4.14Å; L467-M474 HydrophobicContact CG-SD 4.35Å; L467-I476 HydrophobicContact CD1-CG1 4.11Å
468	E	65.4	Low	75.2	Confident	68 Å²	68	63.3 Å²	63.3	32%	0.318	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	92.4	167.1	-78.6	176.1	-164.6	0	0	107.9	K466 N470 S475 S477	K466-E468 HydrophobicContact CD-CG 4.24Å; K466-E468 IonicContact NZ-OE1 3.3Å; K466-E468 PolarHBondContact NZ-OE1 3.11Å; E468-N470 PolarHBondContact O-N 2.74Å; E468-N470 PolarHBondContact O-ND2 3Å; E468-S475 WeakPolarHBondContact CA-O 3.36Å; E468-S475 PolarHBondContact N-O 2.93Å; E468-S475 PolarHBondContact O-N 3.3Å; E468-S475 PolarHBondContact O-OG 3.17Å; E468-S477 PolarHBondContact OE1-OG 2.84Å
469	N	60.6	Low	74.7	Confident	117 Å²	117	64.6 Å²	64.6	63%	0.626	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.6	75.8	173.8	-67.7	22.4	0	0	0	109.1
470	N	60.1	Low	74.3	Confident	97 Å²	97	68.1 Å²	68.1	52%	0.519	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	140.1	161.3	-65.3	-67.8	0	0	0	107.6	E468 S472 E473 S475	E468-N470 PolarHBondContact O-N 2.74Å; E468-N470 PolarHBondContact O-ND2 3Å; N470-S472 PolarHBondContact O-N 3Å; N470-E473 PolarHBondContact O-N 3.32Å; N470-S475 PolarHBondContact ND2-OG 2.94Å
471	S	52.6	Low	74	Confident	136 Å²	136	68.3 Å²	68.3	95%	0.951	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	20	-158.6	61	0	0	0	0	117.2
472	S	56.1	Low	74	Confident	114 Å²	114	70.1 Å²	70.1	80%	0.797	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-153.5	3.2	171.1	71.8	0	0	0	0	113.7	N470	N470-S472 PolarHBondContact O-N 3Å
473	E	54	Low	74	Confident	133 Å²	133	70 Å²	70	62%	0.621	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-159.1	114.7	-173.6	-131.4	177.3	171	0	0	109.7	N470 S475	N470-E473 PolarHBondContact O-N 3.32Å; E473-S475 VanDerWaalsContact C-N 3.29Å; E473-S475 PolarHBondContact O-N 3.06Å
474	M	59.8	Low	74.2	Confident	131 Å²	131	70 Å²	70	65%	0.645	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.8	75.5	-177.2	-172.5	146.4	57.9	0	0	111.3	L467	L467-M474 HydrophobicContact CD2-CG 4.04Å; L467-M474 HydrophobicContact CD2-SD 3.59Å; L467-M474 VanDerWaalsContact CD2-SD 3.59Å; L467-M474 HydrophobicContact CG-CG 4.14Å; L467-M474 HydrophobicContact CG-SD 4.35Å
475	S	65.5	Low	74.6	Confident	45 Å²	45	67.6 Å²	67.6	32%	0.315	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	128	-177.4	53.5	0	0	0	0	112.7	E468 N470 E473	E468-S475 WeakPolarHBondContact CA-O 3.36Å; E468-S475 PolarHBondContact N-O 2.93Å; E468-S475 PolarHBondContact O-N 3.3Å; E468-S475 PolarHBondContact O-OG 3.17Å; N470-S475 PolarHBondContact ND2-OG 2.94Å; E473-S475 VanDerWaalsContact C-N 3.29Å; E473-S475 PolarHBondContact O-N 3.06Å
476	I	64.2	Low	75.3	Confident	120 Å²	120	65.4 Å²	65.4	62%	0.615	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.6	107.4	170.4	-54.9	179.9	0	0	0	108.4	C465 K466 L467	C465-I476 HydrophobicContact CB-CG2 4.23Å; K466-I476 CarbonylContact O-C 2.89Å; K466-I476 WeakPolarHBondContact O-CA 3.31Å; L467-I476 HydrophobicContact CD1-CG1 4.11Å
477	S	72.7	Confident	76.2	Confident	36 Å²	36	61.4 Å²	61.4	25%	0.252	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	137.6	169.8	75.3	0	0	0	0	109.5	K466 E468	K466-S477 PolarHBondContact N-O 2.89Å; K466-S477 PolarHBondContact O-N 2.79Å; E468-S477 PolarHBondContact OE1-OG 2.84Å
478	G	75.1	Confident	77.1	Confident	52 Å²	52	57.7 Å²	57.7	54%	0.536	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.7	169.5	-174	0	0	0	0	0	115	Q464	Q464-G478 CarbonylContact O-C 3.6Å; Q464-G478 WeakPolarHBondContact O-CA 3.16Å
479	G	86.1	Confident	78.2	Confident	29 Å²	29	54.8 Å²	54.8	30%	0.299	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.5	164.9	-176.8	0	0	0	0	0	113.2	Q464	Q464-G479 PolarHBondContact N-O 3.26Å; Q464-G479 PolarHBondContact O-N 3.06Å
480	R	88.8	Confident	79.2	Confident	75 Å²	75	49.5 Å²	49.5	28%	0.283	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	139.3	168.8	179.9	-178.6	173.4	163.3	-0.9	108.7	S366 E422 H461 L462 Y463	S366-R480 PolarHBondContact OG-NH1 2.87Å; E422-R480 IonicContact OE1-CZ 3.96Å; E422-R480 IonicContact OE1-NH1 3.89Å; E422-R480 PolarHBondContact OE1-NH1 2.94Å; E422-R480 IonicContact OE1-NH2 3.79Å; E422-R480 PolarHBondContact OE1-NH2 2.81Å; E422-R480 IonicContact OE2-NH1 2.69Å; H461-R480 PolarHBondContact ND1-NH2 3.23Å; L462-R480 CarbonylContact O-C 3.54Å; L462-R480 WeakPolarHBondContact O-CA 3.1Å; Y463-R480 HydrophobicContact CD1-CB 3.99Å; Y463-R480 HydrophobicContact CD1-CG 4.07Å; Y463-R480 HydrophobicContact CE1-CB 4.02Å; Y463-R480 HydrophobicContact CE1-CG 3.79Å; Y463-R480 PolarHBondContact OH-NH1 2.96Å; Y463-R480 VanDerWaalsContact OH-NH1 3.16Å
481	T	92.9	Very high	79.9	Confident	4 Å²	4	45 Å²	45	3%	0.025	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	135.8	176	-60.9	0	0	0	0	109.3	V272 G275 K276 D277 L462	V272-T481 HydrophobicContact CB-CG2 4.44Å; V272-T481 HydrophobicContact CG1-CG2 4.2Å; G275-T481 VanDerWaalsContact C-OG1 3.31Å; G275-T481 VanDerWaalsContact CA-OG1 3.31Å; G275-T481 WeakPolarHBondContact CA-OG1 3.42Å; G275-T481 PolarHBondContact O-OG1 3.06Å; K276-T481 VanDerWaalsContact O-CG2 3.22Å; K276-T481 WeakPolarHBondContact O-CG2 3.35Å; D277-T481 WeakPolarHBondContact OD1-CA 3.4Å; L462-T481 PolarHBondContact N-O 3.41Å; L462-T481 PolarHBondContact O-N 3.14Å
482	K	94.2	Very high	80.9	Confident	49 Å²	49	40.9 Å²	40.9	21%	0.213	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	132.8	-179.5	-59.7	-173.4	178.5	174.6	0	111.1	D277 S278 T459 H484 E611	D277-K482 CarbonylContact C-O 3.59Å; D277-K482 VanDerWaalsContact CA-O 3.25Å; D277-K482 WeakPolarHBondContact CA-O 3.45Å; D277-K482 PolarHBondContact OD1-N 3.17Å; S278-K482 PolarHBondContact N-O 2.97Å; T459-K482 HydrophobicContact CG2-CB 4.09Å; K482-H484 WeakPolarHBondContact CB-NE2 3.47Å; K482-H484 WeakPolarHBondContact CD-NE2 3.41Å; K482-E611 IonicContact NZ-OE1 2.86Å; K482-E611 PolarHBondContact NZ-OE1 2.97Å
483	F	96.2	Very high	81.3	Confident	1 Å²	1	39.1 Å²	39.1	0%	0.004	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	100.7	166.8	-167.7	-168.3	0	0	0	108.9	L265 A268 L269 V272 I280 L314 T459 L460 F485	L265-F483 HydrophobicContact CD2-CE1 4.33Å; L265-F483 HydrophobicContact CD2-CZ 3.75Å; A268-F483 HydrophobicContact CB-CE2 3.8Å; A268-F483 HydrophobicContact CB-CZ 3.92Å; L269-F483 HydrophobicContact CD2-CD1 4.34Å; L269-F483 HydrophobicContact CD2-CE1 3.61Å; L269-F483 HydrophobicContact CD2-CZ 4.32Å; L269-F483 HydrophobicContact CG-CE1 4.35Å; V272-F483 HydrophobicContact CG2-CB 3.78Å; V272-F483 HydrophobicContact CG2-CD1 4.2Å; V272-F483 HydrophobicContact CG2-CD2 4.07Å; V272-F483 HydrophobicContact CG2-CG 3.78Å; I280-F483 HydrophobicContact CD1-CE2 3.65Å; I280-F483 HydrophobicContact CD1-CZ 3.81Å; I280-F483 HydrophobicContact CG1-CE2 4.22Å; L314-F483 HydrophobicContact CD2-CD1 4.47Å; T459-F483 WeakPolarHBondContact CA-O 3.37Å; L460-F483 HydrophobicContact CB-CB 4.34Å; L460-F483 PolarHBondContact N-O 3.1Å; L460-F483 PolarHBondContact O-N 2.97Å; F483-F485 AromaticContact CD1-CE2 3.86Å; F483-F485 HydrophobicContact CD1-CE2 3.86Å; F483-F485 AromaticContact CD1-CZ 3.85Å; F483-F485 HydrophobicContact CD1-CZ 3.85Å; F483-F485 HydrophobicContact CD2-CE2 4.36Å; F483-F485 HydrophobicContact CD2-CZ 4.29Å; F483-F485 HydrophobicContact CE1-CE1 4.22Å; F483-F485 AromaticContact CE1-CE2 3.88Å; F483-F485 HydrophobicContact CE1-CE2 3.88Å; F483-F485 AromaticContact CE1-CZ 3.36Å; F483-F485 HydrophobicContact CE1-CZ 3.36Å; F483-F485 HydrophobicContact CE2-CE1 4.03Å; F483-F485 HydrophobicContact CE2-CE2 4.37Å; F483-F485 AromaticContact CE2-CZ 3.86Å; F483-F485 HydrophobicContact CE2-CZ 3.86Å; F483-F485 HydrophobicContact CG-CE2 4.12Å; F483-F485 HydrophobicContact CG-CZ 4.3Å; F483-F485 AromaticContact CZ-CE1 3.77Å; F483-F485 HydrophobicContact CZ-CE1 3.77Å; F483-F485 HydrophobicContact CZ-CE2 4.15Å; F483-F485 AromaticContact CZ-CZ 3.38Å; F483-F485 HydrophobicContact CZ-CZ 3.38Å
484	H	96.3	Very high	81	Confident	1 Å²	1	36.1 Å²	36.1	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	134.6	-177.2	-62.4	-83.4	0	0	0	111.3	S278 C279 I280 L457 T459 K482 E611 A612	S278-H484 PolarHBondContact O-N 2.97Å; C279-H484 CarbonylContact C-O 3.36Å; C279-H484 WeakPolarHBondContact CA-O 3.39Å; C279-H484 HydrophobicContact CB-CB 4.06Å; I280-H484 PolarHBondContact N-O 3.08Å; L457-H484 HydrophobicContact CD1-CB 3.92Å; T459-H484 VanDerWaalsContact CG2-ND1 3.34Å; T459-H484 WeakPolarHBondContact CG2-ND1 3.44Å; T459-H484 PolarHBondContact OG1-ND1 3.14Å; K482-H484 WeakPolarHBondContact CB-NE2 3.47Å; K482-H484 WeakPolarHBondContact CD-NE2 3.41Å; H484-E611 IonicContact CE1-OE1 2.77Å; H484-E611 IonicContact CE1-OE2 2.65Å; H484-E611 PolarHBondContact CE1-OE2 2.96Å; H484-A612 HydrophobicContact CB-CB 4.31Å
485	F	97.5	Very high	79.9	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	117.9	169.8	-65.2	-81	0	0	0	108.7	L265 I280 M294 I306 I307 L457 F458 L460 F483	L265-F485 HydrophobicContact CD2-CE1 4.15Å; L265-F485 HydrophobicContact CD2-CZ 4.36Å; I280-F485 HydrophobicContact CB-CD1 4.19Å; I280-F485 HydrophobicContact CD1-CD1 4.19Å; I280-F485 HydrophobicContact CD1-CE1 3.74Å; I280-F485 WeakPolarHBondContact O-CA 3.49Å; M294-F485 HydrophobicContact CE-CB 3.8Å; M294-F485 HydrophobicContact CE-CD1 4.14Å; M294-F485 HydrophobicContact CE-CG 4.48Å; I306-F485 HydrophobicContact CG2-CD1 3.91Å; I306-F485 HydrophobicContact CG2-CE1 3.6Å; I307-F485 HydrophobicContact CD1-CB 3.85Å; I307-F485 HydrophobicContact CD1-CG 4.39Å; I307-F485 HydrophobicContact CG1-CB 3.7Å; I307-F485 HydrophobicContact CG1-CD1 3.84Å; I307-F485 HydrophobicContact CG1-CD2 4.26Å; I307-F485 HydrophobicContact CG1-CE1 4.47Å; I307-F485 HydrophobicContact CG1-CG 3.7Å; I307-F485 HydrophobicContact CG2-CD2 4.29Å; L457-F485 WeakPolarHBondContact CA-O 3.32Å; F458-F485 HydrophobicContact CB-CB 4.42Å; F458-F485 HydrophobicContact CD1-CD2 4.24Å; F458-F485 PolarHBondContact N-O 3.04Å; F458-F485 PolarHBondContact O-N 2.85Å; L460-F485 HydrophobicContact CD1-CD2 3.87Å; L460-F485 HydrophobicContact CD1-CE2 3.61Å; F483-F485 AromaticContact CD1-CE2 3.86Å; F483-F485 HydrophobicContact CD1-CE2 3.86Å; F483-F485 AromaticContact CD1-CZ 3.85Å; F483-F485 HydrophobicContact CD1-CZ 3.85Å; F483-F485 HydrophobicContact CD2-CE2 4.36Å; F483-F485 HydrophobicContact CD2-CZ 4.29Å; F483-F485 HydrophobicContact CE1-CE1 4.22Å; F483-F485 AromaticContact CE1-CE2 3.88Å; F483-F485 HydrophobicContact CE1-CE2 3.88Å; F483-F485 AromaticContact CE1-CZ 3.36Å; F483-F485 HydrophobicContact CE1-CZ 3.36Å; F483-F485 HydrophobicContact CE2-CE1 4.03Å; F483-F485 HydrophobicContact CE2-CE2 4.37Å; F483-F485 AromaticContact CE2-CZ 3.86Å; F483-F485 HydrophobicContact CE2-CZ 3.86Å; F483-F485 HydrophobicContact CG-CE2 4.12Å; F483-F485 HydrophobicContact CG-CZ 4.3Å; F483-F485 AromaticContact CZ-CE1 3.77Å; F483-F485 HydrophobicContact CZ-CE1 3.77Å; F483-F485 HydrophobicContact CZ-CE2 4.15Å; F483-F485 AromaticContact CZ-CZ 3.38Å; F483-F485 HydrophobicContact CZ-CZ 3.38Å
486	L	95.7	Very high	78.1	Confident	0 Å²	0	43 Å²	43	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	97.3	-171.5	-174	70.7	0	0	0	110.6	I280 L281 T282 M456 L457 L488 L608 L609	I280-L486 PolarHBondContact O-N 3.12Å; L281-L486 WeakPolarHBondContact CA-O 3.32Å; L281-L486 HydrophobicContact CB-CB 3.88Å; L281-L486 HydrophobicContact CB-CD2 4.02Å; L281-L486 HydrophobicContact CB-CG 4.37Å; T282-L486 PolarHBondContact N-O 2.98Å; T282-L486 PolarHBondContact OG1-O 2.94Å; M456-L486 CarbonylContact O-C 3.48Å; M456-L486 WeakPolarHBondContact O-CA 3.33Å; L457-L486 HydrophobicContact CB-CD1 3.79Å; L457-L486 HydrophobicContact CD1-CB 4.32Å; L457-L486 HydrophobicContact CD1-CD1 4.07Å; L457-L486 HydrophobicContact CG-CD1 4.47Å; L486-L488 HydrophobicContact CD1-CD2 4.03Å; L486-L488 HydrophobicContact CD2-CD1 4.41Å; L486-L488 HydrophobicContact CD2-CD2 3.79Å; L486-L488 HydrophobicContact CD2-CG 4.09Å; L486-L488 HydrophobicContact CG-CD2 3.71Å; L486-L488 HydrophobicContact CG-CG 3.99Å; L486-L488 PolarHBondContact O-N 3.34Å; L486-L608 HydrophobicContact CD1-CD2 4.25Å; L486-L609 HydrophobicContact CD2-CD2 3.55Å
487	D	94	Very high	76.4	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.005	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	95.8	171.7	-176.4	42	0	0	0	109.3	T282 T291 M294 R442 M456	T282-D487 WeakPolarHBondContact OG1-CA 3.37Å; T282-D487 PolarHBondContact OG1-OD1 2.96Å; T291-D487 WeakPolarHBondContact CB-OD2 3.45Å; T291-D487 PolarHBondContact N-OD1 3.11Å; T291-D487 PolarHBondContact OG1-OD2 3.21Å; M294-D487 HydrophobicContact CB-CB 4.25Å; M294-D487 HydrophobicContact CG-CB 4.08Å; R442-D487 IonicContact CZ-OD2 2.66Å; R442-D487 IonicContact NH1-OD2 3.62Å; R442-D487 PolarHBondContact NH1-OD2 3.02Å; R442-D487 IonicContact NH2-OD2 3.74Å; R442-D487 PolarHBondContact NH2-OD2 3.03Å; M456-D487 PolarHBondContact N-O 2.86Å; M456-D487 PolarHBondContact O-N 2.89Å
488	L	91.9	Very high	74.3	Confident	2 Å²	2	46 Å²	46	1%	0.01	26%	0.264	C	S	.	.			trans	-78.7	127.7	177.8	-64.6	-179.1	0	0	0	110.3	T282 I283 K290 H455 L486 I584 L605 L609	T282-L488 WeakPolarHBondContact O-CB 3.23Å; T282-L488 WeakPolarHBondContact O-CD1 3.4Å; T282-L488 PolarHBondContact OG1-N 3.17Å; T282-L488 VanDerWaalsContact OG1-N 3.12Å; I283-L488 HydrophobicContact CG2-CD1 4.21Å; K290-L488 WeakPolarHBondContact CD-O 3.35Å; K290-L488 WeakPolarHBondContact CE-O 3.26Å; H455-L488 HydrophobicContact CB-CD2 4.13Å; H455-L488 WeakPolarHBondContact ND1-CD2 3.18Å; L486-L488 HydrophobicContact CD1-CD2 4.03Å; L486-L488 HydrophobicContact CD2-CD1 4.41Å; L486-L488 HydrophobicContact CD2-CD2 3.79Å; L486-L488 HydrophobicContact CD2-CG 4.09Å; L486-L488 HydrophobicContact CG-CD2 3.71Å; L486-L488 HydrophobicContact CG-CG 3.99Å; L486-L488 PolarHBondContact O-N 3.34Å; L488-I584 HydrophobicContact CD1-CG2 3.98Å; L488-L605 HydrophobicContact CD2-CD1 3.99Å; L488-L609 HydrophobicContact CD1-CD2 4.28Å; L488-L609 HydrophobicContact CD2-CD2 4.46Å
489	G	88.1	Confident	71.8	Confident	8 Å²	8	51.6 Å²	51.6	8%	0.082	28%	0.276	C	S	.	.			trans	-50.2	152.3	154.5	0	0	0	0	0	110.9	G452 S454 H455 G491	G452-G489 CarbonylContact O-C 3.49Å; G452-G489 WeakPolarHBondContact O-CA 3.23Å; S454-G489 WeakPolarHBondContact O-CA 3.39Å; S454-G489 PolarHBondContact O-N 3Å; S454-G489 VanDerWaalsContact O-N 3.1Å; H455-G489 PolarHBondContact CE1-O 2.76Å; H455-G489 PolarHBondContact ND1-N 3.09Å; H455-G489 VanDerWaalsContact ND1-N 3.19Å; G489-G491 PolarHBondContact O-N 2.9Å; G489-G491 VanDerWaalsContact O-N 3.09Å
490	C	81.9	Confident	69.2	Low	5 Å²	5	54.6 Å²	54.6	3%	0.034	29%	0.288	C	S	.	.			trans	-67.7	-6	-179.1	57.3	0	0	0	0	114.5	G284 G452 Y493	G284-C490 VanDerWaalsContact O-CB 3.25Å; G284-C490 WeakPolarHBondContact O-CB 3.16Å; G452-C490 WeakPolarHBondContact CA-SG 3.35Å; G452-C490 PolarHBondContact O-N 2.86Å; C490-Y493 HydrophobicContact CB-CE2 4.4Å; C490-Y493 WeakPolarHBondContact CB-OH 3.43Å
491	G	74.4	Confident	66.1	Low	3 Å²	3	57.7 Å²	57.7	3%	0.031	31%	0.31	C	S	.	.			trans	71.9	-171.4	-174.5	0	0	0	0	0	111.7	G452 L453 G489 L579	G452-G491 PolarHBondContact O-N 2.91Å; L453-G491 VanDerWaalsContact CD2-C 3.49Å; G489-G491 PolarHBondContact O-N 2.9Å; G489-G491 VanDerWaalsContact O-N 3.09Å; G491-L579 CarbonylContact C-O 3.23Å; G491-L579 WeakPolarHBondContact CA-O 3.44Å
492	R	73.4	Confident	62.9	Low	50 Å²	50	64.7 Å²	64.7	19%	0.189	35%	0.347	C	S	.	.	B	Isolated β-bridge	trans	-76.1	135.3	174.9	-65.9	-168.5	-173.9	121	-2.5	112.2	L341 L453 S576 A578 L579 S580	L341-R492 VanDerWaalsContact CD2-NE 3.31Å; L341-R492 VanDerWaalsContact CD2-NH2 3.3Å; L341-R492 PolarHBondContact O-NH2 3.16Å; L453-R492 HydrophobicContact CD2-CG 3.84Å; R492-S576 PolarHBondContact NH1-O 2.78Å; R492-S576 PolarHBondContact NH1-OG 2.89Å; R492-S576 VanDerWaalsContact NH1-OG 3.11Å; R492-S576 VanDerWaalsContact NH2-C 3.33Å; R492-A578 VanDerWaalsContact CZ-O 3.23Å; R492-A578 PolarHBondContact NH1-O 2.71Å; R492-L579 PolarHBondContact N-O 3Å; R492-S580 VanDerWaalsContact O-CA 3.26Å; R492-S580 WeakPolarHBondContact O-CA 3.47Å; R492-S580 VanDerWaalsContact O-CB 3.25Å; R492-S580 WeakPolarHBondContact O-CB 3.2Å
493	Y	64.7	Low	59.7	Low	77 Å²	77	71.5 Å²	71.5	30%	0.302	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-74.5	132.7	154.4	-65.7	-74.5	0	0	0	108.6	H285 K286 C490 Q495 E635	H285-Y493 WeakPolarHBondContact CA-OH 3.39Å; H285-Y493 HydrophobicContact CB-CE1 4.39Å; H285-Y493 WeakPolarHBondContact CB-OH 3.4Å; K286-Y493 HydrophobicContact CB-CE2 4.1Å; K286-Y493 PolarHBondContact N-OH 2.78Å; C490-Y493 HydrophobicContact CB-CE2 4.4Å; C490-Y493 WeakPolarHBondContact CB-OH 3.43Å; Y493-Q495 PolarHBondContact O-N 3.39Å; Y493-E635 HydrophobicContact CD1-CG 4.09Å; Y493-E635 HydrophobicContact CE1-CG 3.59Å
494	G	46.8	Very low	56.2	Low	70 Å²	70	77.1 Å²	77.1	72%	0.722	42%	0.415	S	S	*	.	P	Polyproline II helix	trans	-64.3	120.2	158.4	0	0	0	0	0	106.8	H496	G494-H496 PolarHBondContact O-N 3.36Å
495	Q	37.8	Very low	53	Low	143 Å²	143	83.2 Å²	83.2	67%	0.668	45%	0.452	S	S	*	.			trans	-63.7	104.2	173.7	-74.8	177.2	-35.2	0	0	108.4	Y493 S497	Y493-Q495 PolarHBondContact O-N 3.39Å; Q495-S497 PolarHBondContact O-N 2.95Å
496	H	28.2	Very low	49.4	Very low	178 Å²	178	92.8 Å²	92.8	82%	0.824	50%	0.497	S	S	*	.			trans	-60.7	112.2	140.7	-102.2	-70.8	0	0	0	105.7	G494 I498	G494-H496 PolarHBondContact O-N 3.36Å; H496-I498 VanDerWaalsContact C-N 3.32Å; H496-I498 PolarHBondContact O-N 2.89Å
497	S	26.7	Very low	46.3	Very low	100 Å²	100	98.6 Å²	98.6	70%	0.699	53%	0.532	S	S	*	.			trans	-17.4	78.5	-178.1	-45.8	0	0	0	0	115.4	Q495 H499	Q495-S497 PolarHBondContact O-N 2.95Å; S497-H499 PolarHBondContact O-N 3.25Å; S497-H499 VanDerWaalsContact O-N 3.08Å
498	I	29.2	Very low	42.9	Very low	118 Å²	118	106.1 Å²	106.1	61%	0.605	57%	0.567	S	S	*	*			trans	-67.4	111.5	161.9	-64.6	179.2	0	0	0	104	H496 V500	H496-I498 VanDerWaalsContact C-N 3.32Å; H496-I498 PolarHBondContact O-N 2.89Å; I498-V500 VanDerWaalsContact C-N 3.25Å; I498-V500 PolarHBondContact O-N 3.26Å
499	H	23.8	Very low	39.8	Very low	170 Å²	170	111.9 Å²	111.9	79%	0.787	60%	0.598	S	S	*	*			trans	-62.6	94.4	172.2	-135.5	-65.3	0	0	0	106.9	S497 N501	S497-H499 PolarHBondContact O-N 3.25Å; S497-H499 VanDerWaalsContact O-N 3.08Å; H499-N501 PolarHBondContact O-N 3.14Å; H499-N501 VanDerWaalsContact O-N 3.14Å
500	V	30.3	Very low	36.8	Very low	92 Å²	92	118 Å²	118	56%	0.558	63%	0.629	S	S	*	*			trans	-61.2	119.1	166.5	178.2	0	0	0	0	104.9	I498 N502	I498-V500 VanDerWaalsContact C-N 3.25Å; I498-V500 PolarHBondContact O-N 3.26Å; V500-N502 PolarHBondContact O-N 3.12Å
501	N	23.8	Very low	34.3	Very low	139 Å²	139	121.5 Å²	121.5	74%	0.743	65%	0.653	S	S	*	*			trans	-68	90.6	171.7	-84.7	-15.8	0	0	0	107.6	H499 K503	H499-N501 PolarHBondContact O-N 3.14Å; H499-N501 VanDerWaalsContact O-N 3.14Å; N501-K503 PolarHBondContact O-N 2.84Å
502	N	25.8	Very low	32	Very low	152 Å²	152	128.6 Å²	128.6	81%	0.813	69%	0.691	S	S	*	*			trans	-68.2	70.7	164.7	-77.3	6.9	0	0	0	108.7	V500	V500-N502 PolarHBondContact O-N 3.12Å
503	K	26.1	Very low	29.9	Very low	192 Å²	192	131.2 Å²	131.2	84%	0.835	72%	0.717	S	S	*	*			trans	-148.7	50.3	172.3	-150	174.7	-172.6	-178.9	0	111.6	N501	N501-K503 PolarHBondContact O-N 2.84Å
504	C	23.3	Very low	28.2	Very low	119 Å²	119	132.1 Å²	132.1	80%	0.804	74%	0.74	S	S	*	*	S	Bend	trans	-159.4	153.9	155.4	-93.6	0	0	0	0	107.6
505	V	28.6	Very low	27.2	Very low	128 Å²	128	136 Å²	136	78%	0.776	74%	0.744	S	S	*	*			trans	73	59.7	-172.7	-161.1	0	0	0	0	113.8	V507	V505-V507 HydrophobicContact CG1-CG2 3.57Å
506	E	23.3	Very low	26.5	Very low	202 Å²	202	134.5 Å²	134.5	94%	0.944	75%	0.748	S	S	*	*				-80.7	132.9	123.9	-72.7	-179.5	142.4	0	0	106.4
507	V	30.5	Very low	26.4	Very low	122 Å²	122	130.1 Å²	130.1	74%	0.739	74%	0.738	S	S	*	*			trans	-102.1	114.8	173.8	178.2	0	0	0	0	107	V505	V505-V507 HydrophobicContact CG1-CG2 3.57Å
508	E	22.7	Very low	26.6	Very low	159 Å²	159	133.6 Å²	133.6	74%	0.743	74%	0.74	S	S	*	*			trans	-71.1	158.4	165.8	-69.8	-168.9	137.9	0	0	111.2
509	N	26.6	Very low	26.4	Very low	122 Å²	122	136.2 Å²	136.2	65%	0.652	75%	0.747	S	S	*	*			trans	77.9	140.3	165.6	-47.6	-72.9	0	0	0	115.7
510	N	25.5	Very low	26.4	Very low	137 Å²	137	134.3 Å²	134.3	73%	0.733	74%	0.743	S	S	*	*			cis	-176.7	163.6	-19.5	-106.1	-22	0	0	0	105.4
511	S	27.8	Very low	26.5	Very low	79 Å²	79	138.2 Å²	138.2	55%	0.552	75%	0.752	S	S	*	*			cis	-171.8	171.3	-0.6	41.6	0	0	0	0	108.3
512	N	27.8	Very low	26.4	Very low	152 Å²	152	137.6 Å²	137.6	81%	0.813	75%	0.749	S	S	*	*			trans	77	141.5	162.9	-53.9	-27.2	0	0	0	116.7
513	S	27.5	Very low	26.4	Very low	105 Å²	105	137.8 Å²	137.8	73%	0.734	75%	0.745	S	S	*	*			cis	-160.8	154.4	-3.1	47.1	0	0	0	0	113.1
514	A	29.5	Very low	26.4	Very low	95 Å²	95	133.9 Å²	133.9	79%	0.785	74%	0.737	S	S	*	*			trans	68.2	149.9	164.2	0	0	0	0	0	117.1
515	D	25.5	Very low	26.6	Very low	151 Å²	151	134.8 Å²	134.8	81%	0.807	73%	0.734	S	S	*	*			cis	-140.6	171.6	3.1	-150.7	-15.8	0	0	0	112.4
516	C	24.3	Very low	26.4	Very low	113 Å²	113	132.6 Å²	132.6	76%	0.764	72%	0.724	S	S	*	*			trans	-83	170.6	-177.5	-54.8	0	0	0	0	111.7
517	S	26.3	Very low	26.6	Very low	86 Å²	86	129.8 Å²	129.8	60%	0.601	72%	0.716	S	S	*	*			cis	178.6	165.7	39.5	59.4	0	0	0	0	112.4
518	K	29.4	Very low	26.4	Very low	172 Å²	172	129.6 Å²	129.6	75%	0.748	72%	0.715	S	S	*	*			trans	63.2	157.6	152.3	-68.3	158.9	-175.1	168.6	0	117.9
519	F	26.2	Very low	26.6	Very low	174 Å²	174	127.4 Å²	127.4	76%	0.763	71%	0.713	S	S	*	*			cis	-146.2	130.8	-18.2	-97.7	-59.3	0	0	0	104.2
520	N	24.1	Very low	26.5	Very low	129 Å²	129	129 Å²	129	69%	0.69	72%	0.721	S	S	*	*				69	146.7	79.5	-157.8	12.7	0	0	0	116.5
521	K	30.9	Very low	26.5	Very low	175 Å²	175	126.9 Å²	126.9	76%	0.761	72%	0.717	S	S	*	*			trans	84	121.6	-178.7	-58.2	-176.5	-179.5	-174.2	0	114.5
522	N	23.7	Very low	26.4	Very low	126 Å²	126	131 Å²	131	67%	0.674	73%	0.732	S	S	*	*				73.7	138.8	64.2	-61.6	30.6	0	0	0	110.6
523	E	25.8	Very low	26.5	Very low	155 Å²	155	128.6 Å²	128.6	72%	0.724	73%	0.728	S	S	*	*			cis	-161.4	-174.3	14	-128.8	151.2	-127.5	0	0	111.6
524	T	25.5	Very low	26.7	Very low	110 Å²	110	127.7 Å²	127.7	68%	0.675	72%	0.719	S	S	*	*			trans	-13.2	160.8	159.3	58.5	0	0	0	0	120.6
525	N	26.8	Very low	26.6	Very low	138 Å²	138	129.2 Å²	129.2	74%	0.738	72%	0.719	S	S	*	*			cis	-166.7	155.2	21.3	-134.4	-6.6	0	0	0	115.8
526	S	25.6	Very low	26.6	Very low	82 Å²	82	126.5 Å²	126.5	57%	0.573	71%	0.712	S	S	*	*			trans	41.7	129.6	138.5	71.1	0	0	0	0	126
527	N	26.1	Very low	26.7	Very low	143 Å²	143	125.6 Å²	125.6	77%	0.765	71%	0.707	S	S	*	*				102.5	139.5	129.1	-68.9	-2.6	0	0	0	124.8
528	T	28	Very low	26.6	Very low	118 Å²	118	128.2 Å²	128.2	72%	0.724	71%	0.714	S	S	*	*			trans	55	105.7	149.4	49.2	0	0	0	0	119.7
529	T	25.3	Very low	26.4	Very low	114 Å²	114	126.3 Å²	126.3	70%	0.699	71%	0.711	S	S	*	*				85.5	122.1	66.5	57.1	0	0	0	0	115.8
530	D	25.1	Very low	26.4	Very low	154 Å²	154	123.9 Å²	123.9	82%	0.824	71%	0.706	S	S	*	*			trans	67.1	147.6	155.2	-56.9	-24.4	0	0	0	120.2
531	S	25	Very low	26.6	Very low	93 Å²	93	123.9 Å²	123.9	65%	0.65	71%	0.705	S	S	*	*			cis	-166.7	169.2	-21.8	60.1	0	0	0	0	112.6
532	L	25.6	Very low	26.3	Very low	166 Å²	166	121 Å²	121	87%	0.869	70%	0.698	S	S	*	*			trans	77.9	166	155.5	-71.4	163.1	0	0	0	121.9
533	S	30	Very low	26.7	Very low	102 Å²	102	124.6 Å²	124.6	71%	0.713	70%	0.702	S	S	*	*			trans	-124.8	-153.4	-160.4	57.7	0	0	0	0	110.4
534	P	32.4	Very low	26.8	Very low	85 Å²	85	123.4 Å²	123.4	55%	0.552	70%	0.7	S	S	*	*			cis	-147.5	-173.2	10.1	39.9	-14.7	0	0	0	118.4
535	T	26.4	Very low	27	Very low	128 Å²	128	124.2 Å²	124.2	79%	0.785	70%	0.701	S	S	*	*			trans	38.6	156.3	142.5	49.9	0	0	0	0	123.9
536	S	26.8	Very low	27.1	Very low	94 Å²	94	123.6 Å²	123.6	66%	0.657	70%	0.702	S	S	*	*			cis	-172.3	175.3	-7.5	49.3	0	0	0	0	111.3
537	S	25.6	Very low	27.1	Very low	94 Å²	94	125.8 Å²	125.8	66%	0.657	71%	0.706	S	S	*	*			trans	62.9	148.1	149.6	45.7	0	0	0	0	119.8
538	D	24.7	Very low	27.1	Very low	140 Å²	140	127.8 Å²	127.8	75%	0.749	71%	0.708	S	S	*	*			cis	-162.9	161.7	-7.7	-115.4	-32.1	0	0	0	114.2
539	L	25.6	Very low	27.3	Very low	133 Å²	133	126.8 Å²	126.8	70%	0.696	71%	0.706	S	S	*	*			trans	57.9	123.4	147.2	-63.9	171.1	0	0	0	124.9
540	N	25.6	Very low	28	Very low	123 Å²	123	124.9 Å²	124.9	66%	0.658	70%	0.696	S	S	*	*				97.8	109.6	122.3	-77	-10.8	0	0	0	126.1
541	I	28.2	Very low	28.2	Very low	128 Å²	128	120.9 Å²	120.9	66%	0.656	68%	0.677	S	S	*	*				93.8	131.5	115.2	-72.4	172.7	0	0	0	122.7
542	N	25.4	Very low	28.4	Very low	116 Å²	116	118.5 Å²	118.5	62%	0.62	66%	0.66	S	S	*	*			trans	74.1	146.7	159.3	-78.5	-28.7	0	0	0	119.3
543	R	31.4	Very low	28.5	Very low	201 Å²	201	118.5 Å²	118.5	76%	0.758	66%	0.656	S	S	*	*			cis	-154.8	146.1	8.7	-116.8	148.4	-159.4	164.1	1.3	111.9
544	N	28.1	Very low	28.3	Very low	129 Å²	129	119.8 Å²	119.8	69%	0.69	66%	0.655	S	S	*	*			trans	40.1	143	138.1	-56.1	10.4	0	0	0	120.8
545	N	28.8	Very low	28	Very low	128 Å²	128	120.4 Å²	120.4	68%	0.684	66%	0.661	S	S	*	*			cis	-159.3	166.5	0.5	-98.4	-14.1	0	0	0	106.5
546	V	30.3	Very low	28.1	Very low	125 Å²	125	119.9 Å²	119.9	76%	0.758	66%	0.658	S	S	*	*			cis	-146.2	134.3	42.5	169.6	0	0	0	0	111.3
547	L	25.9	Very low	28	Very low	127 Å²	127	120.3 Å²	120.3	67%	0.665	66%	0.661	S	S	*	*			trans	12.2	141.1	151.3	-71.6	61.9	0	0	0	119.6
548	K	25.2	Very low	28.2	Very low	186 Å²	186	123.1 Å²	123.1	81%	0.809	67%	0.669	S	S	*	*			cis	-158.2	118.3	13.6	-133	171.6	-176.3	-172.4	0	113.4
549	S	33	Very low	28.1	Very low	96 Å²	96	121.3 Å²	121.3	67%	0.671	67%	0.665	S	S	*	*			trans	-112.7	-163.1	145.3	70.2	0	0	0	0	106.9
550	P	40	Very low	28.1	Very low	75 Å²	75	121 Å²	121	49%	0.487	67%	0.67	S	S	.	*			cis	-130.2	-147.5	28.4	40.1	-18	0	0	0	114.5	N798	P550-N798 CarbonylContact C-O 3.38Å
551	T	28.4	Very low	28.1	Very low	70 Å²	70	120.7 Å²	120.7	43%	0.429	67%	0.672	S	S	.	*				-171.3	-178.1	-121.4	43.6	0	0	0	0	111.6	N797 N798	T551-N797 CarbonylContact C-O 3.45Å; T551-N798 PolarHBondContact N-O 2.8Å
552	S	29.1	Very low	28.1	Very low	43 Å²	43	121.6 Å²	121.6	30%	0.301	68%	0.684	S	S	.	*			trans	72.2	161	132.6	61.5	0	0	0	0	120.2	N797	S552-N797 WeakPolarHBondContact O-CB 3.22Å
553	E	27.2	Very low	28.2	Very low	165 Å²	165	124.3 Å²	124.3	77%	0.771	70%	0.697	S	S	*	*			cis	-179.4	178.5	-29.4	-99.2	132.6	-122	0	0	104.8
554	D	26.7	Very low	27.9	Very low	129 Å²	129	120.3 Å²	120.3	69%	0.69	70%	0.7	S	S	*	*			cis	-155.6	172.5	-27	167.2	54.8	0	0	0	104.8	T556	D554-T556 PolarHBondContact OD2-N 2.71Å
555	S	26.1	Very low	28	Very low	98 Å²	98	122.9 Å²	122.9	69%	0.685	71%	0.708	S	S	*	*			trans	-161.3	115.9	141.6	-82.3	0	0	0	0	113.7
556	T	27.4	Very low	28	Very low	118 Å²	118	124.2 Å²	124.2	72%	0.724	71%	0.71	S	S	*	*			trans	42.5	135.7	133.4	67.1	0	0	0	0	119.4	D554	D554-T556 PolarHBondContact OD2-N 2.71Å
557	S	25.7	Very low	28	Very low	103 Å²	103	123.3 Å²	123.3	72%	0.72	71%	0.709	S	S	*	*			cis	-172.1	-170.4	-3.9	57.6	0	0	0	0	106.3
558	N	29.8	Very low	28.1	Very low	153 Å²	153	127.5 Å²	127.5	82%	0.818	72%	0.716	S	S	*	*			cis	-153.7	-174.5	5.8	-149	-37.2	0	0	0	109.3
559	C	23	Very low	28.3	Very low	101 Å²	101	124.6 Å²	124.6	68%	0.682	71%	0.71	S	S	*	*			trans	-147.5	149.3	-170.7	-174.4	0	0	0	0	114.1
560	T	24.2	Very low	28.5	Very low	128 Å²	128	124.8 Å²	124.8	79%	0.785	70%	0.702	S	S	*	*			trans	-171.1	121.2	134.1	13.3	0	0	0	0	114.7
561	T	25.2	Very low	28.1	Very low	116 Å²	116	127.1 Å²	127.1	71%	0.712	71%	0.707	S	S	*	*			trans	41.8	117.1	142.5	56.9	0	0	0	0	122.4
562	T	29.1	Very low	28.5	Very low	146 Å²	146	131.3 Å²	131.3	90%	0.896	72%	0.721	S	S	*	*				-160.7	101.5	114.5	6.7	0	0	0	0	111.6
563	L	26.8	Very low	29	Very low	173 Å²	173	136.8 Å²	136.8	91%	0.906	74%	0.735	S	S	*	*			trans	-96.2	111.9	174.5	-82	161.2	0	0	0	109.9
564	S	26	Very low	29.7	Very low	118 Å²	118	134.1 Å²	134.1	83%	0.825	73%	0.73	S	S	*	*	S	Bend	trans	178	27.1	158.1	39.5	0	0	0	0	117.4
565	Q	29.4	Very low	30.9	Very low	182 Å²	182	134.3 Å²	134.3	85%	0.85	73%	0.73	S	S	*	*	S	Bend	trans	-146	-16.9	174.7	-117.4	169.1	30.3	0	0	119.4	S567	Q565-S567 PolarHBondContact O-N 2.94Å
566	E	29.5	Very low	32.6	Very low	157 Å²	157	131.8 Å²	131.8	73%	0.734	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-72.8	-28.2	-171.5	-68.5	-172	102.3	0	0	115.5	R568 N569	E566-R568 PolarHBondContact O-N 3.27Å; E566-N569 PolarHBondContact O-N 3.46Å; E566-N569 VanDerWaalsContact O-N 3.14Å
567	S	30.4	Very low	35	Very low	105 Å²	105	131 Å²	131	73%	0.734	70%	0.699	S	S	*	*	G	3₁₀ helix	trans	-62.4	-21.2	-166.3	-49.7	0	0	0	0	115.6	Q565	Q565-S567 PolarHBondContact O-N 2.94Å
568	R	28.5	Very low	37.8	Very low	216 Å²	216	126.2 Å²	126.2	82%	0.815	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-88.4	-16.1	-179.8	-66.2	-177.8	-177	153.6	1.5	114.4	E566	E566-R568 PolarHBondContact O-N 3.27Å
569	N	29.7	Very low	40.7	Very low	124 Å²	124	119.3 Å²	119.3	66%	0.663	63%	0.629	S	S	*	*	H	α-helix	trans	-92.4	-12.8	-175.8	-75.9	-23.3	0	0	0	114	E566	E566-N569 PolarHBondContact O-N 3.46Å; E566-N569 VanDerWaalsContact O-N 3.14Å
570	I	36.6	Very low	43.8	Very low	100 Å²	100	116.6 Å²	116.6	51%	0.513	61%	0.611	S	S	.	*	H	α-helix	trans	-81.9	-35.7	-176.2	-62.9	176.5	0	0	0	111.7	R573 T574	I570-R573 PolarHBondContact O-N 3.4Å; I570-T574 PolarHBondContact O-OG1 3.31Å; I570-T574 VanDerWaalsContact O-OG1 3.07Å
571	E	31	Very low	46.8	Very low	125 Å²	125	110.9 Å²	110.9	58%	0.584	58%	0.576	S	S	*	*	H	α-helix	trans	-68	-43.3	-179.1	-59.3	-172.7	138	0	0	111.9	R573 T574 L575	E571-R573 VanDerWaalsContact C-N 3.27Å; E571-R573 PolarHBondContact O-N 3.34Å; E571-T574 PolarHBondContact O-N 3.06Å; E571-T574 PolarHBondContact O-OG1 3.32Å; E571-T574 VanDerWaalsContact O-OG1 3.13Å; E571-L575 HydrophobicContact CB-CD1 4.3Å; E571-L575 PolarHBondContact O-N 2.63Å
572	H	36.5	Very low	49.9	Very low	157 Å²	157	109 Å²	109	73%	0.727	57%	0.567	S	S	*	*	H	α-helix	trans	-64.4	-26.8	179.3	-97.4	-80	0	0	0	114	T574	H572-T574 VanDerWaalsContact C-N 3.34Å
573	R	39.2	Very low	52.8	Low	159 Å²	159	102 Å²	102	60%	0.6	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-12.3	174	-85.1	-169.5	173.6	173.6	3.4	114	I570 E571 E725	I570-R573 PolarHBondContact O-N 3.4Å; E571-R573 VanDerWaalsContact C-N 3.27Å; E571-R573 PolarHBondContact O-N 3.34Å; R573-E725 IonicContact CZ-OE1 2.98Å; R573-E725 IonicContact NH1-OE1 2.73Å; R573-E725 IonicContact NH2-OE1 2.97Å; R573-E725 PolarHBondContact NH2-OE1 2.74Å
574	T	43.5	Very low	55.9	Low	109 Å²	109	94 Å²	94	67%	0.669	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.9	-26.9	-171.7	51.3	0	0	0	0	114.9	I570 E571 H572 S576	I570-T574 PolarHBondContact O-OG1 3.31Å; I570-T574 VanDerWaalsContact O-OG1 3.07Å; E571-T574 PolarHBondContact O-N 3.06Å; E571-T574 PolarHBondContact O-OG1 3.32Å; E571-T574 VanDerWaalsContact O-OG1 3.13Å; H572-T574 VanDerWaalsContact C-N 3.34Å; T574-S576 PolarHBondContact O-N 3.11Å
575	L	51.6	Low	59	Low	132 Å²	132	88.4 Å²	88.4	69%	0.691	44%	0.444	S	S	*	.	S	Bend	trans	-69	-11.6	-179.6	-83.9	165.2	0	0	0	115.8	E571	E571-L575 HydrophobicContact CB-CD1 4.3Å; E571-L575 PolarHBondContact O-N 2.63Å
576	S	62.5	Low	62	Low	45 Å²	45	81.9 Å²	81.9	32%	0.315	42%	0.418	S	S	.	.			trans	-117.7	111.3	-153.1	81.4	0	0	0	0	112.1	R492 T574	R492-S576 PolarHBondContact NH1-O 2.78Å; R492-S576 PolarHBondContact NH1-OG 2.89Å; R492-S576 VanDerWaalsContact NH1-OG 3.11Å; R492-S576 VanDerWaalsContact NH2-C 3.33Å; T574-S576 PolarHBondContact O-N 3.11Å
577	K	77.7	Confident	65	Low	103 Å²	103	74.4 Å²	74.4	45%	0.448	38%	0.383	S	S	.	.			trans	-78	-43	-170.8	-66.6	-171.6	-174.2	174.2	0	116.2	L341 E343 L579	L341-K577 PolarHBondContact O-N 3.37Å; E343-K577 HydrophobicContact CG-CB 4.05Å; K577-L579 PolarHBondContact O-N 3.22Å
578	A	84.4	Confident	67.9	Low	2 Å²	2	69.4 Å²	69.4	2%	0.017	35%	0.348	C	S	.	.	S	Bend	trans	-51.7	122.3	-169.7	0	0	0	0	0	115	G340 L341 E343 L453 R492	G340-A578 WeakPolarHBondContact O-CB 3.22Å; L341-A578 PolarHBondContact O-N 2.94Å; L341-A578 VanDerWaalsContact O-N 3.11Å; E343-A578 HydrophobicContact CG-CB 4.06Å; E343-A578 WeakPolarHBondContact OE1-CA 3.45Å; L453-A578 HydrophobicContact CD1-CB 4.47Å; L453-A578 HydrophobicContact CD2-CB 4.21Å; R492-A578 VanDerWaalsContact CZ-O 3.23Å; R492-A578 PolarHBondContact NH1-O 2.71Å
579	L	88.9	Confident	70.9	Confident	8 Å²	8	61.1 Å²	61.1	4%	0.042	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-62.4	148.3	-172.2	-57.4	-173.7	0	0	0	113.7	E343 G491 R492 K577 I584 V587 Y600 L605	E343-L579 PolarHBondContact OE1-N 3.12Å; G491-L579 CarbonylContact C-O 3.23Å; G491-L579 WeakPolarHBondContact CA-O 3.44Å; R492-L579 PolarHBondContact N-O 3Å; K577-L579 PolarHBondContact O-N 3.22Å; L579-I584 HydrophobicContact CB-CD1 4.49Å; L579-I584 HydrophobicContact CB-CG1 3.69Å; L579-I584 HydrophobicContact CD1-CG1 4.22Å; L579-V587 HydrophobicContact CD1-CG2 3.96Å; L579-Y600 HydrophobicContact CD2-CD1 3.71Å; L579-Y600 HydrophobicContact CD2-CD2 4.27Å; L579-Y600 HydrophobicContact CD2-CE1 4.46Å; L579-Y600 HydrophobicContact CD2-CG 3.6Å; L579-L605 HydrophobicContact CD1-CD2 4.37Å
580	S	89.7	Confident	73.8	Confident	43 Å²	43	55.2 Å²	55.2	30%	0.301	29%	0.288	S	S	.	.	B	Isolated β-bridge	trans	-76.1	163.2	163.4	68.7	0	0	0	0	110.9	R492 S582 G583 I584	R492-S580 VanDerWaalsContact O-CA 3.26Å; R492-S580 WeakPolarHBondContact O-CA 3.47Å; R492-S580 VanDerWaalsContact O-CB 3.25Å; R492-S580 WeakPolarHBondContact O-CB 3.2Å; S580-S582 PolarHBondContact O-N 3.13Å; S580-G583 CarbonylContact O-C 3.57Å; S580-G583 WeakPolarHBondContact O-CA 3.41Å; S580-G583 PolarHBondContact O-N 3.01Å; S580-G583 PolarHBondContact OG-N 3.06Å; S580-I584 WeakPolarHBondContact O-CG1 3.1Å; S580-I584 PolarHBondContact O-N 3.33Å
581	L	87.1	Confident	76.4	Confident	9 Å²	9	51 Å²	51	5%	0.047	27%	0.267	C	S	.	.	H	α-helix	trans	-53	-37.9	175.2	-178.1	64	0	0	0	112.6	G585 Q638 V639	L581-G585 PolarHBondContact O-N 3.4Å; L581-Q638 HydrophobicContact CD2-CB 4.48Å; L581-V639 HydrophobicContact CD2-CG2 3.8Å
582	S	89	Confident	79	Confident	76 Å²	76	46.4 Å²	46.4	53%	0.531	25%	0.246	S	C	.	.	H	α-helix	trans	-70.2	-34.5	174.4	-174.2	0	0	0	0	112.9	S580 G585 S586	S580-S582 PolarHBondContact O-N 3.13Å; S582-G585 PolarHBondContact O-N 3.06Å; S582-S586 WeakPolarHBondContact O-CB 3.28Å; S582-S586 PolarHBondContact O-N 3.21Å; S582-S586 PolarHBondContact O-OG 3.49Å
583	G	91.2	Very high	81.4	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-63.9	-50.5	172.2	0	0	0	0	0	112.2	S580 G585 S586 V587 Y600	S580-G583 CarbonylContact O-C 3.57Å; S580-G583 WeakPolarHBondContact O-CA 3.41Å; S580-G583 PolarHBondContact O-N 3.01Å; S580-G583 PolarHBondContact OG-N 3.06Å; G583-G585 VanDerWaalsContact C-N 3.3Å; G583-G585 PolarHBondContact O-N 3.41Å; G583-S586 WeakPolarHBondContact O-CB 3.35Å; G583-S586 PolarHBondContact O-N 3.14Å; G583-S586 VanDerWaalsContact O-N 3.1Å; G583-V587 WeakPolarHBondContact O-CG2 3.43Å; G583-V587 PolarHBondContact O-N 3.39Å; G583-Y600 VanDerWaalsContact CA-CE2 3.48Å
584	I	91.1	Very high	83.5	Confident	3 Å²	3	37.1 Å²	37.1	2%	0.015	23%	0.23	C	C	.	.	H	α-helix	trans	-56.1	-45.7	173.4	-62.1	172.4	0	0	0	110.3	L488 L579 S580 S586 V587 L588 L605 L609	L488-I584 HydrophobicContact CD1-CG2 3.98Å; L579-I584 HydrophobicContact CB-CD1 4.49Å; L579-I584 HydrophobicContact CB-CG1 3.69Å; L579-I584 HydrophobicContact CD1-CG1 4.22Å; S580-I584 WeakPolarHBondContact O-CG1 3.1Å; S580-I584 PolarHBondContact O-N 3.33Å; I584-S586 VanDerWaalsContact C-N 3.34Å; I584-S586 PolarHBondContact O-N 3.43Å; I584-V587 PolarHBondContact O-N 3.07Å; I584-L588 HydrophobicContact CG2-CD1 4.07Å; I584-L588 HydrophobicContact CG2-CG 4.46Å; I584-L588 WeakPolarHBondContact O-CG 3.2Å; I584-L588 PolarHBondContact O-N 3.28Å; I584-L605 HydrophobicContact CD1-CD2 4.04Å; I584-L605 HydrophobicContact CG1-CD2 3.97Å; I584-L609 HydrophobicContact CG2-CD1 4.42Å
585	G	90.9	Very high	85.5	Confident	2 Å²	2	39.7 Å²	39.7	2%	0.021	23%	0.228	C	C	.	.	H	α-helix	trans	-59.6	-41.3	175.8	0	0	0	0	0	113.5	L581 S582 G583 L588 L589 L642	L581-G585 PolarHBondContact O-N 3.4Å; S582-G585 PolarHBondContact O-N 3.06Å; G583-G585 VanDerWaalsContact C-N 3.3Å; G583-G585 PolarHBondContact O-N 3.41Å; G585-L588 PolarHBondContact O-N 2.95Å; G585-L589 WeakPolarHBondContact O-CB 3.02Å; G585-L589 VanDerWaalsContact O-CG 3.23Å; G585-L589 WeakPolarHBondContact O-CG 3.25Å; G585-L589 PolarHBondContact O-N 3.47Å; G585-L642 VanDerWaalsContact CA-CD1 3.42Å; G585-L642 VanDerWaalsContact CA-CD2 3.48Å
586	S	92.1	Very high	87	Confident	44 Å²	44	45.1 Å²	45.1	31%	0.308	24%	0.239	S	C	.	.	H	α-helix	trans	-64.6	-39	176.3	-61.5	0	0	0	0	112.3	S582 G583 I584 A590	S582-S586 WeakPolarHBondContact O-CB 3.28Å; S582-S586 PolarHBondContact O-N 3.21Å; S582-S586 PolarHBondContact O-OG 3.49Å; G583-S586 WeakPolarHBondContact O-CB 3.35Å; G583-S586 PolarHBondContact O-N 3.14Å; G583-S586 VanDerWaalsContact O-N 3.1Å; I584-S586 VanDerWaalsContact C-N 3.34Å; I584-S586 PolarHBondContact O-N 3.43Å; S586-A590 WeakPolarHBondContact O-CB 3.31Å; S586-A590 PolarHBondContact O-N 3.1Å
587	V	93.5	Very high	88.1	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-63.7	-52.1	172.8	172.8	0	0	0	0	110.7	L579 G583 I584 L589 A590 L591 P599 Y600 T606 L609	L579-V587 HydrophobicContact CD1-CG2 3.96Å; G583-V587 WeakPolarHBondContact O-CG2 3.43Å; G583-V587 PolarHBondContact O-N 3.39Å; I584-V587 PolarHBondContact O-N 3.07Å; V587-L589 VanDerWaalsContact C-N 3.34Å; V587-L589 PolarHBondContact O-N 2.74Å; V587-A590 WeakPolarHBondContact O-CB 3.38Å; V587-A590 PolarHBondContact O-N 3.41Å; V587-L591 HydrophobicContact CG1-CD1 3.69Å; V587-L591 HydrophobicContact CG1-CG 4.16Å; V587-L591 WeakPolarHBondContact O-CG 3.41Å; V587-L591 PolarHBondContact O-N 3.08Å; V587-P599 HydrophobicContact CG2-CG 4.16Å; V587-Y600 HydrophobicContact CG2-CD2 4.07Å; V587-T606 HydrophobicContact CG1-CG2 4.07Å; V587-T606 HydrophobicContact CG2-CG2 4.26Å; V587-T606 WeakPolarHBondContact CG2-OG1 3.45Å; V587-L609 HydrophobicContact CB-CD1 4.36Å; V587-L609 HydrophobicContact CG1-CB 4.25Å; V587-L609 HydrophobicContact CG1-CD1 3.76Å
588	L	91.1	Very high	88.7	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-55.7	-46.4	178.2	-73.8	171.4	0	0	0	111.9	L281 I283 I584 G585 A590 L591 L592 L609 I613 I646	L281-L588 HydrophobicContact CD1-CD1 4.45Å; L281-L588 HydrophobicContact CD1-CD2 4.49Å; L281-L588 HydrophobicContact CD2-CD2 4.3Å; I283-L588 HydrophobicContact CG2-CD1 3.85Å; I584-L588 HydrophobicContact CG2-CD1 4.07Å; I584-L588 HydrophobicContact CG2-CG 4.46Å; I584-L588 WeakPolarHBondContact O-CG 3.2Å; I584-L588 PolarHBondContact O-N 3.28Å; G585-L588 PolarHBondContact O-N 2.95Å; L588-A590 VanDerWaalsContact C-N 3.33Å; L588-A590 PolarHBondContact O-N 2.97Å; L588-L591 PolarHBondContact O-N 3.47Å; L588-L592 WeakPolarHBondContact O-CB 3.2Å; L588-L592 VanDerWaalsContact O-CG 3.25Å; L588-L592 WeakPolarHBondContact O-CG 3.17Å; L588-L592 PolarHBondContact O-N 3.42Å; L588-L609 HydrophobicContact CD2-CD2 4Å; L588-I613 HydrophobicContact CD2-CD1 3.49Å; L588-I613 VanDerWaalsContact CD2-CD1 3.49Å; L588-I646 HydrophobicContact CB-CD1 4.45Å
589	L	91.2	Very high	89	Confident	42 Å²	42	46.9 Å²	46.9	22%	0.22	25%	0.247	C	C	.	.	H	α-helix	trans	-62.6	-37.7	176.4	-70.7	168.2	0	0	0	112.1	G585 V587 T593 L642 E645 I646 L649	G585-L589 WeakPolarHBondContact O-CB 3.02Å; G585-L589 VanDerWaalsContact O-CG 3.23Å; G585-L589 WeakPolarHBondContact O-CG 3.25Å; G585-L589 PolarHBondContact O-N 3.47Å; V587-L589 VanDerWaalsContact C-N 3.34Å; V587-L589 PolarHBondContact O-N 2.74Å; L589-T593 WeakPolarHBondContact O-CB 3.47Å; L589-T593 WeakPolarHBondContact O-CG2 3.49Å; L589-T593 PolarHBondContact O-N 2.87Å; L589-T593 VanDerWaalsContact O-N 3.11Å; L589-T593 PolarHBondContact O-OG1 3.25Å; L589-L642 HydrophobicContact CD1-CD1 4.02Å; L589-L642 HydrophobicContact CG-CD1 4.12Å; L589-E645 HydrophobicContact CD2-CB 4.31Å; L589-E645 HydrophobicContact CD2-CG 4.01Å; L589-I646 HydrophobicContact CD2-CG1 3.65Å; L589-I646 HydrophobicContact CG-CG1 4.34Å; L589-L649 HydrophobicContact CD2-CD1 3.62Å; L589-L649 HydrophobicContact CD2-CG 4.27Å
590	A	92	Very high	89	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.008	26%	0.264	C	S	.	.	H	α-helix	trans	-68.8	-44.6	176.7	0	0	0	0	0	112.7	S586 V587 L588 T593 G594 R595 L598 P599	S586-A590 WeakPolarHBondContact O-CB 3.31Å; S586-A590 PolarHBondContact O-N 3.1Å; V587-A590 WeakPolarHBondContact O-CB 3.38Å; V587-A590 PolarHBondContact O-N 3.41Å; L588-A590 VanDerWaalsContact C-N 3.33Å; L588-A590 PolarHBondContact O-N 2.97Å; A590-T593 PolarHBondContact O-OG1 2.82Å; A590-G594 PolarHBondContact O-N 3.38Å; A590-G594 VanDerWaalsContact O-N 3.17Å; A590-R595 HydrophobicContact CB-CB 4.28Å; A590-R595 HydrophobicContact CB-CG 4.37Å; A590-R595 PolarHBondContact O-N 2.97Å; A590-L598 HydrophobicContact CB-CD2 4.03Å; A590-P599 VanDerWaalsContact CB-CD 3.44Å; A590-P599 HydrophobicContact CB-CG 4.15Å
591	L	90.3	Very high	88.9	Confident	12 Å²	12	52.7 Å²	52.7	6%	0.063	26%	0.263	C	S	.	.	H	α-helix	trans	-62.8	-50.2	176.9	-66.6	171.3	0	0	0	111.1	V587 L588 T593 G594 L598 L609 R610 I613 T614	V587-L591 HydrophobicContact CG1-CD1 3.69Å; V587-L591 HydrophobicContact CG1-CG 4.16Å; V587-L591 WeakPolarHBondContact O-CG 3.41Å; V587-L591 PolarHBondContact O-N 3.08Å; L588-L591 PolarHBondContact O-N 3.47Å; L591-T593 VanDerWaalsContact C-N 3.3Å; L591-T593 PolarHBondContact O-N 3.07Å; L591-G594 PolarHBondContact O-N 2.72Å; L591-L598 HydrophobicContact CD2-CD1 3.67Å; L591-L598 HydrophobicContact CD2-CD2 3.65Å; L591-L598 HydrophobicContact CD2-CG 4.33Å; L591-L598 HydrophobicContact CG-CD2 4.19Å; L591-L609 HydrophobicContact CD1-CB 3.7Å; L591-R610 HydrophobicContact CD2-CB 3.86Å; L591-R610 HydrophobicContact CD2-CG 4Å; L591-I613 HydrophobicContact CD1-CD1 4.39Å; L591-T614 HydrophobicContact CB-CG2 4.18Å; L591-T614 HydrophobicContact CD2-CG2 3.63Å; L591-T614 HydrophobicContact CG-CG2 4.45Å
592	L	85.6	Confident	89	Confident	27 Å²	27	56 Å²	56	14%	0.141	28%	0.281	C	S	.	.	H	α-helix	trans	-71.1	-22.6	-177.1	-63.8	178.9	0	0	0	113.4	N192 L588 I613 P620 I622 I646 L649	N192-L592 WeakPolarHBondContact ND2-CD2 3.38Å; L588-L592 WeakPolarHBondContact O-CB 3.2Å; L588-L592 VanDerWaalsContact O-CG 3.25Å; L588-L592 WeakPolarHBondContact O-CG 3.17Å; L588-L592 PolarHBondContact O-N 3.42Å; L592-I613 HydrophobicContact CD2-CG2 3.58Å; L592-I613 HydrophobicContact CG-CG2 4.49Å; L592-P620 HydrophobicContact CD2-CG 4.03Å; L592-I622 HydrophobicContact CD1-CD1 4.25Å; L592-I646 HydrophobicContact CD1-CG2 3.5Å; L592-L649 HydrophobicContact CB-CD1 4.31Å
593	T	86.1	Confident	89.1	Confident	62 Å²	62	52.4 Å²	52.4	38%	0.38	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-5.6	166.8	51.3	0	0	0	0	114.4	L589 A590 L591 R595 L649	L589-T593 WeakPolarHBondContact O-CB 3.47Å; L589-T593 WeakPolarHBondContact O-CG2 3.49Å; L589-T593 PolarHBondContact O-N 2.87Å; L589-T593 VanDerWaalsContact O-N 3.11Å; L589-T593 PolarHBondContact O-OG1 3.25Å; A590-T593 PolarHBondContact O-OG1 2.82Å; L591-T593 VanDerWaalsContact C-N 3.3Å; L591-T593 PolarHBondContact O-N 3.07Å; T593-R595 WeakPolarHBondContact OG1-CG 3.33Å; T593-R595 PolarHBondContact OG1-NE 3.11Å; T593-L649 HydrophobicContact CG2-CD1 3.61Å; T593-L649 HydrophobicContact CG2-CD2 3.46Å; T593-L649 VanDerWaalsContact CG2-CD2 3.46Å; T593-L649 HydrophobicContact CG2-CG 4.12Å
594	G	84.1	Confident	89.1	Confident	60 Å²	60	53.1 Å²	53.1	62%	0.619	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.5	32.1	179.8	0	0	0	0	0	114	A590 L591	A590-G594 PolarHBondContact O-N 3.38Å; A590-G594 VanDerWaalsContact O-N 3.17Å; L591-G594 PolarHBondContact O-N 2.72Å
595	R	85.3	Confident	89.2	Confident	162 Å²	162	53 Å²	53	61%	0.611	26%	0.261	S	S	*	.			trans	-66.8	133	175.1	-62.5	-175.4	-171.2	-162.7	-0.5	110	A590 T593	A590-R595 HydrophobicContact CB-CB 4.28Å; A590-R595 HydrophobicContact CB-CG 4.37Å; A590-R595 PolarHBondContact O-N 2.97Å; T593-R595 WeakPolarHBondContact OG1-CG 3.33Å; T593-R595 PolarHBondContact OG1-NE 3.11Å
596	R	82.3	Confident	89.3	Confident	247 Å²	247	52.9 Å²	52.9	93%	0.932	26%	0.26	S	S	*	.	S	Bend	trans	-71.7	-33.8	176.8	-71	-175.5	176.7	178.4	-2.2	113.4
597	Q	86.6	Confident	89.2	Confident	123 Å²	123	51.8 Å²	51.8	58%	0.575	25%	0.249	S	C	*	.	S	Bend	trans	-101.7	125.2	172.5	-171.6	176.6	7.8	0	0	107.9
598	L	89.9	Confident	89.2	Confident	21 Å²	21	51.8 Å²	51.8	11%	0.11	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-95	145.7	178.6	-56.4	178.6	0	0	0	109.7	A590 L591 T606 R610	A590-L598 HydrophobicContact CB-CD2 4.03Å; L591-L598 HydrophobicContact CD2-CD1 3.67Å; L591-L598 HydrophobicContact CD2-CD2 3.65Å; L591-L598 HydrophobicContact CD2-CG 4.33Å; L591-L598 HydrophobicContact CG-CD2 4.19Å; L598-T606 HydrophobicContact CB-CG2 3.88Å; L598-T606 HydrophobicContact CD1-CG2 3.71Å; L598-T606 HydrophobicContact CG-CG2 4.44Å; L598-R610 HydrophobicContact CD1-CB 4.4Å; L598-R610 HydrophobicContact CD1-CG 4.42Å
599	P	90.9	Very high	89.3	Confident	42 Å²	42	51.8 Å²	51.8	27%	0.273	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.6	154.9	163.3	33.7	-34.2	0	0	0	109	V587 A590 Y601	V587-P599 HydrophobicContact CG2-CG 4.16Å; A590-P599 VanDerWaalsContact CB-CD 3.44Å; A590-P599 HydrophobicContact CB-CG 4.15Å; P599-Y601 VanDerWaalsContact C-N 3.31Å; P599-Y601 PolarHBondContact O-N 3.34Å
600	Y	89.4	Confident	89.2	Confident	99 Å²	99	55 Å²	55	39%	0.388	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.9	47.3	-179.2	-46.1	-83.1	0	0	0	113.2	L579 G583 V587 D602 S603 T606	L579-Y600 HydrophobicContact CD2-CD1 3.71Å; L579-Y600 HydrophobicContact CD2-CD2 4.27Å; L579-Y600 HydrophobicContact CD2-CE1 4.46Å; L579-Y600 HydrophobicContact CD2-CG 3.6Å; G583-Y600 VanDerWaalsContact CA-CE2 3.48Å; V587-Y600 HydrophobicContact CG2-CD2 4.07Å; Y600-D602 VanDerWaalsContact C-OD1 3.26Å; Y600-D602 WeakPolarHBondContact CA-OD1 3.32Å; Y600-D602 PolarHBondContact O-N 3.18Å; Y600-D602 VanDerWaalsContact O-N 3.16Å; Y600-S603 WeakPolarHBondContact O-CB 3.26Å; Y600-S603 PolarHBondContact O-N 2.84Å; Y600-S603 VanDerWaalsContact O-N 3.12Å; Y600-T606 VanDerWaalsContact O-CB 3.23Å; Y600-T606 WeakPolarHBondContact O-CB 3.4Å; Y600-T606 PolarHBondContact O-OG1 3.04Å
601	Y	88.2	Confident	88.9	Confident	74 Å²	74	57.5 Å²	57.5	29%	0.29	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-6.1	179.1	64	-97.6	0	0	0	113.3	A406 P599 Y607	A406-Y601 HydrophobicContact CB-CD2 3.3Å; A406-Y601 HydrophobicContact CB-CE2 3.31Å; A406-Y601 HydrophobicContact CB-CG 4.27Å; P599-Y601 VanDerWaalsContact C-N 3.31Å; P599-Y601 PolarHBondContact O-N 3.34Å; Y601-Y607 WeakPolarHBondContact O-CE2 3.31Å; Y601-Y607 PolarHBondContact O-OH 3.36Å; Y601-Y607 VanDerWaalsContact O-OH 3.06Å
602	D	88.2	Confident	88.8	Confident	78 Å²	78	56.9 Å²	56.9	42%	0.417	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-9.8	176	55.4	-43	0	0	0	112.8	Y600	Y600-D602 VanDerWaalsContact C-OD1 3.26Å; Y600-D602 WeakPolarHBondContact CA-OD1 3.32Å; Y600-D602 PolarHBondContact O-N 3.18Å; Y600-D602 VanDerWaalsContact O-N 3.16Å
603	S	91	Very high	88.9	Confident	2 Å²	2	56 Å²	56	1%	0.014	26%	0.262	C	S	.	.			trans	-84	131.5	172.3	162	0	0	0	0	111.5	E343 Y600 L605 T606 Y607	E343-S603 PolarHBondContact OE1-OG 3.25Å; E343-S603 VanDerWaalsContact OE2-C 3.29Å; E343-S603 WeakPolarHBondContact OE2-CA 3.49Å; E343-S603 VanDerWaalsContact OE2-CB 3.23Å; E343-S603 WeakPolarHBondContact OE2-CB 3.47Å; E343-S603 PolarHBondContact OE2-OG 2.83Å; Y600-S603 WeakPolarHBondContact O-CB 3.26Å; Y600-S603 PolarHBondContact O-N 2.84Å; Y600-S603 VanDerWaalsContact O-N 3.12Å; S603-L605 VanDerWaalsContact C-N 3.27Å; S603-L605 PolarHBondContact O-N 3.21Å; S603-L605 WeakPolarHBondContact OG-CB 3.34Å; S603-L605 PolarHBondContact OG-N 2.95Å; S603-L605 VanDerWaalsContact OG-N 3.13Å; S603-T606 WeakPolarHBondContact O-CB 3.39Å; S603-T606 PolarHBondContact O-N 2.69Å; S603-T606 PolarHBondContact OG-N 2.84Å; S603-Y607 WeakPolarHBondContact O-CD2 3.4Å
604	S	91.7	Very high	88.5	Confident	15 Å²	15	56.5 Å²	56.5	11%	0.105	27%	0.265	C	S	.	.	H	α-helix	trans	-62.8	-34.6	169.7	-71.2	0	0	0	0	111.5	E343 T606 Y607 L608	E343-S604 PolarHBondContact OE2-N 2.67Å; S604-T606 VanDerWaalsContact C-N 3.29Å; S604-T606 PolarHBondContact O-N 3.33Å; S604-Y607 PolarHBondContact O-N 2.68Å; S604-Y607 VanDerWaalsContact O-N 3.14Å; S604-L608 PolarHBondContact O-N 2.87Å
605	L	92.4	Very high	87.8	Confident	0 Å²	0	55 Å²	55	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-63.6	-34.7	177.2	-177.9	60.7	0	0	0	111.9	I338 E343 H455 L488 L579 I584 S603 Y607 L608 L609	I338-L605 HydrophobicContact CD1-CB 4.34Å; E343-L605 PolarHBondContact OE2-N 3.03Å; H455-L605 HydrophobicContact CB-CD1 4Å; L488-L605 HydrophobicContact CD2-CD1 3.99Å; L579-L605 HydrophobicContact CD1-CD2 4.37Å; I584-L605 HydrophobicContact CD1-CD2 4.04Å; I584-L605 HydrophobicContact CG1-CD2 3.97Å; S603-L605 VanDerWaalsContact C-N 3.27Å; S603-L605 PolarHBondContact O-N 3.21Å; S603-L605 WeakPolarHBondContact OG-CB 3.34Å; S603-L605 PolarHBondContact OG-N 2.95Å; S603-L605 VanDerWaalsContact OG-N 3.13Å; L605-Y607 VanDerWaalsContact C-N 3.27Å; L605-Y607 PolarHBondContact O-N 2.73Å; L605-L608 HydrophobicContact CD1-CD2 4.37Å; L605-L608 PolarHBondContact O-N 3.43Å; L605-L609 HydrophobicContact CD1-CD1 4.32Å; L605-L609 HydrophobicContact CD1-CG 4.23Å; L605-L609 HydrophobicContact CG-CD1 3.95Å; L605-L609 HydrophobicContact CG-CG 4.36Å; L605-L609 WeakPolarHBondContact O-CB 3.4Å; L605-L609 VanDerWaalsContact O-CG 3.31Å; L605-L609 WeakPolarHBondContact O-CG 3.42Å; L605-L609 PolarHBondContact O-N 3.19Å
606	T	93.2	Very high	86.7	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-59	-36.5	173.7	-63.7	0	0	0	0	112.7	V587 L598 Y600 S603 S604 R610	V587-T606 HydrophobicContact CG1-CG2 4.07Å; V587-T606 HydrophobicContact CG2-CG2 4.26Å; V587-T606 WeakPolarHBondContact CG2-OG1 3.45Å; L598-T606 HydrophobicContact CB-CG2 3.88Å; L598-T606 HydrophobicContact CD1-CG2 3.71Å; L598-T606 HydrophobicContact CG-CG2 4.44Å; Y600-T606 VanDerWaalsContact O-CB 3.23Å; Y600-T606 WeakPolarHBondContact O-CB 3.4Å; Y600-T606 PolarHBondContact O-OG1 3.04Å; S603-T606 WeakPolarHBondContact O-CB 3.39Å; S603-T606 PolarHBondContact O-N 2.69Å; S603-T606 PolarHBondContact OG-N 2.84Å; S604-T606 VanDerWaalsContact C-N 3.29Å; S604-T606 PolarHBondContact O-N 3.33Å; T606-R610 WeakPolarHBondContact O-CB 3.11Å; T606-R610 PolarHBondContact O-N 3.5Å
607	Y	91.2	Very high	86.3	Confident	20 Å²	20	47 Å²	47	8%	0.078	23%	0.234	C	C	.	.	H	α-helix	trans	-79.9	-36.7	177.6	-70.5	-73.9	0	0	0	113.2	A406 V409 S410 M413 Y601 S603 S604 L605 R610 E611	A406-Y607 PolarHBondContact O-OH 3.35Å; V409-Y607 HydrophobicContact CG1-CD2 4.43Å; V409-Y607 HydrophobicContact CG1-CE2 3.95Å; S410-Y607 VanDerWaalsContact CB-OH 3.31Å; S410-Y607 WeakPolarHBondContact CB-OH 3.41Å; S410-Y607 WeakPolarHBondContact OG-CE1 3.23Å; M413-Y607 HydrophobicContact CB-CD2 4.23Å; M413-Y607 HydrophobicContact CB-CG 4.2Å; M413-Y607 HydrophobicContact CG-CD2 4.46Å; M413-Y607 HydrophobicContact CG-CG 4.3Å; Y601-Y607 WeakPolarHBondContact O-CE2 3.31Å; Y601-Y607 PolarHBondContact O-OH 3.36Å; Y601-Y607 VanDerWaalsContact O-OH 3.06Å; S603-Y607 WeakPolarHBondContact O-CD2 3.4Å; S604-Y607 PolarHBondContact O-N 2.68Å; S604-Y607 VanDerWaalsContact O-N 3.14Å; L605-Y607 VanDerWaalsContact C-N 3.27Å; L605-Y607 PolarHBondContact O-N 2.73Å; Y607-R610 WeakPolarHBondContact O-CB 3.21Å; Y607-R610 PolarHBondContact O-N 3.08Å; Y607-R610 VanDerWaalsContact O-N 3.16Å; Y607-E611 PolarHBondContact O-N 3.32Å
608	L	92	Very high	86.1	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.8	-46.6	172.8	-170.4	72.3	0	0	0	111	V336 I338 L417 L457 L486 S604 L605 R610 E611 A612	V336-L608 HydrophobicContact CG2-CD1 3.85Å; I338-L608 HydrophobicContact CD1-CB 3.79Å; I338-L608 HydrophobicContact CD1-CD2 3.69Å; I338-L608 HydrophobicContact CD1-CG 4.29Å; I338-L608 HydrophobicContact CG1-CD2 4.11Å; L417-L608 HydrophobicContact CD2-CD1 4.02Å; L457-L608 HydrophobicContact CB-CD1 4.19Å; L457-L608 HydrophobicContact CB-CD2 4.17Å; L457-L608 HydrophobicContact CB-CG 4.39Å; L457-L608 HydrophobicContact CD2-CD1 3.55Å; L457-L608 HydrophobicContact CD2-CG 4.12Å; L486-L608 HydrophobicContact CD1-CD2 4.25Å; S604-L608 PolarHBondContact O-N 2.87Å; L605-L608 HydrophobicContact CD1-CD2 4.37Å; L605-L608 PolarHBondContact O-N 3.43Å; L608-R610 VanDerWaalsContact C-N 3.27Å; L608-R610 PolarHBondContact O-N 2.92Å; L608-E611 PolarHBondContact O-N 3.3Å; L608-A612 PolarHBondContact O-N 3.48Å
609	L	93.3	Very high	85.6	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-60.3	-36.4	172.3	-74.9	167.3	0	0	0	112	L486 L488 I584 V587 L588 L591 L605 I613	L486-L609 HydrophobicContact CD2-CD2 3.55Å; L488-L609 HydrophobicContact CD1-CD2 4.28Å; L488-L609 HydrophobicContact CD2-CD2 4.46Å; I584-L609 HydrophobicContact CG2-CD1 4.42Å; V587-L609 HydrophobicContact CB-CD1 4.36Å; V587-L609 HydrophobicContact CG1-CB 4.25Å; V587-L609 HydrophobicContact CG1-CD1 3.76Å; L588-L609 HydrophobicContact CD2-CD2 4Å; L591-L609 HydrophobicContact CD1-CB 3.7Å; L605-L609 HydrophobicContact CD1-CD1 4.32Å; L605-L609 HydrophobicContact CD1-CG 4.23Å; L605-L609 HydrophobicContact CG-CD1 3.95Å; L605-L609 HydrophobicContact CG-CG 4.36Å; L605-L609 WeakPolarHBondContact O-CB 3.4Å; L605-L609 VanDerWaalsContact O-CG 3.31Å; L605-L609 WeakPolarHBondContact O-CG 3.42Å; L605-L609 PolarHBondContact O-N 3.19Å; L609-I613 HydrophobicContact CB-CD1 4.37Å; L609-I613 HydrophobicContact CD2-CD1 3.8Å; L609-I613 WeakPolarHBondContact O-CB 3.47Å; L609-I613 WeakPolarHBondContact O-CD1 3.48Å; L609-I613 WeakPolarHBondContact O-CG1 3.21Å; L609-I613 PolarHBondContact O-N 3.39Å; L609-I613 VanDerWaalsContact O-N 3.17Å
610	R	90.3	Very high	85.4	Confident	109 Å²	109	40.1 Å²	40.1	41%	0.411	20%	0.199	S	C	.	.	H	α-helix	trans	-65.8	-45.4	176.2	-176.1	-175.6	175	-159.4	-5.6	111.6	L591 L598 T606 Y607 L608 T614	L591-R610 HydrophobicContact CD2-CB 3.86Å; L591-R610 HydrophobicContact CD2-CG 4Å; L598-R610 HydrophobicContact CD1-CB 4.4Å; L598-R610 HydrophobicContact CD1-CG 4.42Å; T606-R610 WeakPolarHBondContact O-CB 3.11Å; T606-R610 PolarHBondContact O-N 3.5Å; Y607-R610 WeakPolarHBondContact O-CB 3.21Å; Y607-R610 PolarHBondContact O-N 3.08Å; Y607-R610 VanDerWaalsContact O-N 3.16Å; L608-R610 VanDerWaalsContact C-N 3.27Å; L608-R610 PolarHBondContact O-N 2.92Å; R610-T614 HydrophobicContact CG-CG2 4.26Å; R610-T614 VanDerWaalsContact CG-OG1 3.26Å; R610-T614 WeakPolarHBondContact CG-OG1 3Å; R610-T614 WeakPolarHBondContact O-CB 3.17Å; R610-T614 PolarHBondContact O-N 3.08Å; R610-T614 PolarHBondContact O-OG1 2.95Å
611	E	84.9	Confident	85.5	Confident	54 Å²	54	35.6 Å²	35.6	25%	0.252	18%	0.182	S	C	.	.	H	α-helix	trans	-62.3	-50.2	179.2	-167.5	-83.4	154.6	0	0	111.2	L417 K482 H484 Y607 L608 I613	L417-E611 HydrophobicContact CD1-CB 4.21Å; L417-E611 HydrophobicContact CD1-CG 4.3Å; K482-E611 IonicContact NZ-OE1 2.86Å; K482-E611 PolarHBondContact NZ-OE1 2.97Å; H484-E611 IonicContact CE1-OE1 2.77Å; H484-E611 IonicContact CE1-OE2 2.65Å; H484-E611 PolarHBondContact CE1-OE2 2.96Å; Y607-E611 PolarHBondContact O-N 3.32Å; L608-E611 PolarHBondContact O-N 3.3Å; E611-I613 VanDerWaalsContact C-N 3.32Å; E611-I613 PolarHBondContact O-N 2.92Å
612	A	88.1	Confident	85.8	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-76	-7.9	-177.2	0	0	0	0	0	115.5	C279 L457 H484 L608	C279-A612 VanDerWaalsContact CB-O 3.23Å; C279-A612 WeakPolarHBondContact CB-O 3.47Å; C279-A612 PolarHBondContact SG-O 2.98Å; L457-A612 HydrophobicContact CD1-CB 4.09Å; L457-A612 HydrophobicContact CD2-CB 4.21Å; H484-A612 HydrophobicContact CB-CB 4.31Å; L608-A612 PolarHBondContact O-N 3.48Å
613	I	88.3	Confident	86.1	Confident	9 Å²	9	28.4 Å²	28.4	5%	0.046	15%	0.148	C	C	.	.	H	α-helix	trans	-126.2	-27.2	-175	-53.8	172.8	0	0	0	113.4	L281 L588 L591 L592 L609 E611 G615 P620	L281-I613 HydrophobicContact CD2-CD1 3.71Å; L281-I613 HydrophobicContact CD2-CG1 4.26Å; L588-I613 HydrophobicContact CD2-CD1 3.49Å; L588-I613 VanDerWaalsContact CD2-CD1 3.49Å; L591-I613 HydrophobicContact CD1-CD1 4.39Å; L592-I613 HydrophobicContact CD2-CG2 3.58Å; L592-I613 HydrophobicContact CG-CG2 4.49Å; L609-I613 HydrophobicContact CB-CD1 4.37Å; L609-I613 HydrophobicContact CD2-CD1 3.8Å; L609-I613 WeakPolarHBondContact O-CB 3.47Å; L609-I613 WeakPolarHBondContact O-CD1 3.48Å; L609-I613 WeakPolarHBondContact O-CG1 3.21Å; L609-I613 PolarHBondContact O-N 3.39Å; L609-I613 VanDerWaalsContact O-N 3.17Å; E611-I613 VanDerWaalsContact C-N 3.32Å; E611-I613 PolarHBondContact O-N 2.92Å; I613-G615 PolarHBondContact O-N 2.76Å; I613-P620 HydrophobicContact CG2-CB 4.49Å
614	T	77.4	Confident	86.2	Confident	71 Å²	71	28.3 Å²	28.3	44%	0.436	15%	0.147	S	C	.	.			trans	-96.8	65.1	-174.7	65.2	0	0	0	0	114.3	L591 R610	L591-T614 HydrophobicContact CB-CG2 4.18Å; L591-T614 HydrophobicContact CD2-CG2 3.63Å; L591-T614 HydrophobicContact CG-CG2 4.45Å; R610-T614 HydrophobicContact CG-CG2 4.26Å; R610-T614 VanDerWaalsContact CG-OG1 3.26Å; R610-T614 WeakPolarHBondContact CG-OG1 3Å; R610-T614 WeakPolarHBondContact O-CB 3.17Å; R610-T614 PolarHBondContact O-N 3.08Å; R610-T614 PolarHBondContact O-OG1 2.95Å
615	G	69.5	Low	86.3	Confident	30 Å²	30	27.6 Å²	27.6	31%	0.309	14%	0.143	S	C	.	.			trans	-110.4	148.4	171	0	0	0	0	0	112.3	I613 Q617 I618	I613-G615 PolarHBondContact O-N 2.76Å; G615-Q617 PolarHBondContact O-N 2.89Å; G615-Q617 VanDerWaalsContact O-N 3.12Å; G615-I618 PolarHBondContact O-N 3.18Å
616	N	61.8	Low	86.3	Confident	138 Å²	138	27.6 Å²	27.6	74%	0.738	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-20.9	-177.7	-90.7	-23.5	0	0	0	114.1	W839	N616-W839 HydrophobicContact CB-CH2 4.25Å; N616-W839 HydrophobicContact CB-CZ2 3.87Å; N616-W839 WeakPolarHBondContact O-CH2 3.42Å
617	Q	75	Confident	86.1	Confident	101 Å²	101	27.8 Å²	27.8	47%	0.472	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-127.1	12.4	177.1	-58.6	-161.8	66.8	0	0	113.4	K276 G615 Q619 W839	K276-Q617 HydrophobicContact CB-CB 4.32Å; K276-Q617 HydrophobicContact CG-CB 4.21Å; G615-Q617 PolarHBondContact O-N 2.89Å; G615-Q617 VanDerWaalsContact O-N 3.12Å; Q617-Q619 PolarHBondContact O-N 2.94Å; Q617-W839 HydrophobicContact CG-CH2 4.44Å
618	I	80.8	Confident	86	Confident	16 Å²	16	28.5 Å²	28.5	8%	0.082	15%	0.148	C	C	.	.			trans	-60.7	130.5	-178	-81.8	-178.4	0	0	0	111.2	D277 C279 G615 P620	D277-I618 HydrophobicContact CB-CD1 4.2Å; D277-I618 HydrophobicContact CB-CG1 3.4Å; D277-I618 WeakPolarHBondContact O-CA 3.31Å; C279-I618 HydrophobicContact CB-CG2 4.41Å; G615-I618 PolarHBondContact O-N 3.18Å; I618-P620 HydrophobicContact CG2-CB 4.2Å; I618-P620 HydrophobicContact CG2-CG 4.26Å; I618-P620 WeakPolarHBondContact O-CD 3.46Å
619	Q	80.3	Confident	85.7	Confident	22 Å²	22	30 Å²	30	10%	0.103	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	98	168.2	-63.4	-175.7	-111.8	0	0	109.4	L191 D277 S278 C279 Q617	L191-Q619 WeakPolarHBondContact O-CA 3.17Å; D277-Q619 PolarHBondContact O-N 3.49Å; D277-Q619 VanDerWaalsContact O-N 3.09Å; S278-Q619 PolarHBondContact OG-O 2.89Å; S278-Q619 VanDerWaalsContact OG-O 3.08Å; C279-Q619 PolarHBondContact N-O 3.42Å; Q617-Q619 PolarHBondContact O-N 2.94Å
620	P	87.1	Confident	85.5	Confident	5 Å²	5	32.4 Å²	32.4	3%	0.032	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	119.5	-178.4	33.7	-28.1	0	0	0	111.7	L191 N192 T193 C279 L592 I613 I618	L191-P620 VanDerWaalsContact O-CD 3.28Å; L191-P620 WeakPolarHBondContact O-CD 3.36Å; N192-P620 WeakPolarHBondContact CA-O 3.48Å; N192-P620 HydrophobicContact CB-CG 4.21Å; N192-P620 WeakPolarHBondContact CB-O 3.25Å; N192-P620 WeakPolarHBondContact ND2-CG 3.42Å; T193-P620 PolarHBondContact N-O 3.1Å; C279-P620 HydrophobicContact CB-CB 4.42Å; C279-P620 CarbonylContact O-C 2.94Å; C279-P620 VanDerWaalsContact O-CA 3.25Å; C279-P620 WeakPolarHBondContact O-CA 3.18Å; L592-P620 HydrophobicContact CD2-CG 4.03Å; I613-P620 HydrophobicContact CG2-CB 4.49Å; I618-P620 HydrophobicContact CG2-CB 4.2Å; I618-P620 HydrophobicContact CG2-CG 4.26Å; I618-P620 WeakPolarHBondContact O-CD 3.46Å
621	C	91.8	Very high	85.3	Confident	4 Å²	4	34 Å²	34	3%	0.027	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	135.3	168	-175.2	0	0	0	0	110	T193 C279 I280 L281	T193-C621 WeakPolarHBondContact O-CA 3.29Å; T193-C621 WeakPolarHBondContact OG1-CB 3.38Å; T193-C621 PolarHBondContact OG1-SG 3.46Å; C279-C621 PolarHBondContact O-N 2.89Å; I280-C621 HydrophobicContact CG1-CB 4.04Å; L281-C621 PolarHBondContact N-O 2.92Å
622	I	92.8	Very high	85.3	Confident	1 Å²	1	34.6 Å²	34.6	1%	0.005	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	123.5	178	-55.7	-175	0	0	0	109.8	T193 I194 H195 L281 I283 L592 I646	T193-I622 PolarHBondContact O-N 3.39Å; I194-I622 WeakPolarHBondContact CA-O 3.28Å; I194-I622 HydrophobicContact CG1-CB 4.41Å; H195-I622 PolarHBondContact N-O 2.89Å; L281-I622 HydrophobicContact CD1-CB 4.43Å; L281-I622 HydrophobicContact CD1-CG1 4.06Å; L281-I622 HydrophobicContact CD1-CG2 4.03Å; L281-I622 HydrophobicContact CD2-CG1 4.26Å; L281-I622 HydrophobicContact CG-CG1 4.09Å; I283-I622 HydrophobicContact CD1-CG2 3.71Å; I283-I622 HydrophobicContact CG1-CG2 3.81Å; L592-I622 HydrophobicContact CD1-CD1 4.25Å; I622-I646 HydrophobicContact CD1-CD1 3.85Å; I622-I646 HydrophobicContact CD1-CG2 3.85Å
623	L	94.4	Very high	85.4	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	99.1	176	-51.5	179.2	0	0	0	108.3	H195 F260 V264 I280 L281 T282 I283 M294 I306	H195-L623 HydrophobicContact CB-CD2 4.04Å; F260-L623 HydrophobicContact CZ-CD1 4.29Å; F260-L623 HydrophobicContact CZ-CD2 4.5Å; V264-L623 HydrophobicContact CB-CD2 4.5Å; V264-L623 HydrophobicContact CG1-CD2 4.02Å; V264-L623 HydrophobicContact CG2-CD2 3.58Å; I280-L623 HydrophobicContact CG2-CD1 3.62Å; I280-L623 HydrophobicContact CG2-CG 4.05Å; L281-L623 PolarHBondContact O-N 2.82Å; T282-L623 CarbonylContact C-O 3.48Å; T282-L623 WeakPolarHBondContact CA-O 3.28Å; T282-L623 HydrophobicContact CG2-CB 4.19Å; T282-L623 HydrophobicContact CG2-CD1 4.28Å; I283-L623 PolarHBondContact N-O 3.39Å; M294-L623 HydrophobicContact SD-CD1 4.08Å; I306-L623 HydrophobicContact CD1-CD1 3.36Å
624	A	94.7	Very high	85.5	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	104.9	-176.1	0	0	0	0	0	110.2	H195 L196 K197 I283 V639 A643	H195-A624 PolarHBondContact O-N 2.88Å; L196-A624 CarbonylContact C-O 3.42Å; L196-A624 WeakPolarHBondContact CA-O 3.39Å; L196-A624 HydrophobicContact CD2-CB 3.63Å; L196-A624 VanDerWaalsContact CD2-O 3.32Å; L196-A624 WeakPolarHBondContact CD2-O 3.45Å; K197-A624 PolarHBondContact N-O 3.44Å; I283-A624 HydrophobicContact CD1-CB 4.11Å; I283-A624 HydrophobicContact CG1-CB 3.85Å; I283-A624 CarbonylContact O-C 3.56Å; I283-A624 WeakPolarHBondContact O-CA 3.38Å; A624-V639 HydrophobicContact CB-CG1 4.07Å; A624-A643 HydrophobicContact CB-CB 3.92Å
625	H	93	Very high	86	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	122.5	-172.6	-90.7	-99.6	0	0	0	112.3	K197 D199 I283 G284 T288 G289 K290 S293	K197-H625 WeakPolarHBondContact O-CA 3.38Å; D199-H625 IonicContact OD2-CE1 3.61Å; D199-H625 PolarHBondContact OD2-CE1 3.3Å; D199-H625 IonicContact OD2-CG 2.74Å; D199-H625 IonicContact OD2-ND1 2.69Å; D199-H625 PolarHBondContact OD2-ND1 2.91Å; I283-H625 PolarHBondContact O-N 3.24Å; G284-H625 WeakPolarHBondContact CA-O 3.39Å; T288-H625 VanDerWaalsContact O-CB 3.32Å; T288-H625 WeakPolarHBondContact O-CB 3.38Å; T288-H625 PolarHBondContact O-ND1 2.9Å; T288-H625 PolarHBondContact OG1-O 3.38Å; G289-H625 PolarHBondContact O-CE1 3.41Å; K290-H625 HydrophobicContact CG-CB 3.9Å; S293-H625 WeakPolarHBondContact CB-NE2 3.38Å; S293-H625 PolarHBondContact OG-CE1 2.88Å; S293-H625 PolarHBondContact OG-NE2 2.9Å
626	I	92.7	Very high	87	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	163.7	-172.9	56.2	168	0	0	0	112.3	L196 K197 M198 D199 I215 I224 T636 V639 I640	L196-I626 HydrophobicContact CD1-CD1 4.15Å; L196-I626 HydrophobicContact CD2-CD1 4.12Å; L196-I626 HydrophobicContact CD2-CG1 4.37Å; L196-I626 HydrophobicContact CD2-CG2 4.06Å; K197-I626 WeakPolarHBondContact O-CG1 3.34Å; K197-I626 PolarHBondContact O-N 3.36Å; M198-I626 WeakPolarHBondContact CA-O 3.35Å; M198-I626 HydrophobicContact CB-CD1 4.45Å; M198-I626 HydrophobicContact CB-CG1 4.16Å; M198-I626 HydrophobicContact CE-CD1 3.79Å; M198-I626 HydrophobicContact CG-CD1 4.47Å; M198-I626 HydrophobicContact CG-CG1 4.3Å; D199-I626 PolarHBondContact N-O 3.43Å; I215-I626 HydrophobicContact CD1-CD1 4.09Å; I224-I626 HydrophobicContact CD1-CD1 4.01Å; I626-T636 HydrophobicContact CB-CG2 3.88Å; I626-T636 HydrophobicContact CG2-CG2 4.02Å; I626-V639 HydrophobicContact CG2-CB 3.95Å; I626-V639 HydrophobicContact CG2-CG1 3.66Å; I626-I640 HydrophobicContact CD1-CD1 4.02Å; I626-I640 HydrophobicContact CD1-CG1 4.41Å; I626-I640 HydrophobicContact CG2-CD1 4.35Å; I626-I640 HydrophobicContact CG2-CG1 3.95Å
627	S	89.4	Confident	88.4	Confident	3 Å²	3	30.3 Å²	30.3	2%	0.021	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	139.8	-179.9	162	0	0	0	0	112	I215 H285 N629 T636	I215-S627 WeakPolarHBondContact CD1-O 3.49Å; H285-S627 VanDerWaalsContact CE1-CB 3.47Å; H285-S627 WeakPolarHBondContact CE1-CB 2.97Å; H285-S627 WeakPolarHBondContact NE2-CB 3.35Å; S627-N629 WeakPolarHBondContact OG-CB 3.25Å; S627-N629 PolarHBondContact OG-N 2.93Å; S627-T636 PolarHBondContact N-OG1 2.93Å; S627-T636 VanDerWaalsContact N-OG1 3.12Å; S627-T636 PolarHBondContact O-OG1 3.05Å
628	E	88.9	Confident	89.2	Confident	36 Å²	36	29.6 Å²	29.6	17%	0.168	15%	0.147	C	C	.	.			trans	-69.3	-29.5	170.4	-70.4	-176.4	-105.2	0	0	114	M198 R200 S213 C214 Q253 V630	M198-E628 HydrophobicContact CG-CG 3.69Å; M198-E628 HydrophobicContact SD-CG 3.35Å; M198-E628 WeakPolarHBondContact SD-CG 3.33Å; R200-E628 IonicContact NE-OE1 3.56Å; R200-E628 IonicContact NH2-OE1 2.77Å; S213-E628 WeakPolarHBondContact OG-CB 3.25Å; S213-E628 PolarHBondContact OG-OE2 3.27Å; C214-E628 PolarHBondContact N-O 2.84Å; C214-E628 VanDerWaalsContact N-O 3.08Å; C214-E628 PolarHBondContact SG-O 3.36Å; Q253-E628 PolarHBondContact NE2-OE1 3.21Å; E628-V630 PolarHBondContact O-N 3.16Å
629	N	85.8	Confident	89.7	Confident	30 Å²	30	28.9 Å²	28.9	16%	0.16	14%	0.144	C	C	.	.	S	Bend	trans	-65.1	124.8	-174.4	178.5	-4	0	0	0	111.4	S627 Q631 Y632	S627-N629 WeakPolarHBondContact OG-CB 3.25Å; S627-N629 PolarHBondContact OG-N 2.93Å; N629-Q631 PolarHBondContact ND2-OE1 2.99Å; N629-Q631 PolarHBondContact O-N 3.26Å; N629-Q631 VanDerWaalsContact O-N 3.11Å; N629-Q631 WeakPolarHBondContact OD1-CB 3.26Å; N629-Q631 WeakPolarHBondContact OD1-CG 3.35Å; N629-Q631 PolarHBondContact OD1-N 3.33Å; N629-Y632 HydrophobicContact CB-CD2 4.34Å; N629-Y632 PolarHBondContact O-N 3.19Å
630	V	87.8	Confident	90.3	Very high	51 Å²	51	27.9 Å²	27.9	31%	0.309	14%	0.139	S	C	.	.	G	3₁₀ helix	trans	-48.9	-33.3	176.4	166.7	0	0	0	0	113.5	S212 C214 P229 E628 Y632 Y633	S212-V630 WeakPolarHBondContact O-CG2 3.1Å; C214-V630 HydrophobicContact CB-CG2 3.94Å; P229-V630 HydrophobicContact CB-CB 4.49Å; P229-V630 HydrophobicContact CB-CG1 3.67Å; P229-V630 HydrophobicContact CB-CG2 4.03Å; P229-V630 HydrophobicContact CG-CG1 3.97Å; E628-V630 PolarHBondContact O-N 3.16Å; V630-Y632 PolarHBondContact O-N 3.14Å; V630-Y632 VanDerWaalsContact O-N 3.08Å; V630-Y633 VanDerWaalsContact O-CB 3.29Å; V630-Y633 WeakPolarHBondContact O-CB 3.42Å; V630-Y633 PolarHBondContact O-N 3.03Å
631	Q	86.2	Confident	90.6	Very high	142 Å²	142	32 Å²	32	66%	0.664	16%	0.158	S	C	*	.	G	3₁₀ helix	trans	-57.7	-22.5	177.3	-67.7	172.4	-22.9	0	0	113.5	N629	N629-Q631 PolarHBondContact ND2-OE1 2.99Å; N629-Q631 PolarHBondContact O-N 3.26Å; N629-Q631 VanDerWaalsContact O-N 3.11Å; N629-Q631 WeakPolarHBondContact OD1-CB 3.26Å; N629-Q631 WeakPolarHBondContact OD1-CG 3.35Å; N629-Q631 PolarHBondContact OD1-N 3.33Å
632	Y	86.6	Confident	90.5	Very high	68 Å²	68	32.7 Å²	32.7	27%	0.267	16%	0.161	S	C	.	.	G	3₁₀ helix	trans	-115.4	21.9	178.1	-53.4	-60.7	0	0	0	113.2	H285 N629 V630 T634 E635 T636	H285-Y632 WeakPolarHBondContact CE1-CB 3.36Å; H285-Y632 AromaticContact CE1-CD1 3.96Å; H285-Y632 AromaticContact CE1-CD2 3.64Å; H285-Y632 AromaticContact CE1-CG 3.35Å; H285-Y632 AromaticContact ND1-CG 3.97Å; H285-Y632 WeakPolarHBondContact NE2-CB 3.29Å; N629-Y632 HydrophobicContact CB-CD2 4.34Å; N629-Y632 PolarHBondContact O-N 3.19Å; V630-Y632 PolarHBondContact O-N 3.14Å; V630-Y632 VanDerWaalsContact O-N 3.08Å; Y632-T634 VanDerWaalsContact C-N 3.3Å; Y632-T634 PolarHBondContact O-N 3.46Å; Y632-E635 PolarHBondContact O-N 2.94Å; Y632-T636 VanDerWaalsContact O-CB 3.28Å; Y632-T636 WeakPolarHBondContact O-CB 3.23Å; Y632-T636 PolarHBondContact O-N 3.13Å; Y632-T636 PolarHBondContact O-OG1 3.07Å
633	Y	89.2	Confident	90.5	Very high	17 Å²	17	32.7 Å²	32.7	7%	0.067	16%	0.161	C	C	.	.	H	α-helix	trans	-55.6	-44.1	-179.9	177.8	-103.8	0	0	0	112.5	C214 L226 L227 D228 P229 R243 V630 L637	C214-Y633 HydrophobicContact CB-CD2 3.95Å; C214-Y633 HydrophobicContact CB-CE2 4.5Å; L226-Y633 HydrophobicContact CD2-CD2 4.19Å; L226-Y633 HydrophobicContact CD2-CE2 3.55Å; L226-Y633 HydrophobicContact CG-CD2 4.48Å; L226-Y633 HydrophobicContact CG-CE2 3.78Å; L227-Y633 WeakPolarHBondContact O-CE2 3.46Å; D228-Y633 WeakPolarHBondContact CA-OH 3.34Å; D228-Y633 PolarHBondContact OD2-OH 3.29Å; P229-Y633 HydrophobicContact CG-CD1 3.98Å; P229-Y633 HydrophobicContact CG-CD2 4.06Å; P229-Y633 HydrophobicContact CG-CE1 4.47Å; P229-Y633 HydrophobicContact CG-CG 3.76Å; R243-Y633 PolarHBondContact NH2-OH 3.41Å; V630-Y633 VanDerWaalsContact O-CB 3.29Å; V630-Y633 WeakPolarHBondContact O-CB 3.42Å; V630-Y633 PolarHBondContact O-N 3.03Å; Y633-L637 HydrophobicContact CE1-CD2 4.29Å; Y633-L637 WeakPolarHBondContact O-CB 3.4Å; Y633-L637 PolarHBondContact O-N 3.04Å
634	T	90	Very high	90.4	Very high	80 Å²	80	34 Å²	34	49%	0.491	17%	0.17	S	C	.	.	H	α-helix	trans	-61.5	-45.7	179.8	22.4	0	0	0	0	112.4	Y632 Q638	Y632-T634 VanDerWaalsContact C-N 3.3Å; Y632-T634 PolarHBondContact O-N 3.46Å; T634-Q638 WeakPolarHBondContact O-CG 2.98Å; T634-Q638 PolarHBondContact O-N 2.84Å; T634-Q638 VanDerWaalsContact O-N 3.11Å
635	E	88.3	Confident	90.2	Very high	38 Å²	38	36.8 Å²	36.8	18%	0.178	18%	0.182	C	C	.	.	H	α-helix	trans	-71.2	-44.8	-179.3	-70.9	64.9	-148.5	0	0	110.8	H285 Y493 Y632 L637 Q638 V639	H285-E635 HydrophobicContact CB-CB 3.76Å; H285-E635 HydrophobicContact CB-CG 4.2Å; Y493-E635 HydrophobicContact CD1-CG 4.09Å; Y493-E635 HydrophobicContact CE1-CG 3.59Å; Y632-E635 PolarHBondContact O-N 2.94Å; E635-L637 VanDerWaalsContact C-N 3.35Å; E635-L637 PolarHBondContact O-N 3.01Å; E635-Q638 WeakPolarHBondContact O-CB 3.48Å; E635-Q638 PolarHBondContact O-N 3.5Å; E635-V639 WeakPolarHBondContact O-CG2 3.4Å; E635-V639 PolarHBondContact O-N 3.39Å
636	T	91	Very high	89.9	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-62	-41.9	175.1	-78.1	0	0	0	0	111.3	I215 L226 H285 I626 S627 Y632 Q638 V639 I640	I215-T636 HydrophobicContact CD1-CG2 4Å; L226-T636 HydrophobicContact CD1-CG2 4.32Å; H285-T636 PolarHBondContact NE2-OG1 2.92Å; H285-T636 VanDerWaalsContact NE2-OG1 3.09Å; I626-T636 HydrophobicContact CB-CG2 3.88Å; I626-T636 HydrophobicContact CG2-CG2 4.02Å; S627-T636 PolarHBondContact N-OG1 2.93Å; S627-T636 VanDerWaalsContact N-OG1 3.12Å; S627-T636 PolarHBondContact O-OG1 3.05Å; Y632-T636 VanDerWaalsContact O-CB 3.28Å; Y632-T636 WeakPolarHBondContact O-CB 3.23Å; Y632-T636 PolarHBondContact O-N 3.13Å; Y632-T636 PolarHBondContact O-OG1 3.07Å; T636-Q638 VanDerWaalsContact C-N 3.33Å; T636-Q638 PolarHBondContact O-N 2.75Å; T636-V639 PolarHBondContact O-N 2.55Å; T636-I640 HydrophobicContact CG2-CD1 3.59Å; T636-I640 HydrophobicContact CG2-CG1 4.35Å; T636-I640 WeakPolarHBondContact O-CB 3.39Å; T636-I640 VanDerWaalsContact O-CG1 3.25Å; T636-I640 WeakPolarHBondContact O-CG1 3.43Å; T636-I640 PolarHBondContact O-N 2.83Å
637	L	91.4	Very high	89.5	Confident	23 Å²	23	37 Å²	37	12%	0.12	18%	0.183	C	C	.	.	H	α-helix	trans	-60.5	-40.7	173.6	-179.7	62	0	0	0	111.8	L226 Y633 E635 Q641	L226-L637 HydrophobicContact CD2-CB 3.94Å; L226-L637 HydrophobicContact CD2-CD1 3.72Å; L226-L637 HydrophobicContact CD2-CG 4.38Å; Y633-L637 HydrophobicContact CE1-CD2 4.29Å; Y633-L637 WeakPolarHBondContact O-CB 3.4Å; Y633-L637 PolarHBondContact O-N 3.04Å; E635-L637 VanDerWaalsContact C-N 3.35Å; E635-L637 PolarHBondContact O-N 3.01Å; L637-Q641 HydrophobicContact CD1-CG 4.22Å; L637-Q641 WeakPolarHBondContact O-CB 3.21Å; L637-Q641 WeakPolarHBondContact O-CG 3.33Å; L637-Q641 PolarHBondContact O-N 2.72Å
638	Q	90.5	Very high	89.3	Confident	86 Å²	86	42 Å²	42	40%	0.402	20%	0.202	S	C	.	.	H	α-helix	trans	-63.6	-46.4	174.8	-71.5	172.5	37.7	0	0	112.3	L581 T634 E635 T636 I640 Q641 L642	L581-Q638 HydrophobicContact CD2-CB 4.48Å; T634-Q638 WeakPolarHBondContact O-CG 2.98Å; T634-Q638 PolarHBondContact O-N 2.84Å; T634-Q638 VanDerWaalsContact O-N 3.11Å; E635-Q638 WeakPolarHBondContact O-CB 3.48Å; E635-Q638 PolarHBondContact O-N 3.5Å; T636-Q638 VanDerWaalsContact C-N 3.33Å; T636-Q638 PolarHBondContact O-N 2.75Å; Q638-I640 PolarHBondContact O-N 2.93Å; Q638-Q641 PolarHBondContact O-N 3.3Å; Q638-L642 WeakPolarHBondContact O-CB 3.46Å; Q638-L642 PolarHBondContact O-N 2.91Å
639	V	92.6	Very high	88.8	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.006	20%	0.2	C	C	.	.	H	α-helix	trans	-59.8	-46.3	176.9	175.5	0	0	0	0	110.9	L581 A624 I626 E635 T636 L642 A643	L581-V639 HydrophobicContact CD2-CG2 3.8Å; A624-V639 HydrophobicContact CB-CG1 4.07Å; I626-V639 HydrophobicContact CG2-CB 3.95Å; I626-V639 HydrophobicContact CG2-CG1 3.66Å; E635-V639 WeakPolarHBondContact O-CG2 3.4Å; E635-V639 PolarHBondContact O-N 3.39Å; T636-V639 PolarHBondContact O-N 2.55Å; V639-L642 PolarHBondContact O-N 2.85Å; V639-A643 WeakPolarHBondContact O-CB 3.39Å; V639-A643 PolarHBondContact O-N 3.29Å
640	I	93.1	Very high	87.9	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-65.9	-40.7	-179.3	-70.3	172.7	0	0	0	111.3	L196 I224 L226 Y245 F247 I626 T636 Q638 T644	L196-I640 HydrophobicContact CD1-CG1 4.38Å; L196-I640 HydrophobicContact CD2-CG1 4.31Å; I224-I640 HydrophobicContact CG2-CD1 4.07Å; L226-I640 HydrophobicContact CD1-CD1 3.5Å; L226-I640 VanDerWaalsContact CD1-CD1 3.5Å; L226-I640 HydrophobicContact CD2-CD1 4.47Å; Y245-I640 HydrophobicContact CD1-CG2 3.88Å; Y245-I640 HydrophobicContact CD2-CG2 3.35Å; Y245-I640 HydrophobicContact CE1-CG2 4.16Å; Y245-I640 HydrophobicContact CE2-CG2 3.63Å; Y245-I640 HydrophobicContact CG-CG2 3.46Å; Y245-I640 VanDerWaalsContact CG-CG2 3.46Å; F247-I640 HydrophobicContact CE2-CG2 4.45Å; F247-I640 HydrophobicContact CZ-CG2 4.12Å; I626-I640 HydrophobicContact CD1-CD1 4.02Å; I626-I640 HydrophobicContact CD1-CG1 4.41Å; I626-I640 HydrophobicContact CG2-CD1 4.35Å; I626-I640 HydrophobicContact CG2-CG1 3.95Å; T636-I640 HydrophobicContact CG2-CD1 3.59Å; T636-I640 HydrophobicContact CG2-CG1 4.35Å; T636-I640 WeakPolarHBondContact O-CB 3.39Å; T636-I640 VanDerWaalsContact O-CG1 3.25Å; T636-I640 WeakPolarHBondContact O-CG1 3.43Å; T636-I640 PolarHBondContact O-N 2.83Å; Q638-I640 PolarHBondContact O-N 2.93Å; I640-T644 VanDerWaalsContact O-CB 3.22Å; I640-T644 WeakPolarHBondContact O-CB 3.4Å; I640-T644 PolarHBondContact O-N 2.81Å; I640-T644 PolarHBondContact O-OG1 3.23Å
641	Q	92.6	Very high	86.6	Confident	91 Å²	91	45.2 Å²	45.2	43%	0.425	21%	0.206	S	C	.	.	H	α-helix	trans	-63.9	-45.7	175.4	-75.7	175.2	9.6	0	0	111.9	L637 Q638 T644 E645	L637-Q641 HydrophobicContact CD1-CG 4.22Å; L637-Q641 WeakPolarHBondContact O-CB 3.21Å; L637-Q641 WeakPolarHBondContact O-CG 3.33Å; L637-Q641 PolarHBondContact O-N 2.72Å; Q638-Q641 PolarHBondContact O-N 3.3Å; Q641-T644 WeakPolarHBondContact O-CB 3.43Å; Q641-T644 PolarHBondContact O-N 2.8Å; Q641-E645 PolarHBondContact O-N 2.86Å
642	L	90.7	Very high	85.2	Confident	20 Å²	20	43.9 Å²	43.9	11%	0.105	20%	0.195	C	C	.	.	H	α-helix	trans	-59.9	-51.9	176.5	174.4	57.4	0	0	0	111.5	I283 G585 L589 Q638 V639 T644 E645 I646	I283-L642 HydrophobicContact CD1-CD2 4.04Å; I283-L642 HydrophobicContact CD1-CG 4.27Å; G585-L642 VanDerWaalsContact CA-CD1 3.42Å; G585-L642 VanDerWaalsContact CA-CD2 3.48Å; L589-L642 HydrophobicContact CD1-CD1 4.02Å; L589-L642 HydrophobicContact CG-CD1 4.12Å; Q638-L642 WeakPolarHBondContact O-CB 3.46Å; Q638-L642 PolarHBondContact O-N 2.91Å; V639-L642 PolarHBondContact O-N 2.85Å; L642-T644 PolarHBondContact O-N 2.86Å; L642-E645 PolarHBondContact O-N 3.23Å; L642-I646 HydrophobicContact CD1-CD1 3.89Å; L642-I646 HydrophobicContact CD1-CG1 4.27Å; L642-I646 HydrophobicContact CG-CD1 4.07Å; L642-I646 WeakPolarHBondContact O-CG1 3.49Å; L642-I646 PolarHBondContact O-N 2.89Å; L642-I646 VanDerWaalsContact O-N 3.07Å
643	A	92.2	Very high	83.6	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-59.9	-34.9	177.3	0	0	0	0	0	112	I194 F247 A624 V639 N647	I194-A643 HydrophobicContact CG2-CB 4.18Å; F247-A643 HydrophobicContact CE1-CB 3.7Å; F247-A643 HydrophobicContact CZ-CB 4.43Å; A624-A643 HydrophobicContact CB-CB 3.92Å; V639-A643 WeakPolarHBondContact O-CB 3.39Å; V639-A643 PolarHBondContact O-N 3.29Å; A643-N647 WeakPolarHBondContact O-CB 3.34Å; A643-N647 PolarHBondContact O-N 2.9Å
644	T	91.5	Very high	81.6	Confident	29 Å²	29	48.1 Å²	48.1	18%	0.178	22%	0.218	C	C	.	.	H	α-helix	trans	-67.7	-43.9	176.7	-63.5	0	0	0	0	112.8	Y245 F247 I640 Q641 L642 N647 R648	Y245-T644 HydrophobicContact CD1-CG2 3.97Å; Y245-T644 VanDerWaalsContact CD1-OG1 3.23Å; Y245-T644 WeakPolarHBondContact CD1-OG1 3.27Å; Y245-T644 HydrophobicContact CE1-CG2 4.38Å; F247-T644 WeakPolarHBondContact CZ-OG1 3.44Å; I640-T644 VanDerWaalsContact O-CB 3.22Å; I640-T644 WeakPolarHBondContact O-CB 3.4Å; I640-T644 PolarHBondContact O-N 2.81Å; I640-T644 PolarHBondContact O-OG1 3.23Å; Q641-T644 WeakPolarHBondContact O-CB 3.43Å; Q641-T644 PolarHBondContact O-N 2.8Å; L642-T644 PolarHBondContact O-N 2.86Å; T644-N647 WeakPolarHBondContact O-CB 3.41Å; T644-N647 PolarHBondContact O-N 2.87Å; T644-R648 WeakPolarHBondContact O-CG 3.37Å; T644-R648 PolarHBondContact O-N 3Å
645	E	90.5	Very high	79	Confident	57 Å²	57	50.8 Å²	50.8	27%	0.266	23%	0.227	S	C	.	.	H	α-helix	trans	-70.9	-35.8	178	-174.8	56.8	-159	0	0	111.3	L589 Q641 L642 N647 R648 L649 R652	L589-E645 HydrophobicContact CD2-CB 4.31Å; L589-E645 HydrophobicContact CD2-CG 4.01Å; Q641-E645 PolarHBondContact O-N 2.86Å; L642-E645 PolarHBondContact O-N 3.23Å; E645-N647 VanDerWaalsContact C-N 3.29Å; E645-N647 PolarHBondContact O-N 3.11Å; E645-R648 CarbonylContact O-C 3.4Å; E645-R648 WeakPolarHBondContact O-CA 3.47Å; E645-R648 WeakPolarHBondContact O-CB 3.46Å; E645-R648 PolarHBondContact O-N 3.27Å; E645-R648 VanDerWaalsContact OE2-CD 3.29Å; E645-R648 WeakPolarHBondContact OE2-CD 3.43Å; E645-R648 IonicContact OE2-CZ 3.89Å; E645-R648 IonicContact OE2-NE 3.11Å; E645-R648 PolarHBondContact OE2-NE 3.25Å; E645-R648 IonicContact OE2-NH2 3.92Å; E645-L649 WeakPolarHBondContact O-CG 3.3Å; E645-L649 PolarHBondContact O-N 2.91Å; E645-R652 IonicContact OE1-CZ 2.68Å; E645-R652 IonicContact OE1-NH1 2.74Å; E645-R652 PolarHBondContact OE1-NH1 2.88Å; E645-R652 IonicContact OE1-NH2 2.8Å
646	I	87.7	Confident	76.7	Confident	3 Å²	3	54.5 Å²	54.5	2%	0.015	25%	0.246	C	C	.	.	H	α-helix	trans	-60.6	-39.9	171.6	-58.2	166.4	0	0	0	110.7	I194 L588 L589 L592 I622 L642 R648 L649 R650	I194-I646 HydrophobicContact CD1-CB 4.06Å; I194-I646 HydrophobicContact CD1-CG2 3.91Å; L588-I646 HydrophobicContact CB-CD1 4.45Å; L589-I646 HydrophobicContact CD2-CG1 3.65Å; L589-I646 HydrophobicContact CG-CG1 4.34Å; L592-I646 HydrophobicContact CD1-CG2 3.5Å; I622-I646 HydrophobicContact CD1-CD1 3.85Å; I622-I646 HydrophobicContact CD1-CG2 3.85Å; L642-I646 HydrophobicContact CD1-CD1 3.89Å; L642-I646 HydrophobicContact CD1-CG1 4.27Å; L642-I646 HydrophobicContact CG-CD1 4.07Å; L642-I646 WeakPolarHBondContact O-CG1 3.49Å; L642-I646 PolarHBondContact O-N 2.89Å; L642-I646 VanDerWaalsContact O-N 3.07Å; I646-R648 VanDerWaalsContact C-N 3.33Å; I646-R648 PolarHBondContact O-N 2.69Å; I646-L649 WeakPolarHBondContact O-CB 3.35Å; I646-L649 PolarHBondContact O-N 2.94Å; I646-R650 PolarHBondContact O-N 3.04Å
647	N	84.9	Confident	74.1	Confident	2 Å²	2	59 Å²	59	1%	0.011	27%	0.271	C	S	.	.	H	α-helix	trans	-60.6	-41	172.5	-164.6	-30.3	0	0	0	111.9	I194 K246 A643 T644 E645 R650 R651	I194-N647 HydrophobicContact CD1-CB 3.78Å; K246-N647 PolarHBondContact O-ND2 2.94Å; A643-N647 WeakPolarHBondContact O-CB 3.34Å; A643-N647 PolarHBondContact O-N 2.9Å; T644-N647 WeakPolarHBondContact O-CB 3.41Å; T644-N647 PolarHBondContact O-N 2.87Å; E645-N647 VanDerWaalsContact C-N 3.29Å; E645-N647 PolarHBondContact O-N 3.11Å; N647-R650 WeakPolarHBondContact O-CB 3.49Å; N647-R650 PolarHBondContact O-N 3.29Å; N647-R651 PolarHBondContact ND2-NH2 3.47Å; N647-R651 PolarHBondContact O-N 3.38Å; N647-R651 PolarHBondContact OD1-NE 3.39Å; N647-R651 PolarHBondContact OD1-NH2 3.38Å
648	R	83.3	Confident	71.4	Confident	107 Å²	107	63 Å²	63	40%	0.404	29%	0.289	S	S	.	.	H	α-helix	trans	-66.2	-37.1	176.4	-74.3	162.1	54.7	99.4	-15.9	112.6	T644 E645 I646 R650 R651 R652	T644-R648 WeakPolarHBondContact O-CG 3.37Å; T644-R648 PolarHBondContact O-N 3Å; E645-R648 CarbonylContact O-C 3.4Å; E645-R648 WeakPolarHBondContact O-CA 3.47Å; E645-R648 WeakPolarHBondContact O-CB 3.46Å; E645-R648 PolarHBondContact O-N 3.27Å; E645-R648 VanDerWaalsContact OE2-CD 3.29Å; E645-R648 WeakPolarHBondContact OE2-CD 3.43Å; E645-R648 IonicContact OE2-CZ 3.89Å; E645-R648 IonicContact OE2-NE 3.11Å; E645-R648 PolarHBondContact OE2-NE 3.25Å; E645-R648 IonicContact OE2-NH2 3.92Å; I646-R648 VanDerWaalsContact C-N 3.33Å; I646-R648 PolarHBondContact O-N 2.69Å; R648-R650 VanDerWaalsContact C-N 3.32Å; R648-R650 PolarHBondContact O-N 3Å; R648-R651 PolarHBondContact O-N 3.3Å; R648-R652 PolarHBondContact O-N 3.39Å
649	L	78.2	Confident	68.9	Low	26 Å²	26	64.2 Å²	64.2	14%	0.136	30%	0.297	C	S	.	.	H	α-helix	trans	-56.4	-45.4	173.1	-65.4	-175.4	0	0	0	111.9	L589 L592 T593 E645 I646 R651 R652 K653	L589-L649 HydrophobicContact CD2-CD1 3.62Å; L589-L649 HydrophobicContact CD2-CG 4.27Å; L592-L649 HydrophobicContact CB-CD1 4.31Å; T593-L649 HydrophobicContact CG2-CD1 3.61Å; T593-L649 HydrophobicContact CG2-CD2 3.46Å; T593-L649 VanDerWaalsContact CG2-CD2 3.46Å; T593-L649 HydrophobicContact CG2-CG 4.12Å; E645-L649 WeakPolarHBondContact O-CG 3.3Å; E645-L649 PolarHBondContact O-N 2.91Å; I646-L649 WeakPolarHBondContact O-CB 3.35Å; I646-L649 PolarHBondContact O-N 2.94Å; L649-R651 VanDerWaalsContact C-N 3.35Å; L649-R651 PolarHBondContact O-N 3.28Å; L649-R652 PolarHBondContact O-N 3.35Å; L649-K653 PolarHBondContact O-N 3.26Å
650	R	68	Low	66.2	Low	34 Å²	34	65.6 Å²	65.6	13%	0.128	31%	0.311	C	S	.	.	H	α-helix	trans	-57.6	-45.8	-179.2	-166.8	-176.7	85.4	-168.7	-3.4	112.6	N192 D248 I646 N647 R648 R652 K653 I654	N192-R650 WeakPolarHBondContact O-CD 3.1Å; N192-R650 PolarHBondContact O-NH1 3.04Å; D248-R650 IonicContact OD1-CZ 2.72Å; D248-R650 VanDerWaalsContact OD1-CZ 3.27Å; D248-R650 IonicContact OD1-NH1 3.59Å; D248-R650 PolarHBondContact OD1-NH1 3.29Å; D248-R650 IonicContact OD1-NH2 3.81Å; D248-R650 PolarHBondContact OD1-NH2 3.03Å; D248-R650 IonicContact OD2-CZ 3.75Å; D248-R650 IonicContact OD2-NH1 3.9Å; D248-R650 PolarHBondContact OD2-NH1 3.35Å; D248-R650 IonicContact OD2-NH2 3.59Å; I646-R650 PolarHBondContact O-N 3.04Å; N647-R650 WeakPolarHBondContact O-CB 3.49Å; N647-R650 PolarHBondContact O-N 3.29Å; R648-R650 VanDerWaalsContact C-N 3.32Å; R648-R650 PolarHBondContact O-N 3Å; R650-R652 VanDerWaalsContact C-N 3.32Å; R650-R652 PolarHBondContact O-N 3.43Å; R650-K653 PolarHBondContact O-N 2.98Å; R650-I654 HydrophobicContact CG-CD1 4.32Å; R650-I654 PolarHBondContact O-N 3.25Å
651	R	60.7	Low	63.5	Low	125 Å²	125	70.2 Å²	70.2	47%	0.472	34%	0.339	S	S	.	.	H	α-helix	trans	-62.3	-38.8	-178.4	-59.6	175.3	-158	-164.4	6.2	111.5	N647 R648 L649 M655	N647-R651 PolarHBondContact ND2-NH2 3.47Å; N647-R651 PolarHBondContact O-N 3.38Å; N647-R651 PolarHBondContact OD1-NE 3.39Å; N647-R651 PolarHBondContact OD1-NH2 3.38Å; R648-R651 PolarHBondContact O-N 3.3Å; L649-R651 VanDerWaalsContact C-N 3.35Å; L649-R651 PolarHBondContact O-N 3.28Å; R651-M655 PolarHBondContact O-N 3.37Å
652	R	56.1	Low	60.7	Low	114 Å²	114	73 Å²	73	43%	0.43	36%	0.356	S	S	.	.	H	α-helix	trans	-63.2	-44.3	175.6	-65	175.6	-178.4	131.1	-4.4	112.1	E645 R648 L649 R650 I654 M655 I656	E645-R652 IonicContact OE1-CZ 2.68Å; E645-R652 IonicContact OE1-NH1 2.74Å; E645-R652 PolarHBondContact OE1-NH1 2.88Å; E645-R652 IonicContact OE1-NH2 2.8Å; R648-R652 PolarHBondContact O-N 3.39Å; L649-R652 PolarHBondContact O-N 3.35Å; R650-R652 VanDerWaalsContact C-N 3.32Å; R650-R652 PolarHBondContact O-N 3.43Å; R652-I654 PolarHBondContact O-N 3.4Å; R652-M655 PolarHBondContact O-N 2.98Å; R652-I656 WeakPolarHBondContact O-CG1 3.4Å; R652-I656 PolarHBondContact O-N 3.42Å; R652-I656 VanDerWaalsContact O-N 3.14Å
653	K	52.6	Low	58.1	Low	107 Å²	107	76.7 Å²	76.7	47%	0.465	38%	0.38	S	S	.	.	H	α-helix	trans	-63.2	-39.3	-178.6	-159.4	172.4	-175.4	177.5	0	112.3	L649 R650 N657	L649-K653 PolarHBondContact O-N 3.26Å; R650-K653 PolarHBondContact O-N 2.98Å; K653-N657 PolarHBondContact O-N 3.45Å
654	I	48.6	Very low	55.3	Low	68 Å²	68	83.6 Å²	83.6	35%	0.349	41%	0.41	S	S	.	.	H	α-helix	trans	-67	-44.7	176.6	-65.2	169.2	0	0	0	111.5	R650 R652 I656 N657 H658	R650-I654 HydrophobicContact CG-CD1 4.32Å; R650-I654 PolarHBondContact O-N 3.25Å; R652-I654 PolarHBondContact O-N 3.4Å; I654-I656 PolarHBondContact O-N 2.83Å; I654-N657 PolarHBondContact O-N 3.05Å; I654-H658 PolarHBondContact O-CD2 3.26Å; I654-H658 PolarHBondContact O-N 3.11Å
655	M	34.7	Very low	52.3	Low	136 Å²	136	89.4 Å²	89.4	67%	0.67	44%	0.44	S	S	*	.	H	α-helix	trans	-61.8	-42.3	178	-78.8	-172.4	164.1	0	0	113.1	R651 R652 N657 H658 I659	R651-M655 PolarHBondContact O-N 3.37Å; R652-M655 PolarHBondContact O-N 2.98Å; M655-N657 VanDerWaalsContact C-N 3.34Å; M655-N657 PolarHBondContact O-N 2.66Å; M655-H658 PolarHBondContact O-N 3.17Å; M655-I659 WeakPolarHBondContact O-CG1 3.37Å; M655-I659 PolarHBondContact O-N 3.07Å; M655-I659 VanDerWaalsContact O-N 3.15Å
656	I	39.7	Very low	49.4	Very low	115 Å²	115	97.8 Å²	97.8	59%	0.59	47%	0.469	S	S	*	.	H	α-helix	trans	-61.8	-42.6	179.8	-68.3	165.8	0	0	0	111.1	R652 I654 I659 G660	R652-I656 WeakPolarHBondContact O-CG1 3.4Å; R652-I656 PolarHBondContact O-N 3.42Å; R652-I656 VanDerWaalsContact O-N 3.14Å; I654-I656 PolarHBondContact O-N 2.83Å; I656-I659 PolarHBondContact O-N 3.45Å; I656-G660 PolarHBondContact O-N 2.66Å
657	N	36.2	Very low	46.5	Very low	96 Å²	96	106.6 Å²	106.6	51%	0.513	51%	0.51	S	S	.	.	H	α-helix	trans	-64.5	-43.1	179.8	-74	-1.4	0	0	0	112.3	K653 I654 M655 I659 G660 T661	K653-N657 PolarHBondContact O-N 3.45Å; I654-N657 PolarHBondContact O-N 3.05Å; M655-N657 VanDerWaalsContact C-N 3.34Å; M655-N657 PolarHBondContact O-N 2.66Å; N657-I659 VanDerWaalsContact C-N 3.34Å; N657-I659 PolarHBondContact O-N 2.95Å; N657-G660 PolarHBondContact O-N 3.44Å; N657-T661 PolarHBondContact O-N 2.89Å; N657-T661 PolarHBondContact O-OG1 3.22Å
658	H	35.6	Very low	43.8	Very low	107 Å²	107	114.6 Å²	114.6	50%	0.495	55%	0.552	S	S	.	*	H	α-helix	trans	-64.9	-35	177.2	-79.5	-61.1	0	0	0	113.3	I654 M655 T661	I654-H658 PolarHBondContact O-CD2 3.26Å; I654-H658 PolarHBondContact O-N 3.11Å; M655-H658 PolarHBondContact O-N 3.17Å; H658-T661 WeakPolarHBondContact CA-OG1 3.2Å; H658-T661 PolarHBondContact O-OG1 3.15Å
659	I	38.5	Very low	41.1	Very low	111 Å²	111	114.8 Å²	114.8	57%	0.569	57%	0.57	S	S	*	*	H	α-helix	trans	-66.6	-43.8	172.9	-66.4	165.7	0	0	0	110.2	M655 I656 N657 T661 L662	M655-I659 WeakPolarHBondContact O-CG1 3.37Å; M655-I659 PolarHBondContact O-N 3.07Å; M655-I659 VanDerWaalsContact O-N 3.15Å; I656-I659 PolarHBondContact O-N 3.45Å; N657-I659 VanDerWaalsContact C-N 3.34Å; N657-I659 PolarHBondContact O-N 2.95Å; I659-T661 VanDerWaalsContact C-N 3.34Å; I659-T661 PolarHBondContact O-N 3.22Å; I659-L662 PolarHBondContact O-N 2.65Å; I659-L662 VanDerWaalsContact O-N 3.1Å
660	G	35	Very low	38.6	Very low	30 Å²	30	121.6 Å²	121.6	31%	0.309	61%	0.605	S	S	.	*	H	α-helix	trans	-60.9	-36.4	178.1	0	0	0	0	0	114.2	I656 N657 L662 T663	I656-G660 PolarHBondContact O-N 2.66Å; N657-G660 PolarHBondContact O-N 3.44Å; G660-L662 VanDerWaalsContact C-N 3.28Å; G660-L662 PolarHBondContact O-N 3.15Å; G660-T663 PolarHBondContact O-N 3.11Å; G660-T663 PolarHBondContact O-OG1 3.25Å
661	T	37.2	Very low	36.8	Very low	96 Å²	96	125.5 Å²	125.5	59%	0.589	64%	0.635	S	S	*	*	H	α-helix	trans	-67.8	-24.6	174.9	43	0	0	0	0	113.8	N657 H658 I659 T663	N657-T661 PolarHBondContact O-N 2.89Å; N657-T661 PolarHBondContact O-OG1 3.22Å; H658-T661 WeakPolarHBondContact CA-OG1 3.2Å; H658-T661 PolarHBondContact O-OG1 3.15Å; I659-T661 VanDerWaalsContact C-N 3.34Å; I659-T661 PolarHBondContact O-N 3.22Å; T661-T663 VanDerWaalsContact C-N 3.33Å
662	L	33.6	Very low	35	Very low	149 Å²	149	127.9 Å²	127.9	78%	0.78	66%	0.656	S	S	*	*	H	α-helix	trans	-82.5	-9.5	175.7	-77.2	164.2	0	0	0	113.5	I659 G660	I659-L662 PolarHBondContact O-N 2.65Å; I659-L662 VanDerWaalsContact O-N 3.1Å; G660-L662 VanDerWaalsContact C-N 3.28Å; G660-L662 PolarHBondContact O-N 3.15Å
663	T	36.1	Very low	33.7	Very low	98 Å²	98	128.7 Å²	128.7	60%	0.601	67%	0.674	S	S	*	*	H	α-helix	trans	-104	-14	-178.9	48.3	0	0	0	0	115.4	G660 T661	G660-T663 PolarHBondContact O-N 3.11Å; G660-T663 PolarHBondContact O-OG1 3.25Å; T661-T663 VanDerWaalsContact C-N 3.33Å
664	K	33.3	Very low	32.5	Very low	145 Å²	145	130.8 Å²	130.8	63%	0.63	69%	0.69	S	S	*	*	S	Bend	trans	-83.9	-8.7	-178.4	-81.1	-166	173.6	-172.9	0	115.7
665	N	28.3	Very low	31.3	Very low	152 Å²	152	134 Å²	134	81%	0.813	71%	0.708	S	S	*	*	S	Bend	trans	-107.5	41.8	-178.7	-71.5	3.4	0	0	0	112.9
666	R	28.9	Very low	30.9	Very low	232 Å²	232	133.3 Å²	133.3	88%	0.875	71%	0.711	S	S	*	*			trans	-155.4	40.3	-179.5	-134.7	173.7	-171.1	141.9	2.4	117
667	E	26.8	Very low	30.1	Very low	188 Å²	188	133 Å²	133	88%	0.879	72%	0.719	S	S	*	*			trans	-128	93.2	166.4	-70.6	-169.4	156.8	0	0	111.2
668	L	29	Very low	29.8	Very low	171 Å²	171	137.5 Å²	137.5	90%	0.895	73%	0.734	S	S	*	*	S	Bend	trans	-166.4	139.7	149.4	-106	163.1	0	0	0	107.7
669	S	26.1	Very low	29.3	Very low	111 Å²	111	136 Å²	136	78%	0.776	74%	0.736	S	S	*	*			trans	44.2	103.9	-178.8	60.1	0	0	0	0	118.1
670	L	26.3	Very low	28.7	Very low	168 Å²	168	139.3 Å²	139.3	88%	0.88	75%	0.749	S	S	*	*				-159.2	133.8	121.7	-100	175.3	0	0	0	107.9
671	P	28.9	Very low	28.4	Very low	117 Å²	117	146 Å²	146	76%	0.76	77%	0.772	S	S	*	*			trans	-75.7	159.8	-173.7	31	-35.2	0	0	0	113
672	L	23.6	Very low	28	Very low	174 Å²	174	149.5 Å²	149.5	91%	0.911	78%	0.782	S	S	*	*			trans	-95.3	105.8	175.3	-79.5	166.5	0	0	0	111
673	T	29.8	Very low	28	Very low	132 Å²	132	150.2 Å²	150.2	81%	0.81	79%	0.785	S	S	*	*			trans	-134	149.7	155.2	34	0	0	0	0	111.5
674	L	25.9	Very low	27.8	Very low	150 Å²	150	148.5 Å²	148.5	79%	0.785	79%	0.786	S	S	*	*			trans	-65.2	164.4	171.3	-54.2	105.5	0	0	0	109.4
675	N	24.5	Very low	27.6	Very low	136 Å²	136	147.3 Å²	147.3	73%	0.727	80%	0.797	S	S	*	*			cis	-161.9	-172.4	29.8	-139.2	-15.7	0	0	0	113.2
676	T	25	Very low	27.5	Very low	122 Å²	122	144.9 Å²	144.9	75%	0.748	79%	0.791	S	S	*	*			trans	-44.4	138	160	48.6	0	0	0	0	112.1
677	S	24.7	Very low	27.6	Very low	107 Å²	107	139.3 Å²	139.3	75%	0.748	78%	0.783	S	S	*	*				-171.5	173.8	62.7	60.5	0	0	0	0	112.4
678	K	28.8	Very low	27.6	Very low	191 Å²	191	135.2 Å²	135.2	83%	0.83	78%	0.776	S	S	*	*				-171.5	139.1	111.1	-98.8	-172.7	-179.9	-170.6	0	112.6
679	S	25.1	Very low	27.6	Very low	77 Å²	77	133.5 Å²	133.5	54%	0.538	77%	0.767	S	S	.	*			trans	164.6	126.7	156.3	58.6	0	0	0	0	104.7	K702	S679-K702 PolarHBondContact OG-NZ 2.82Å
680	Q	27.1	Very low	27.8	Very low	179 Å²	179	134.4 Å²	134.4	84%	0.836	76%	0.763	S	S	*	*			cis	-121	-170.1	21.9	-73.6	150.1	-116.9	0	0	112.7
681	E	27.7	Very low	27.8	Very low	171 Å²	171	131.3 Å²	131.3	80%	0.799	75%	0.751	S	S	*	*			trans	-61.9	156.2	164.9	-65.5	98.7	151.8	0	0	114.3
682	E	29.1	Very low	27.8	Very low	169 Å²	169	130.4 Å²	130.4	79%	0.79	74%	0.74	S	S	*	*			trans	10.1	127.3	147.6	-69.9	169.6	176.8	0	0	123
683	I	33.9	Very low	28.3	Very low	164 Å²	164	125 Å²	125	84%	0.841	71%	0.712	S	S	*	*				75.5	132.8	129.8	-59.2	168.3	0	0	0	119.6
684	G	32.1	Very low	28.3	Very low	62 Å²	62	123.1 Å²	123.1	64%	0.639	70%	0.697	S	S	*	*			trans	90.1	118.8	174	0	0	0	0	0	113.5
685	S	27.5	Very low	28.6	Very low	121 Å²	121	122.2 Å²	122.2	85%	0.846	69%	0.692	S	S	*	*			cis	56.7	119.9	29.7	80.8	0	0	0	0	114.1
686	S	26.4	Very low	28.8	Very low	100 Å²	100	123.1 Å²	123.1	70%	0.699	69%	0.69	S	S	*	*			cis	-160.4	-171.8	6.9	56.5	0	0	0	0	113
687	T	32.6	Very low	29.2	Very low	116 Å²	116	124.7 Å²	124.7	71%	0.712	69%	0.689	S	S	*	*			trans	65.7	97.1	149.9	38.4	0	0	0	0	120.6
688	S	25.2	Very low	29.4	Very low	102 Å²	102	129.8 Å²	129.8	71%	0.713	69%	0.692	S	S	*	*				70.7	143.1	119.1	62.9	0	0	0	0	123.4
689	N	29.3	Very low	29.3	Very low	134 Å²	134	127.1 Å²	127.1	72%	0.717	69%	0.686	S	S	*	*			trans	90.3	116.5	156.8	-66.4	12.6	0	0	0	120.5
690	D	29.6	Very low	29.4	Very low	130 Å²	130	131.4 Å²	131.4	70%	0.695	70%	0.698	S	S	*	*			trans	71.6	138.2	135.3	-55	-35.4	0	0	0	124
691	T	28.2	Very low	29.4	Very low	103 Å²	103	128 Å²	128	63%	0.632	69%	0.693	S	S	*	*			trans	53.4	93	151.4	51.2	0	0	0	0	119.4
692	D	28.7	Very low	29.4	Very low	98 Å²	98	127.1 Å²	127.1	52%	0.524	69%	0.687	S	S	.	*				155.3	151.2	87	-86.1	-7.6	0	0	0	117.2	R759	D692-R759 WeakPolarHBondContact OD1-CD 3.35Å; D692-R759 IonicContact OD1-CZ 3.37Å; D692-R759 IonicContact OD1-NE 3.32Å; D692-R759 PolarHBondContact OD1-NE 3.26Å; D692-R759 IonicContact OD1-NH1 3.37Å; D692-R759 PolarHBondContact OD1-NH1 3.26Å; D692-R759 IonicContact OD1-NH2 2.58Å; D692-R759 PolarHBondContact OD1-NH2 3.39Å; D692-R759 IonicContact OD2-CZ 2.9Å; D692-R759 IonicContact OD2-NE 3.97Å; D692-R759 IonicContact OD2-NH1 3.85Å; D692-R759 PolarHBondContact OD2-NH1 3.45Å; D692-R759 IonicContact OD2-NH2 3.7Å; D692-R759 PolarHBondContact OD2-NH2 3.47Å
693	N	32.3	Very low	29.3	Very low	60 Å²	60	129.7 Å²	129.7	32%	0.321	69%	0.691	S	S	.	*			trans	42.1	108.9	160.7	-67.9	16.4	0	0	0	121.7	D757 R759	N693-D757 WeakPolarHBondContact ND2-CB 3.2Å; N693-D757 PolarHBondContact ND2-OD2 3.4Å; N693-R759 VanDerWaalsContact OD1-CZ 3.24Å; N693-R759 PolarHBondContact OD1-NE 3.32Å; N693-R759 PolarHBondContact OD1-NH2 3.15Å
694	D	31.3	Very low	28.9	Very low	93 Å²	93	129.2 Å²	129.2	50%	0.497	69%	0.69	S	S	.	*				72.7	94.8	122.3	-66.9	-72.1	0	0	0	121.3
695	L	31.2	Very low	28.7	Very low	131 Å²	131	134.4 Å²	134.4	69%	0.686	70%	0.697	S	S	*	*				50.8	94	109.7	-83.4	60.6	0	0	0	116.1
696	F	29.4	Very low	28.8	Very low	156 Å²	156	140.7 Å²	140.7	68%	0.684	70%	0.702	S	S	*	*				71.1	121.9	83.7	-76.7	-68.3	0	0	0	112.2
697	H	32.4	Very low	28.7	Very low	154 Å²	154	147 Å²	147	71%	0.713	71%	0.711	S	S	*	*			cis	-137.5	122.7	28.3	-101.4	-72.7	0	0	0	116
698	R	29.6	Very low	28.8	Very low	215 Å²	215	147.7 Å²	147.7	81%	0.811	72%	0.717	S	S	*	*			trans	47.5	106.9	140.4	-79.5	-172.7	166.3	153.7	-0.8	120.3
699	N	25.8	Very low	29	Very low	135 Å²	135	154.5 Å²	154.5	72%	0.722	73%	0.727	S	S	*	*			trans	-54.8	145	145.8	-90.5	-62.7	0	0	0	113.8
700	Q	28.1	Very low	29	Very low	167 Å²	167	156.6 Å²	156.6	78%	0.78	74%	0.738	S	S	*	*			trans	56.2	148	130	-58.7	177	55.9	0	0	123.4
701	S	26.6	Very low	29.1	Very low	106 Å²	106	153.9 Å²	153.9	74%	0.741	74%	0.74	S	S	*	*			trans	66.9	112.3	150.4	-156	0	0	0	0	119.9
702	K	28.9	Very low	29.2	Very low	153 Å²	153	157 Å²	157	67%	0.665	74%	0.74	S	S	*	*				-154.9	134.2	99.7	-102.2	172.1	-172.1	-173.8	0	110.8	S679	S679-K702 PolarHBondContact OG-NZ 2.82Å
703	Y	26.1	Very low	29.1	Very low	224 Å²	224	159.4 Å²	159.4	88%	0.878	75%	0.753	S	S	*	*			trans	-76	128.3	160	-86.8	-100.5	0	0	0	108.2
704	L	25.9	Very low	28.8	Very low	154 Å²	154	161.3 Å²	161.3	81%	0.806	77%	0.77	S	S	*	*				174.2	155.7	128.2	-91	166.6	0	0	0	110.6
705	H	28.1	Very low	28.7	Very low	171 Å²	171	168 Å²	168	79%	0.792	79%	0.79	S	S	*	*			trans	-23.3	129.9	-173.1	-53.3	-76.3	0	0	0	119.9
706	R	28.4	Very low	28.5	Very low	252 Å²	252	166.1 Å²	166.1	95%	0.951	79%	0.793	S	S	*	*			trans	-146.6	147.7	132.1	-110.5	166.8	-155.1	-137.2	1.4	112
707	R	25.3	Very low	28.3	Very low	233 Å²	233	169.4 Å²	169.4	88%	0.879	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-75.6	140.4	-175.1	-55.3	170.9	-176.5	168.7	-0.8	110.4	R709	R707-R709 PolarHBondContact O-N 2.86Å
708	P	34.4	Very low	28.1	Very low	131 Å²	131	167 Å²	167	85%	0.851	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-65.7	118.8	163.1	-14.7	29.3	0	0	0	109.4
709	R	29.6	Very low	28.1	Very low	244 Å²	244	164.7 Å²	164.7	92%	0.921	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-81.4	133.9	167.2	-88.8	-179.3	163.5	152.4	-6	109	R707 G711	R707-R709 PolarHBondContact O-N 2.86Å; R709-G711 PolarHBondContact O-N 3.39Å
710	L	29.9	Very low	28	Very low	179 Å²	179	161.3 Å²	161.3	94%	0.937	80%	0.802	S	S	*	*			trans	-73	113.6	169.6	-81.3	159.1	0	0	0	109.9
711	G	31.1	Very low	28	Very low	73 Å²	73	159.2 Å²	159.2	75%	0.753	81%	0.805	S	S	*	*			trans	-77.2	159.1	157.5	0	0	0	0	0	110.5	R709	R709-G711 PolarHBondContact O-N 3.39Å
712	R	29.9	Very low	27.8	Very low	167 Å²	167	159.7 Å²	159.7	63%	0.63	81%	0.808	S	S	*	*			trans	-132.6	136.7	-164.5	-159.2	-163.6	179.6	-142.7	-1.3	112.6
713	L	27.8	Very low	27.6	Very low	150 Å²	150	156.4 Å²	156.4	79%	0.785	80%	0.804	S	S	*	*			trans	65.7	160.1	178.5	-93.5	66.7	0	0	0	113.6
714	S	26.1	Very low	27.6	Very low	99 Å²	99	151.6 Å²	151.6	69%	0.692	80%	0.803	S	S	*	*			cis	-134	154.4	21.3	49.8	0	0	0	0	114.7
715	Y	28.1	Very low	27.6	Very low	235 Å²	235	150.2 Å²	150.2	92%	0.922	79%	0.792	S	S	*	*			trans	-172.3	105	145.9	-108.3	-66.4	0	0	0	110.1
716	A	26.2	Very low	27.6	Very low	90 Å²	90	149.5 Å²	149.5	74%	0.744	79%	0.793	S	S	*	*			trans	-171.6	136.4	167.2	0	0	0	0	0	110.1
717	R	27.1	Very low	27.5	Very low	226 Å²	226	143.9 Å²	143.9	85%	0.853	78%	0.782	S	S	*	*			trans	68.4	142.5	-169.2	-52.8	-178.5	-177.7	-137.8	-3.1	112.3
718	S	27.9	Very low	27.6	Very low	104 Å²	104	139.2 Å²	139.2	73%	0.727	78%	0.784	S	S	*	*			cis	-168.9	159.6	-7.6	-95.8	0	0	0	0	106.5
719	L	28.6	Very low	27.2	Very low	165 Å²	165	139.9 Å²	139.9	86%	0.864	79%	0.786	S	S	*	*			cis	-149.5	-179.6	-5.4	-100.2	166.5	0	0	0	105.7
720	G	24.6	Very low	27.3	Very low	64 Å²	64	133.8 Å²	133.8	66%	0.66	78%	0.781	S	S	*	*			cis	119	71.6	-3.3	0	0	0	0	0	115.1
721	S	27.1	Very low	27.1	Very low	123 Å²	123	131 Å²	131	86%	0.86	78%	0.776	S	S	*	*			trans	-153.4	178.8	166.5	-146.4	0	0	0	0	111.6
722	C	23.3	Very low	27	Very low	117 Å²	117	131 Å²	131	79%	0.791	78%	0.777	S	S	*	*			trans	-73.8	161.8	-150.9	-60.1	0	0	0	0	120.6
723	S	23.4	Very low	27.1	Very low	84 Å²	84	131.7 Å²	131.7	59%	0.587	79%	0.787	S	S	*	*			trans	19.4	122.7	154.3	-61.2	0	0	0	0	122.6
724	S	26	Very low	27.1	Very low	122 Å²	122	128.6 Å²	128.6	85%	0.853	77%	0.768	S	S	*	*				-163.8	166.4	116.5	35.7	0	0	0	0	109.4
725	E	26.9	Very low	27.2	Very low	125 Å²	125	129.1 Å²	129.1	58%	0.584	77%	0.772	S	S	*	*			trans	-103.8	129.6	-178.2	-59.8	-173.7	150.7	0	0	111.2	R573	R573-E725 IonicContact CZ-OE1 2.98Å; R573-E725 IonicContact NH1-OE1 2.73Å; R573-E725 IonicContact NH2-OE1 2.97Å; R573-E725 PolarHBondContact NH2-OE1 2.74Å
726	L	28	Very low	27.6	Very low	156 Å²	156	123.9 Å²	123.9	82%	0.817	77%	0.768	S	S	*	*				170.7	138.9	124.7	-92.2	157.7	0	0	0	113
727	D	25.7	Very low	27.7	Very low	134 Å²	134	128 Å²	128	72%	0.717	78%	0.778	S	S	*	*			trans	19.8	109.7	152.4	-64.4	-3.9	0	0	0	120.7
728	C	28.7	Very low	28.1	Very low	135 Å²	135	121.8 Å²	121.8	91%	0.912	77%	0.765	S	S	*	*			trans	-145.6	88.1	137.3	-102.9	0	0	0	0	112.6	S730	C728-S730 PolarHBondContact O-N 3.37Å
729	T	25.8	Very low	28.1	Very low	145 Å²	145	123.5 Å²	123.5	89%	0.89	77%	0.771	S	S	*	*			trans	-65.6	120.5	164.8	55.9	0	0	0	0	110.7
730	S	30.6	Very low	28.3	Very low	117 Å²	117	122.1 Å²	122.1	82%	0.818	76%	0.763	S	S	*	*			trans	-128.4	97.9	166.7	-164.8	0	0	0	0	111.1	C728 G732	C728-S730 PolarHBondContact O-N 3.37Å; S730-G732 PolarHBondContact O-N 3.26Å
731	S	26.7	Very low	28.4	Very low	120 Å²	120	126.4 Å²	126.4	84%	0.839	76%	0.76	S	S	*	*			trans	-62.9	118.2	173.6	51.5	0	0	0	0	111.2
732	G	28.8	Very low	28.6	Very low	74 Å²	74	125.3 Å²	125.3	76%	0.763	75%	0.748	S	S	*	*			trans	-143.4	-13.7	-173.9	0	0	0	0	0	118.2	S730	S730-G732 PolarHBondContact O-N 3.26Å
733	E	31.2	Very low	29	Very low	180 Å²	180	120.5 Å²	120.5	84%	0.841	72%	0.718	S	S	*	*			trans	-122.7	80.4	177.3	-71.9	-162.4	-159.6	0	0	112
734	Q	28	Very low	29.4	Very low	85 Å²	85	123 Å²	123	40%	0.397	73%	0.725	S	S	.	*			trans	-127.7	144.6	161.3	-68.4	-149.7	35.7	0	0	110.6
735	S	29.2	Very low	29.8	Very low	110 Å²	110	123.9 Å²	123.9	77%	0.769	72%	0.721	S	S	*	*			trans	42.1	95.5	165.2	61.5	0	0	0	0	118.4
736	C	36.1	Very low	29.9	Very low	126 Å²	126	126.1 Å²	126.1	85%	0.851	73%	0.728	S	S	*	*			trans	-135.4	29.7	164.6	-98.8	0	0	0	0	114	T738	C736-T738 PolarHBondContact O-N 3.34Å
737	D	28.3	Very low	29.8	Very low	175 Å²	175	124.9 Å²	124.9	94%	0.936	72%	0.722	S	S	*	*			trans	-77.9	61.3	160.8	-97.1	-32.1	0	0	0	110
738	T	35.8	Very low	30	Very low	96 Å²	96	125.8 Å²	125.8	59%	0.589	73%	0.726	S	S	*	*			trans	-130.3	94.6	-178.4	-49.2	0	0	0	0	110.4	C736 I740	C736-T738 PolarHBondContact O-N 3.34Å; T738-I740 HydrophobicContact CG2-CD1 4.25Å; T738-I740 HydrophobicContact CG2-CG1 3.8Å; T738-I740 PolarHBondContact O-N 3.23Å
739	V	26.7	Very low	30.1	Very low	140 Å²	140	123.5 Å²	123.5	85%	0.848	72%	0.716	S	S	*	*			trans	-77.9	86.4	179	-176	0	0	0	0	110.4	Y741	V739-Y741 PolarHBondContact O-N 3.24Å
740	I	33.3	Very low	30.1	Very low	136 Å²	136	124.5 Å²	124.5	70%	0.697	71%	0.711	S	S	*	*			trans	-78.4	100.9	178.6	-59.9	-176.7	0	0	0	110.7	T738 V742	T738-I740 HydrophobicContact CG2-CD1 4.25Å; T738-I740 HydrophobicContact CG2-CG1 3.8Å; T738-I740 PolarHBondContact O-N 3.23Å; I740-V742 HydrophobicContact CG2-CG2 3.92Å; I740-V742 PolarHBondContact O-N 3.14Å
741	Y	27.1	Very low	30	Very low	154 Å²	154	124.1 Å²	124.1	60%	0.604	71%	0.708	S	S	*	*			trans	-88.8	96.5	179.1	-166.8	-82	0	0	0	111.9	V739 R1685	V739-Y741 PolarHBondContact O-N 3.24Å; Y741-R1685 HydrophobicContact CE1-CG 4.27Å
742	V	31.5	Very low	30.2	Very low	100 Å²	100	125.9 Å²	125.9	61%	0.606	70%	0.703	S	S	*	*			trans	-122.8	112	174.4	-179.8	0	0	0	0	111.4	I740	I740-V742 HydrophobicContact CG2-CG2 3.92Å; I740-V742 PolarHBondContact O-N 3.14Å
743	G	32.2	Very low	30.1	Very low	16 Å²	16	133.2 Å²	133.2	17%	0.165	71%	0.708	C	S	.	*			trans	-106.5	151.2	169	0	0	0	0	0	113.2	K1686 K1687	G743-K1686 VanDerWaalsContact C-CE 3.46Å; G743-K1686 WeakPolarHBondContact O-CE 3.19Å; G743-K1686 PolarHBondContact O-NZ 3.39Å; G743-K1687 PolarHBondContact O-NZ 2.77Å
744	N	31	Very low	29.9	Very low	138 Å²	138	135.2 Å²	135.2	74%	0.738	71%	0.708	S	S	*	*			trans	-68.9	148.5	-175.7	-65.5	-0.9	0	0	0	114.4	K1686	N744-K1686 PolarHBondContact O-NZ 3.43Å
745	N	33.2	Very low	30	Very low	140 Å²	140	137.6 Å²	137.6	75%	0.749	72%	0.723	S	S	*	*			trans	169.4	150.9	143.8	-91.1	9.3	0	0	0	107.7
746	K	29.6	Very low	29.9	Very low	172 Å²	172	135.4 Å²	135.4	75%	0.748	71%	0.707	S	S	*	*			cis	-172	141.8	-40.8	-143	-170.6	169	-166.4	0	107.2
747	L	26.4	Very low	29.4	Very low	130 Å²	130	134 Å²	134	68%	0.681	69%	0.691	S	S	*	*			trans	70.4	158.3	154.2	-79.6	163.7	0	0	0	122.6
748	L	29.5	Very low	29.5	Very low	153 Å²	153	129.9 Å²	129.9	80%	0.801	68%	0.676	S	S	*	*			trans	76	131	175.1	-52.2	-177.6	0	0	0	116.5
749	A	30.8	Very low	28.9	Very low	86 Å²	86	131.1 Å²	131.1	71%	0.711	67%	0.67	S	S	*	*			cis	-150.2	149.1	-14.5	0	0	0	0	0	107.3
750	Q	26.4	Very low	29	Very low	167 Å²	167	130.2 Å²	130.2	78%	0.78	66%	0.659	S	S	*	*			cis	87.2	91.3	37.6	-81.5	-167.2	-53.5	0	0	116.6
751	S	28.4	Very low	28.8	Very low	109 Å²	109	129.8 Å²	129.8	76%	0.762	66%	0.663	S	S	*	*			trans	-168.5	153	139.2	47.7	0	0	0	0	108.9
752	E	30.8	Very low	28.9	Very low	157 Å²	157	126.9 Å²	126.9	73%	0.734	67%	0.665	S	S	*	*			cis	-152.2	142	-19.9	-103.9	168.3	146.5	0	0	107.7
753	R	27.1	Very low	28.8	Very low	228 Å²	228	132.1 Å²	132.1	86%	0.86	68%	0.676	S	S	*	*				58.7	143.6	83.2	-63.5	-178.1	170.8	164.8	-7.8	114.5
754	R	26.7	Very low	28.8	Very low	221 Å²	221	136.7 Å²	136.7	83%	0.834	71%	0.705	S	S	*	*			cis	-116.8	-154.5	7.8	-158.6	177.9	162.7	-173.4	-7.3	108.9
755	L	30.1	Very low	28.6	Very low	136 Å²	136	137.1 Å²	137.1	71%	0.712	71%	0.706	S	S	*	*			cis	-145.7	160.1	2.1	-80.3	162.3	0	0	0	106.8
756	S	26	Very low	28.3	Very low	64 Å²	64	139.2 Å²	139.2	45%	0.448	71%	0.708	S	S	.	*			cis	83.3	126.4	4.8	80.5	0	0	0	0	120.7
757	D	26.9	Very low	28.1	Very low	95 Å²	95	137.2 Å²	137.2	51%	0.508	71%	0.706	S	S	.	*			cis	-177.1	-175.6	-8.5	-95.2	-23.6	0	0	0	111.6	N693	N693-D757 WeakPolarHBondContact ND2-CB 3.2Å; N693-D757 PolarHBondContact ND2-OD2 3.4Å
758	S	29.4	Very low	28.1	Very low	90 Å²	90	138.7 Å²	138.7	63%	0.629	71%	0.714	S	S	*	*			trans	88.8	159.7	149.2	87	0	0	0	0	120.9
759	R	24.8	Very low	28.3	Very low	122 Å²	122	134.6 Å²	134.6	46%	0.46	71%	0.708	S	S	.	*			cis	-172.2	154.6	-29	-112.2	177.5	-92.2	151.8	-18.7	114.2	D692 N693	D692-R759 WeakPolarHBondContact OD1-CD 3.35Å; D692-R759 IonicContact OD1-CZ 3.37Å; D692-R759 IonicContact OD1-NE 3.32Å; D692-R759 PolarHBondContact OD1-NE 3.26Å; D692-R759 IonicContact OD1-NH1 3.37Å; D692-R759 PolarHBondContact OD1-NH1 3.26Å; D692-R759 IonicContact OD1-NH2 2.58Å; D692-R759 PolarHBondContact OD1-NH2 3.39Å; D692-R759 IonicContact OD2-CZ 2.9Å; D692-R759 IonicContact OD2-NE 3.97Å; D692-R759 IonicContact OD2-NH1 3.85Å; D692-R759 PolarHBondContact OD2-NH1 3.45Å; D692-R759 IonicContact OD2-NH2 3.7Å; D692-R759 PolarHBondContact OD2-NH2 3.47Å; N693-R759 VanDerWaalsContact OD1-CZ 3.24Å; N693-R759 PolarHBondContact OD1-NE 3.32Å; N693-R759 PolarHBondContact OD1-NH2 3.15Å
760	I	27.2	Very low	28.3	Very low	121 Å²	121	136 Å²	136	62%	0.621	71%	0.71	S	S	*	*			trans	67	159	141.4	-67.3	167.9	0	0	0	121.2
761	T	30.5	Very low	28.5	Very low	127 Å²	127	139.6 Å²	139.6	78%	0.779	72%	0.716	S	S	*	*			trans	81.3	146.9	178.2	70.1	0	0	0	0	117.8
762	S	28	Very low	28.4	Very low	92 Å²	92	137.5 Å²	137.5	64%	0.643	71%	0.712	S	S	*	*			cis	-164.8	171.3	-25.6	57.7	0	0	0	0	113
763	Y	30.6	Very low	28.7	Very low	211 Å²	211	138.7 Å²	138.7	83%	0.827	72%	0.722	S	S	*	*			trans	57.9	126.9	155.2	-70.2	-63	0	0	0	125.3
764	S	31.4	Very low	29.1	Very low	112 Å²	112	132.4 Å²	132.4	78%	0.783	72%	0.719	S	S	*	*				78.9	149.2	127.3	-64.4	0	0	0	0	123.7
765	I	27.2	Very low	29.2	Very low	147 Å²	147	130.1 Å²	130.1	75%	0.754	72%	0.724	S	S	*	*			trans	-105.7	125.6	-175.2	-69.8	169.4	0	0	0	109.2
766	K	25.8	Very low	29.1	Very low	184 Å²	184	127 Å²	127	80%	0.8	72%	0.724	S	S	*	*			trans	55.8	159	158	-59.2	174.2	-176.9	-178.7	0	115.8
767	N	26.6	Very low	29.1	Very low	130 Å²	130	129 Å²	129	70%	0.695	74%	0.737	S	S	*	*			cis	-163.8	170.3	24.5	-146.9	13.6	0	0	0	109.9
768	L	26.2	Very low	28.9	Very low	161 Å²	161	131.4 Å²	131.4	84%	0.843	75%	0.749	S	S	*	*			trans	69.8	143	173.9	-47	169.1	0	0	0	113.9
769	G	32.7	Very low	28.9	Very low	67 Å²	67	133 Å²	133	69%	0.691	75%	0.751	S	S	*	*			cis	92.7	144	13.9	0	0	0	0	0	111.1
770	P	32.6	Very low	29.1	Very low	114 Å²	114	134.1 Å²	134.1	74%	0.74	76%	0.763	S	S	*	*			cis	-142.7	-161.5	33.6	38	-15.6	0	0	0	114.7
771	R	30.6	Very low	29.2	Very low	244 Å²	244	134 Å²	134	92%	0.921	76%	0.762	S	S	*	*			trans	71	123.9	171.8	-55.8	168.5	-177.5	-174	-0.9	113.5
772	G	26.1	Very low	29.2	Very low	64 Å²	64	131.2 Å²	131.2	66%	0.66	74%	0.743	S	S	*	*			cis	117.7	141.9	22.1	0	0	0	0	0	108.2
773	L	35.8	Very low	29.3	Very low	182 Å²	182	133.3 Å²	133.3	95%	0.953	74%	0.74	S	S	*	*			trans	76.8	124.9	-149.3	-50.6	168.1	0	0	0	111
774	A	35.3	Very low	29.1	Very low	97 Å²	97	126.3 Å²	126.3	80%	0.802	72%	0.719	S	S	*	*			cis	-140.5	157.8	-6	0	0	0	0	0	111.8
775	D	28.9	Very low	28.9	Very low	173 Å²	173	131.7 Å²	131.7	93%	0.925	72%	0.724	S	S	*	*			trans	-83.6	-179.5	-173.6	-82.9	-70.9	0	0	0	114.9
776	G	29.2	Very low	29	Very low	69 Å²	69	130.3 Å²	130.3	71%	0.711	73%	0.728	S	S	*	*			trans	92	89.3	164.1	0	0	0	0	0	114
777	S	24.6	Very low	29	Very low	106 Å²	106	126.7 Å²	126.7	74%	0.741	72%	0.724	S	S	*	*			cis	76.6	131.1	29.5	-154.7	0	0	0	0	115.7
778	I	24.1	Very low	29	Very low	146 Å²	146	130 Å²	130	75%	0.749	73%	0.732	S	S	*	*			trans	88.3	148.3	146.5	-94.2	168.8	0	0	0	121
779	D	29.8	Very low	29.2	Very low	124 Å²	124	125.9 Å²	125.9	66%	0.663	73%	0.729	S	S	*	*			trans	68	144.4	170.3	-68.3	-15.7	0	0	0	123.7
780	M	27	Very low	29.1	Very low	146 Å²	146	128.3 Å²	128.3	72%	0.719	74%	0.735	S	S	*	*			cis	-170.2	-174.5	-40	-126.4	-147.5	-73.1	0	0	112.2
781	I	31.3	Very low	28.8	Very low	119 Å²	119	127.8 Å²	127.8	61%	0.61	73%	0.734	S	S	*	*			trans	81	100.7	151	-72.3	150.5	0	0	0	120.7	M806	I781-M806 WeakPolarHBondContact O-CE 3.44Å
782	D	30	Very low	28.7	Very low	68 Å²	68	123.8 Å²	123.8	36%	0.364	73%	0.725	S	S	.	*				83.5	131.8	121.1	-83.9	-18.7	0	0	0	129.3	S805	D782-S805 PolarHBondContact O-OG 2.84Å
783	K	30.4	Very low	28.8	Very low	136 Å²	136	128.1 Å²	128.1	59%	0.591	73%	0.733	S	S	*	*				87.4	142.5	124.9	-77.7	165.6	-173.8	144	0	124.3	M806	K783-M806 CarbonylContact O-C 2.89Å; K783-M806 WeakPolarHBondContact O-CA 3.43Å; K783-M806 VanDerWaalsContact O-CB 3.27Å; K783-M806 WeakPolarHBondContact O-CB 3.49Å; K783-M806 PolarHBondContact O-N 3.28Å; K783-M806 VanDerWaalsContact O-N 3.07Å
784	T	26	Very low	28.4	Very low	63 Å²	63	127 Å²	127	39%	0.387	73%	0.726	S	S	.	*			trans	-104.4	171.9	-164.5	32.2	0	0	0	0	116.1	M806 N807 Q808	T784-M806 WeakPolarHBondContact CA-O 3.37Å; T784-N807 VanDerWaalsContact CG2-C 3.49Å; T784-Q808 WeakPolarHBondContact CG2-O 3.45Å
785	Y	26.6	Very low	28.2	Very low	225 Å²	225	127.8 Å²	127.8	88%	0.882	72%	0.721	S	S	*	*			trans	108.2	136.6	149.8	-70.5	-76.6	0	0	0	121
786	S	29.4	Very low	28.2	Very low	119 Å²	119	126.4 Å²	126.4	83%	0.832	71%	0.713	S	S	*	*			trans	114.7	164.2	141.1	-143.4	0	0	0	0	120.8
787	C	25.3	Very low	28.1	Very low	107 Å²	107	127.2 Å²	127.2	72%	0.723	70%	0.701	S	S	*	*			trans	-90.6	175.8	-161.7	-73.7	0	0	0	0	114.3
788	K	26.2	Very low	28.1	Very low	201 Å²	201	126.5 Å²	126.5	87%	0.874	69%	0.689	S	S	*	*			cis	-165.6	137.2	2.1	-123.9	164.8	-173.6	177.2	0	110.4
789	G	32.3	Very low	28	Very low	74 Å²	74	125.8 Å²	125.8	76%	0.763	68%	0.682	S	S	*	*			trans	70.1	171.5	161.4	0	0	0	0	0	118.6
790	S	29.3	Very low	28.1	Very low	117 Å²	117	124.1 Å²	124.1	82%	0.818	68%	0.677	S	S	*	*			cis	-175.5	107.5	-32.1	46.1	0	0	0	0	112.3
791	S	26.7	Very low	28	Very low	103 Å²	103	123.6 Å²	123.6	72%	0.72	68%	0.675	S	S	*	*			trans	-158.1	159.8	174.8	-109.5	0	0	0	0	115.6
792	E	29	Very low	27.9	Very low	160 Å²	160	126.1 Å²	126.1	75%	0.748	68%	0.682	S	S	*	*			trans	25.9	154.6	144.6	-69.3	139.5	151.4	0	0	123.5
793	L	27.3	Very low	27.9	Very low	155 Å²	155	130.1 Å²	130.1	81%	0.812	70%	0.699	S	S	*	*			cis	102.2	130.7	29.2	-111.9	168.3	0	0	0	114.3
794	I	27.2	Very low	27.9	Very low	158 Å²	158	131.4 Å²	131.4	81%	0.81	71%	0.707	S	S	*	*			trans	69.9	174.9	176.8	-49.3	-175.3	0	0	0	113.6
795	T	30.9	Very low	28.3	Very low	115 Å²	115	131.7 Å²	131.7	71%	0.706	71%	0.711	S	S	*	*			trans	-146.9	117.8	-155.1	-60	0	0	0	0	114.6
796	L	29.8	Very low	28.5	Very low	144 Å²	144	125 Å²	125	75%	0.754	69%	0.688	S	S	*	*			trans	64.8	155.8	166.3	-60.9	176	0	0	0	116.1
797	N	26.5	Very low	28.5	Very low	85 Å²	85	124.7 Å²	124.7	46%	0.455	68%	0.678	S	S	.	*			cis	-134.4	-173.7	7.9	-120.3	-14.3	0	0	0	110.7	T551 S552	T551-N797 CarbonylContact C-O 3.45Å; S552-N797 WeakPolarHBondContact O-CB 3.22Å
798	N	24.5	Very low	28.8	Very low	91 Å²	91	125.9 Å²	125.9	49%	0.487	67%	0.673	S	S	.	*			trans	42.7	141.6	153.3	-74.7	23.4	0	0	0	120.8	P550 T551	P550-N798 CarbonylContact C-O 3.38Å; T551-N798 PolarHBondContact N-O 2.8Å
799	E	22.4	Very low	28.9	Very low	131 Å²	131	122.6 Å²	122.6	61%	0.612	67%	0.665	S	S	*	*			cis	-163	-173.1	4	-138.2	-179.3	-126.9	0	0	111
800	T	31.3	Very low	28.7	Very low	89 Å²	89	126.1 Å²	126.1	55%	0.546	66%	0.661	S	S	.	*			trans	54.8	114.7	151	47.3	0	0	0	0	123.4
801	I	26.2	Very low	28.5	Very low	135 Å²	135	130.1 Å²	130.1	69%	0.692	66%	0.659	S	S	*	*				90.7	110.2	126.8	-66.5	170.2	0	0	0	119.8
802	K	29.4	Very low	28.5	Very low	172 Å²	172	130.3 Å²	130.3	75%	0.748	66%	0.655	S	S	*	*			trans	80.1	111.7	156.6	-71.6	169.4	179.8	-173.9	0	117.2
803	Q	28.4	Very low	28.3	Very low	153 Å²	153	128.5 Å²	128.5	72%	0.715	66%	0.655	S	S	*	*				73.3	133.8	61.6	-68	174.6	-27.5	0	0	111.9
804	H	31.5	Very low	28.4	Very low	163 Å²	163	129.7 Å²	129.7	76%	0.755	66%	0.656	S	S	*	*			cis	-148.8	-164.9	-1	-121.8	-51.6	0	0	0	109.3
805	S	33.3	Very low	28.2	Very low	68 Å²	68	129.9 Å²	129.9	48%	0.476	66%	0.656	S	S	.	*			cis	-132.5	-93.5	17.4	-171.9	0	0	0	0	114.5	D782	D782-S805 PolarHBondContact O-OG 2.84Å
806	M	32.3	Very low	28	Very low	84 Å²	84	131.6 Å²	131.6	41%	0.414	66%	0.661	S	S	.	*			trans	-141.8	-172.8	-159.2	-73.7	-175.2	-123	0	0	110.7	I781 K783 T784	I781-M806 WeakPolarHBondContact O-CE 3.44Å; K783-M806 CarbonylContact O-C 2.89Å; K783-M806 WeakPolarHBondContact O-CA 3.43Å; K783-M806 VanDerWaalsContact O-CB 3.27Å; K783-M806 WeakPolarHBondContact O-CB 3.49Å; K783-M806 PolarHBondContact O-N 3.28Å; K783-M806 VanDerWaalsContact O-N 3.07Å; T784-M806 WeakPolarHBondContact CA-O 3.37Å
807	N	28.7	Very low	27.8	Very low	114 Å²	114	133.3 Å²	133.3	61%	0.61	67%	0.665	S	S	*	*			cis	100.2	152.1	-3.1	-144.2	0.1	0	0	0	119.2	T784	T784-N807 VanDerWaalsContact CG2-C 3.49Å
808	Q	32.5	Very low	27.7	Very low	132 Å²	132	137.5 Å²	137.5	62%	0.617	69%	0.686	S	S	*	*			trans	85.4	161	-179.4	-50.7	-167.8	46.8	0	0	119	T784	T784-Q808 WeakPolarHBondContact CG2-O 3.45Å
809	N	28	Very low	27.7	Very low	131 Å²	131	137.4 Å²	137.4	70%	0.701	69%	0.693	S	S	*	*				-177.5	162.3	-61.6	-123.7	-36.8	0	0	0	110.1
810	Q	27.2	Very low	27.9	Very low	149 Å²	149	137 Å²	137	70%	0.696	70%	0.7	S	S	*	*			trans	66.6	160	168.6	-69.1	-178.7	64.5	0	0	115.5
811	R	26.4	Very low	27.5	Very low	201 Å²	201	140.9 Å²	140.9	76%	0.758	71%	0.713	S	S	*	*			cis	-152.6	145.1	11.3	-141.5	170.1	-155.5	-148.5	2.7	113.5
812	T	25.6	Very low	27.4	Very low	106 Å²	106	141 Å²	141	65%	0.65	72%	0.716	S	S	*	*			trans	54.1	133.6	146.4	41.9	0	0	0	0	124.3
813	T	25.5	Very low	27.3	Very low	122 Å²	122	139.4 Å²	139.4	75%	0.748	72%	0.715	S	S	*	*			trans	66.2	147.4	143.1	54.6	0	0	0	0	119.5
814	H	28.9	Very low	27.1	Very low	180 Å²	180	137.6 Å²	137.6	83%	0.833	72%	0.718	S	S	*	*			cis	-143.2	166.4	-4.4	-143.3	-90.2	0	0	0	109.6
815	M	22.9	Very low	26.9	Very low	162 Å²	162	137.3 Å²	137.3	80%	0.798	72%	0.72	S	S	*	*			trans	-97.6	128.7	178.5	-67.1	-85.7	-70.7	0	0	112
816	N	27.3	Very low	26.4	Very low	151 Å²	151	140.1 Å²	140.1	81%	0.807	74%	0.735	S	S	*	*				-179.4	179.5	118.9	-95.4	7.2	0	0	0	112.7
817	E	25.1	Very low	26.2	Very low	180 Å²	180	142 Å²	142	84%	0.841	75%	0.746	S	S	*	*			trans	-98.9	153.8	-154.1	-53.4	171.2	119.4	0	0	115.2
818	L	25	Very low	26	Very low	173 Å²	173	144 Å²	144	91%	0.906	75%	0.749	S	S	*	*			trans	-151.1	-167.3	130.6	-139.7	69.5	0	0	0	111
819	S	24.9	Very low	25.8	Very low	89 Å²	89	148 Å²	148	62%	0.622	76%	0.758	S	S	*	*			trans	-120.8	174.7	-132.6	60.5	0	0	0	0	118.1
820	T	26	Very low	25.7	Very low	124 Å²	124	149.6 Å²	149.6	76%	0.761	76%	0.763	S	S	*	*			trans	74.2	117.4	157.1	37.4	0	0	0	0	121
821	M	22.6	Very low	25.7	Very low	169 Å²	169	148.6 Å²	148.6	83%	0.833	76%	0.761	S	S	*	*			trans	30	116.5	147.3	-61.4	-175	176.5	0	0	118.1
822	N	24.5	Very low	25.7	Very low	138 Å²	138	143.8 Å²	143.8	74%	0.738	76%	0.756	S	S	*	*				-161.3	164.6	69	-100.9	-44.3	0	0	0	115.4
823	N	27.1	Very low	25.8	Very low	139 Å²	139	148.6 Å²	148.6	74%	0.743	76%	0.763	S	S	*	*			trans	50.1	110.2	156.3	-68	-20.2	0	0	0	121.5
824	C	23.1	Very low	25.9	Very low	114 Å²	114	147 Å²	147	77%	0.77	75%	0.753	S	S	*	*				20.6	120.8	127	-59.3	0	0	0	0	119.9
825	I	27.3	Very low	25.7	Very low	157 Å²	157	145 Å²	145	81%	0.805	75%	0.748	S	S	*	*				-168.9	104.9	110.1	-100.8	161.8	0	0	0	111.9
826	T	24.6	Very low	25.9	Very low	127 Å²	127	141.9 Å²	141.9	78%	0.779	75%	0.748	S	S	*	*			trans	60.1	161.5	147.9	-3.6	0	0	0	0	118.3
827	I	26.8	Very low	26.1	Very low	125 Å²	125	140.3 Å²	140.3	64%	0.641	74%	0.744	S	S	*	*			cis	-141.1	147.5	13.2	-103.3	179.4	0	0	0	111.2
828	K	25.2	Very low	26.2	Very low	155 Å²	155	136.5 Å²	136.5	67%	0.674	73%	0.733	S	S	*	*			trans	15.1	129.9	147.4	-48.4	162.5	-169.1	157	0	117.3
829	R	27.6	Very low	26.2	Very low	217 Å²	217	135.9 Å²	135.9	82%	0.819	72%	0.718	S	S	*	*				168.7	161.7	61.2	-115.6	149.9	-177.3	169.4	-1.9	107.2
830	M	26.9	Very low	26.9	Very low	164 Å²	164	136.2 Å²	136.2	81%	0.808	72%	0.718	S	S	*	*			cis	-155.7	110.4	-7.3	-157.3	163.3	68.9	0	0	109.5	P832	M830-P832 WeakPolarHBondContact O-CD 3.47Å
831	I	26.4	Very low	26.9	Very low	127 Å²	127	141.6 Å²	141.6	65%	0.651	73%	0.725	S	S	*	*			trans	-84.7	124.8	180	-46.4	171.6	0	0	0	110.2	R833	I831-R833 HydrophobicContact CB-CG 4.21Å; I831-R833 HydrophobicContact CG2-CG 3.68Å; I831-R833 PolarHBondContact O-N 3.04Å
832	P	26.5	Very low	27.1	Very low	101 Å²	101	141.4 Å²	141.4	66%	0.656	73%	0.726	S	S	*	*			trans	-77.9	68	169.7	33.8	-35	0	0	0	110.3	M830 T834	M830-P832 WeakPolarHBondContact O-CD 3.47Å; P832-T834 VanDerWaalsContact C-N 3.32Å; P832-T834 PolarHBondContact O-N 3.21Å
833	R	27.6	Very low	27.2	Very low	207 Å²	207	143 Å²	143	78%	0.781	73%	0.731	S	S	*	*			trans	-64.3	86.9	179.5	-83.7	-169	169.7	157.2	-1.3	112	I831 N835	I831-R833 HydrophobicContact CB-CG 4.21Å; I831-R833 HydrophobicContact CG2-CG 3.68Å; I831-R833 PolarHBondContact O-N 3.04Å; R833-N835 PolarHBondContact O-N 3.38Å
834	T	27	Very low	27.1	Very low	88 Å²	88	143.2 Å²	143.2	54%	0.54	73%	0.732	S	S	.	*			trans	-64.1	110.9	150.7	42.6	0	0	0	0	108.9	P832	P832-T834 VanDerWaalsContact C-N 3.32Å; P832-T834 PolarHBondContact O-N 3.21Å
835	N	26.3	Very low	27.2	Very low	139 Å²	139	146 Å²	146	74%	0.743	73%	0.731	S	S	*	*			trans	-144.6	106.1	157.1	-102.4	-14.7	0	0	0	108.5	R833	R833-N835 PolarHBondContact O-N 3.38Å
836	A	27	Very low	27.1	Very low	95 Å²	95	145.9 Å²	145.9	79%	0.785	74%	0.737	S	S	*	*			trans	-156.4	55.9	-177.5	0	0	0	0	0	110.6
837	T	31.5	Very low	27.2	Very low	118 Å²	118	149.4 Å²	149.4	72%	0.724	74%	0.742	S	S	*	*			trans	-132.4	95.9	171.1	45.2	0	0	0	0	107.4
838	V	27.3	Very low	27.2	Very low	100 Å²	100	148.8 Å²	148.8	61%	0.606	75%	0.749	S	S	*	*				68.4	91.1	93	176.3	0	0	0	0	112.5
839	W	24.2	Very low	27.3	Very low	160 Å²	160	152.9 Å²	152.9	61%	0.606	76%	0.76	S	S	*	*				44.3	161.1	114.4	-81	43.4	0	0	0	119.8	N616 Q617	N616-W839 HydrophobicContact CB-CH2 4.25Å; N616-W839 HydrophobicContact CB-CZ2 3.87Å; N616-W839 WeakPolarHBondContact O-CH2 3.42Å; Q617-W839 HydrophobicContact CG-CH2 4.44Å
840	P	39.6	Very low	27.3	Very low	96 Å²	96	152.4 Å²	152.4	62%	0.623	76%	0.764	S	S	*	*			cis	-141.4	174.7	-36.7	41.3	-26.2	0	0	0	113.2
841	R	26.4	Very low	27.2	Very low	238 Å²	238	153.7 Å²	153.7	90%	0.898	77%	0.765	S	S	*	*			trans	172.7	162.6	134.2	-100.3	171.2	176.8	170.6	-2	112.7
842	I	26.6	Very low	27.3	Very low	165 Å²	165	153.8 Å²	153.8	85%	0.846	77%	0.767	S	S	*	*			trans	-110.3	129.7	175	-63.5	166.1	0	0	0	108.4
843	M	25.9	Very low	27.4	Very low	171 Å²	171	158 Å²	158	84%	0.842	78%	0.777	S	S	*	*			trans	-165.7	174.9	140.6	-129.2	176.6	-81.2	0	0	112
844	N	25.2	Very low	27.3	Very low	144 Å²	144	152.1 Å²	152.1	77%	0.77	77%	0.768	S	S	*	*			trans	-87.1	163.9	-161.4	-95.5	-36.4	0	0	0	116.3
845	K	24.6	Very low	27.3	Very low	172 Å²	172	155 Å²	155	75%	0.748	78%	0.779	S	S	*	*			trans	38.3	106.1	149.7	-65.3	177.8	179.8	175.9	0	118.1
846	T	25.2	Very low	27.4	Very low	154 Å²	154	152.8 Å²	152.8	95%	0.945	77%	0.771	S	S	*	*				-159.5	156.7	121.5	5.4	0	0	0	0	111.8
847	K	27.1	Very low	27.4	Very low	202 Å²	202	153.2 Å²	153.2	88%	0.878	76%	0.764	S	S	*	*			trans	-87.3	173.6	-179.3	-69.7	176.2	179.5	172	0	112
848	S	26.3	Very low	27.2	Very low	112 Å²	112	153.3 Å²	153.3	78%	0.783	77%	0.765	S	S	*	*			trans	111.8	99.4	159.7	-59.6	0	0	0	0	113.3
849	R	28.4	Very low	27.2	Very low	241 Å²	241	154.3 Å²	154.3	91%	0.909	77%	0.771	S	S	*	*				62	115.1	67	-71.4	-169.2	171.1	178.6	-2.3	113.6
850	K	27.5	Very low	27.2	Very low	207 Å²	207	152.7 Å²	152.7	90%	0.9	78%	0.779	S	S	*	*			trans	17.1	105.5	149.1	-58.5	-176.1	178	-174.1	0	117.6
851	F	25.1	Very low	26.6	Very low	191 Å²	191	151.6 Å²	151.6	84%	0.838	78%	0.778	S	S	*	*			trans	-73	148.3	137.8	-105.5	-143.6	0	0	0	108
852	L	27.7	Very low	26.5	Very low	129 Å²	129	146.7 Å²	146.7	68%	0.675	78%	0.775	S	S	*	*			cis	-129.7	173.5	-3.6	-99.1	162.8	0	0	0	107.4
853	Q	29.1	Very low	26.3	Very low	188 Å²	188	143.4 Å²	143.4	88%	0.879	77%	0.767	S	S	*	*			cis	-145.8	158.6	39	-163	162.8	-5.7	0	0	113.1
854	S	26.2	Very low	26.2	Very low	84 Å²	84	140.2 Å²	140.2	59%	0.587	76%	0.761	S	S	*	*			trans	-89	152.2	-161	51.7	0	0	0	0	116
855	L	26.5	Very low	26.2	Very low	148 Å²	148	138.7 Å²	138.7	78%	0.775	76%	0.761	S	S	*	*				-160.6	169.6	113.9	-131.2	69	0	0	0	113.5
856	T	28.6	Very low	26.2	Very low	93 Å²	93	137.9 Å²	137.9	57%	0.571	76%	0.762	S	S	*	*			trans	60.4	96.8	155.8	40.2	0	0	0	0	122.1
857	T	26.8	Very low	26.1	Very low	104 Å²	104	138.7 Å²	138.7	64%	0.638	75%	0.753	S	S	*	*				65.4	113.9	115.4	54.4	0	0	0	0	123.2
858	T	26.4	Very low	26	Very low	121 Å²	121	135.4 Å²	135.4	74%	0.742	74%	0.744	S	S	*	*				61.1	148.4	121.7	65	0	0	0	0	121.4
859	T	27.7	Very low	25.8	Very low	120 Å²	120	134.1 Å²	134.1	74%	0.736	74%	0.735	S	S	*	*			cis	-154.6	162.5	-2.7	3.3	0	0	0	0	113.1
860	T	25	Very low	25.6	Very low	126 Å²	126	130.3 Å²	130.3	77%	0.773	73%	0.727	S	S	*	*			trans	-25.2	161.3	153.4	49.8	0	0	0	0	119.6
861	A	26.1	Very low	25.4	Very low	73 Å²	73	126.1 Å²	126.1	60%	0.603	72%	0.719	S	S	*	*			cis	178	173.2	-15.4	0	0	0	0	0	110.9
862	T	23.7	Very low	25.5	Very low	135 Å²	135	125 Å²	125	83%	0.828	72%	0.72	S	S	*	*			trans	64.6	149.8	150.3	39.4	0	0	0	0	119.2
863	S	24.2	Very low	25.3	Very low	97 Å²	97	124.9 Å²	124.9	68%	0.678	72%	0.718	S	S	*	*			cis	-167.3	163.5	-4.7	39.5	0	0	0	0	112.3
864	S	23.4	Very low	25.3	Very low	104 Å²	104	123 Å²	123	73%	0.727	71%	0.713	S	S	*	*			trans	50.9	110.9	153	54.2	0	0	0	0	119
865	S	23.7	Very low	25.3	Very low	111 Å²	111	125.8 Å²	125.8	78%	0.776	72%	0.72	S	S	*	*				175.9	171.6	88.9	-85.3	0	0	0	0	110.5
866	M	26.5	Very low	25.4	Very low	156 Å²	156	122.3 Å²	122.3	77%	0.768	72%	0.72	S	S	*	*			cis	-144.3	173.6	-7.5	-122.5	-157.6	-47.8	0	0	108.4
867	K	22.5	Very low	25.2	Very low	170 Å²	170	126.7 Å²	126.7	74%	0.739	73%	0.734	S	S	*	*				36.2	141.1	84.9	-67.6	-172.3	169.2	-173.7	0	117.1
868	I	23.7	Very low	25.1	Very low	134 Å²	134	127.4 Å²	127.4	69%	0.687	73%	0.73	S	S	*	*			cis	-166.8	153.8	-13	-116.1	168.9	0	0	0	107.9
869	S	22.3	Very low	25	Very low	85 Å²	85	124.7 Å²	124.7	59%	0.594	71%	0.714	S	S	*	*			trans	34	170.7	152.9	-63.4	0	0	0	0	123.6
870	E	24.5	Very low	25	Very low	161 Å²	161	123.9 Å²	123.9	75%	0.752	70%	0.697	S	S	*	*			cis	-150.5	142.3	-10.4	-116	131	-128.6	0	0	105
871	T	24.2	Very low	25.1	Very low	119 Å²	119	123.9 Å²	123.9	73%	0.73	69%	0.692	S	S	*	*				73.1	97.2	69.3	-46.6	0	0	0	0	116
872	I	25.9	Very low	25.1	Very low	167 Å²	167	126.3 Å²	126.3	86%	0.856	69%	0.694	S	S	*	*			trans	-144.8	143.9	152.6	-63.9	-175.8	0	0	0	105.3
873	M	23.9	Very low	25.2	Very low	127 Å²	127	123.1 Å²	123.1	63%	0.626	69%	0.688	S	S	*	*			cis	155.5	122	-24	-106.6	-77.5	-72.5	0	0	105.2	I875	M873-I875 HydrophobicContact CE-CD1 4.06Å; M873-I875 HydrophobicContact CE-CG1 4.12Å
874	N	28.9	Very low	25.7	Very low	147 Å²	147	124.8 Å²	124.8	79%	0.786	70%	0.697	S	S	*	*			trans	177.8	101.7	148.5	-90.8	-13.3	0	0	0	106.1
875	I	26.6	Very low	25.9	Very low	143 Å²	143	124.1 Å²	124.1	73%	0.733	69%	0.685	S	S	*	*				76.8	121.8	79.2	-68.8	172.3	0	0	0	111.2	M873	M873-I875 HydrophobicContact CE-CD1 4.06Å; M873-I875 HydrophobicContact CE-CG1 4.12Å
876	G	28.8	Very low	26	Very low	76 Å²	76	125.4 Å²	125.4	78%	0.784	69%	0.688	S	S	*	*			trans	166.2	107.4	-176	0	0	0	0	0	108.6
877	E	23.5	Very low	25.9	Very low	184 Å²	184	122.5 Å²	122.5	86%	0.86	68%	0.683	S	S	*	*			trans	-82.5	156	-177.5	-61.2	169.9	157.5	0	0	111
878	E	26.3	Very low	26	Very low	119 Å²	119	122 Å²	122	56%	0.556	69%	0.687	S	S	*	*			trans	179.2	139.7	131.8	-103	-163.4	142.6	0	0	112.7	W880 R1301	E878-W880 VanDerWaalsContact CD-CD1 3.47Å; E878-W880 PolarHBondContact OE1-NE1 3.35Å; E878-R1301 VanDerWaalsContact OE1-CD 3.25Å; E878-R1301 WeakPolarHBondContact OE1-CD 3.23Å; E878-R1301 IonicContact OE1-CZ 3.53Å; E878-R1301 IonicContact OE1-NE 3.64Å; E878-R1301 IonicContact OE1-NH1 3.83Å; E878-R1301 PolarHBondContact OE1-NH1 2.97Å; E878-R1301 IonicContact OE2-CZ 2.69Å; E878-R1301 IonicContact OE2-NH1 3.66Å; E878-R1301 PolarHBondContact OE2-NH1 3.45Å
879	T	23.6	Very low	26	Very low	65 Å²	65	120.8 Å²	120.8	40%	0.399	69%	0.691	S	S	.	*			trans	-85.8	132.4	159.1	48	0	0	0	0	108.8	V1302	T879-V1302 WeakPolarHBondContact O-CG2 3.43Å; T879-V1302 WeakPolarHBondContact OG1-CG1 3.29Å; T879-V1302 WeakPolarHBondContact OG1-CG2 3.47Å
880	W	28.2	Very low	26.2	Very low	102 Å²	102	122 Å²	122	39%	0.386	70%	0.699	S	S	.	*			trans	-145.7	155.2	164.8	-97.3	103.1	0	0	0	116.4	E878 F1300 R1301 V1302	E878-W880 VanDerWaalsContact CD-CD1 3.47Å; E878-W880 PolarHBondContact OE1-NE1 3.35Å; W880-F1300 HydrophobicContact CD2-CD1 4.32Å; W880-F1300 AromaticContact CD2-CE1 3.92Å; W880-F1300 HydrophobicContact CD2-CE1 3.92Å; W880-F1300 AromaticContact CE2-CD1 3.98Å; W880-F1300 HydrophobicContact CE3-CD1 4.14Å; W880-F1300 AromaticContact CE3-CE1 3.69Å; W880-F1300 HydrophobicContact CE3-CE1 3.69Å; W880-F1300 AromaticContact CH2-CD1 3.49Å; W880-F1300 HydrophobicContact CH2-CD1 3.49Å; W880-F1300 VanDerWaalsContact CH2-CD1 3.49Å; W880-F1300 AromaticContact CH2-CE1 3.93Å; W880-F1300 HydrophobicContact CH2-CE1 3.93Å; W880-F1300 AromaticContact CZ2-CD1 3.57Å; W880-F1300 HydrophobicContact CZ2-CD1 3.57Å; W880-F1300 HydrophobicContact CZ2-CE1 4.03Å; W880-F1300 AromaticContact CZ3-CD1 3.76Å; W880-F1300 HydrophobicContact CZ3-CD1 3.76Å; W880-F1300 AromaticContact CZ3-CE1 3.72Å; W880-F1300 HydrophobicContact CZ3-CE1 3.72Å; W880-R1301 HydrophobicContact CH2-CB 4.49Å; W880-R1301 HydrophobicContact CH2-CG 4.44Å; W880-R1301 HydrophobicContact CZ2-CB 3.64Å; W880-R1301 HydrophobicContact CZ2-CG 3.52Å; W880-R1301 VanDerWaalsContact NE1-CD 3.33Å; W880-R1301 VanDerWaalsContact NE1-NE 3.11Å; W880-V1302 HydrophobicContact CD2-CG2 4.26Å; W880-V1302 HydrophobicContact CH2-CB 4.22Å; W880-V1302 HydrophobicContact CH2-CG2 3.74Å; W880-V1302 HydrophobicContact CZ2-CB 3.49Å; W880-V1302 VanDerWaalsContact CZ2-CB 3.49Å; W880-V1302 HydrophobicContact CZ2-CG2 3.3Å; W880-V1302 HydrophobicContact CZ3-CG2 4.43Å
881	I	25.5	Very low	26.3	Very low	127 Å²	127	121.4 Å²	121.4	65%	0.651	70%	0.701	S	S	*	*			trans	-109.7	141.9	-177.1	-69.5	173.5	0	0	0	110.3
882	D	26.4	Very low	26.4	Very low	124 Å²	124	120.9 Å²	120.9	66%	0.663	70%	0.697	S	S	*	*			trans	56.8	167.7	171.5	-66.7	-32.4	0	0	0	117.1
883	G	27.3	Very low	26.4	Very low	68 Å²	68	121.1 Å²	121.1	70%	0.701	69%	0.692	S	S	*	*			trans	-145.8	-175.3	179.3	0	0	0	0	0	110.7
884	P	34.5	Very low	26.5	Very low	132 Å²	132	121.3 Å²	121.3	86%	0.857	69%	0.691	S	S	*	*			trans	-132.4	173.1	156.4	36.9	-24	0	0	0	114.3
885	N	26.2	Very low	26.3	Very low	90 Å²	90	119 Å²	119	48%	0.481	68%	0.682	S	S	.	*			trans	-67.9	140.3	-179.9	-67.5	-98.4	0	0	0	112.5	S361 K363	S361-N885 PolarHBondContact OG-ND2 3.41Å; K363-N885 PolarHBondContact NZ-OD1 3.1Å
886	V	26.4	Very low	26.2	Very low	138 Å²	138	118.2 Å²	118.2	84%	0.836	68%	0.68	S	S	*	*			trans	-129.4	121.2	134.9	-178.7	0	0	0	0	108.7
887	S	24.1	Very low	26.1	Very low	95 Å²	95	120.1 Å²	120.1	66%	0.664	67%	0.672	S	S	*	*			trans	-159.1	76.4	170.6	-172.1	0	0	0	0	108.5
888	L	24.8	Very low	26.2	Very low	159 Å²	159	118 Å²	118	83%	0.832	67%	0.665	S	S	*	*			trans	-83.4	126.5	176.3	-84.7	166.2	0	0	0	110.3
889	S	24.2	Very low	26.4	Very low	108 Å²	108	117.5 Å²	117.5	76%	0.755	67%	0.67	S	S	*	*			trans	-148	87.1	167.1	65.6	0	0	0	0	110.8
890	S	26.3	Very low	26.4	Very low	111 Å²	111	120 Å²	120	78%	0.776	68%	0.681	S	S	*	*			trans	-162.6	136.7	167.6	-70.1	0	0	0	0	104.4
891	L	25.9	Very low	26.7	Very low	149 Å²	149	121.8 Å²	121.8	78%	0.78	70%	0.703	S	S	*	*			cis	-133.9	128.4	20.4	-154.3	65.1	0	0	0	106.7
892	V	26.8	Very low	26.6	Very low	108 Å²	108	118.9 Å²	118.9	66%	0.655	69%	0.694	S	S	*	*				47.3	103.1	82	175.5	0	0	0	0	113.6
893	K	26.8	Very low	26.7	Very low	172 Å²	172	119.4 Å²	119.4	75%	0.748	70%	0.697	S	S	*	*			trans	56.4	150.8	141.8	-64.8	-170.1	160.2	-143.1	0	119.8
894	Q	24.9	Very low	26.5	Very low	131 Å²	131	121.2 Å²	121.2	61%	0.612	70%	0.697	S	S	*	*			cis	-152.1	130.4	-8.8	-125.6	-174	-106	0	0	109.3
895	T	25.1	Very low	26	Very low	98 Å²	98	123.2 Å²	123.2	60%	0.601	69%	0.692	S	S	*	*				45.6	142.7	127.4	59.7	0	0	0	0	121.5
896	N	24.9	Very low	26.3	Very low	127 Å²	127	126 Å²	126	68%	0.679	71%	0.707	S	S	*	*			trans	81.5	144.1	145.4	-75.6	33.5	0	0	0	115.6
897	D	25.6	Very low	26.2	Very low	116 Å²	116	125.9 Å²	125.9	62%	0.62	70%	0.702	S	S	*	*			cis	-161.3	173.6	10.5	-131.1	-23.5	0	0	0	114.4
898	I	27.1	Very low	26.5	Very low	139 Å²	139	129.3 Å²	129.3	71%	0.713	71%	0.712	S	S	*	*			trans	70.2	130.8	141.7	-76.1	164.5	0	0	0	117.3
899	V	29.9	Very low	26.5	Very low	108 Å²	108	126.1 Å²	126.1	66%	0.655	70%	0.703	S	S	*	*			cis	-160.7	164.2	5.6	101.2	0	0	0	0	116.5
900	N	24.4	Very low	26.8	Very low	118 Å²	118	127.4 Å²	127.4	63%	0.631	71%	0.706	S	S	*	*			trans	-16.8	150.5	160.2	-41.7	-22.4	0	0	0	120
901	V	32.8	Very low	26.8	Very low	140 Å²	140	128.4 Å²	128.4	85%	0.848	70%	0.703	S	S	*	*				-141.5	120.8	102.4	175.2	0	0	0	0	105.7
902	S	24.5	Very low	26.8	Very low	66 Å²	66	127.2 Å²	127.2	46%	0.462	70%	0.697	S	S	.	*			cis	66.5	93.4	33.9	80.1	0	0	0	0	114.5
903	N	27.5	Very low	26.9	Very low	135 Å²	135	126.6 Å²	126.6	72%	0.722	70%	0.698	S	S	*	*				-178.8	153.7	84	-89.6	-44	0	0	0	110.2
904	C	24.1	Very low	27	Very low	106 Å²	106	123.7 Å²	123.7	72%	0.716	70%	0.699	S	S	*	*				43.6	134.3	93.4	-41.3	0	0	0	0	114.2
905	K	24.8	Very low	27	Very low	173 Å²	173	127.1 Å²	127.1	75%	0.752	71%	0.712	S	S	*	*			cis	-153.2	-169.5	38.1	-128.4	154.6	-170.5	177.1	0	109.9
906	D	30.9	Very low	27	Very low	149 Å²	149	128.2 Å²	128.2	80%	0.797	72%	0.718	S	S	*	*				-152.9	169	51.1	-96.6	-50	0	0	0	115
907	N	25.9	Very low	26.9	Very low	136 Å²	136	129.5 Å²	129.5	73%	0.727	72%	0.724	S	S	*	*			trans	-131.9	154.8	177.2	-63.5	-75.4	0	0	0	111.4
908	L	29	Very low	26.8	Very low	166 Å²	166	132.2 Å²	132.2	87%	0.869	73%	0.731	S	S	*	*			trans	-134.3	145.2	156.2	-82	98.8	0	0	0	110.2
909	S	26.2	Very low	26.8	Very low	93 Å²	93	132.2 Å²	132.2	65%	0.65	73%	0.731	S	S	*	*			cis	-167.9	168.3	-15	54.7	0	0	0	0	111.3
910	V	29.6	Very low	26.5	Very low	134 Å²	134	131.9 Å²	131.9	81%	0.812	73%	0.734	S	S	*	*			trans	64.8	129.6	149.2	160.4	0	0	0	0	119.2
911	N	25.2	Very low	26.4	Very low	133 Å²	133	133.8 Å²	133.8	71%	0.711	74%	0.743	S	S	*	*			cis	-156.7	-143.4	-23.5	-149.6	24.7	0	0	0	107.1
912	D	27.2	Very low	26	Very low	123 Å²	123	135.9 Å²	135.9	66%	0.658	74%	0.744	S	S	*	*			cis	-160.8	173.4	2.1	-146	-65.6	0	0	0	111.2
913	S	29	Very low	26.1	Very low	96 Å²	96	137.3 Å²	137.3	67%	0.671	75%	0.754	S	S	*	*			trans	80.5	136.4	153	78.6	0	0	0	0	121.4
914	S	28.4	Very low	26.1	Very low	110 Å²	110	137.9 Å²	137.9	77%	0.769	76%	0.756	S	S	*	*			trans	69.5	108.1	169.7	-47	0	0	0	0	116.2
915	K	24.7	Very low	26.1	Very low	203 Å²	203	137.3 Å²	137.3	88%	0.883	75%	0.754	S	S	*	*			cis	75	146	39.1	-62	-169.8	173	-179.4	0	116
916	V	25.8	Very low	26.1	Very low	121 Å²	121	135.7 Å²	135.7	73%	0.733	75%	0.753	S	S	*	*			trans	73.5	112.7	-178.5	-167.4	0	0	0	0	113	F918	V916-F918 HydrophobicContact CG1-CD2 3.92Å; V916-F918 HydrophobicContact CG1-CE2 4.31Å
917	L	22.1	Very low	25.8	Very low	155 Å²	155	133 Å²	133	81%	0.812	74%	0.741	S	S	*	*			cis	81.8	74.2	16.9	-149.6	173.6	0	0	0	115.6
918	F	24.5	Very low	25.9	Very low	173 Å²	173	134.2 Å²	134.2	76%	0.759	74%	0.743	S	S	*	*			trans	-162.2	119.9	157.1	-86.4	-50.2	0	0	0	107.1	V916	V916-F918 HydrophobicContact CG1-CD2 3.92Å; V916-F918 HydrophobicContact CG1-CE2 4.31Å
919	I	26.2	Very low	25.6	Very low	138 Å²	138	131 Å²	131	71%	0.708	74%	0.735	S	S	*	*				102.7	146.4	80.2	-102.7	-178.3	0	0	0	111.1
920	S	24.2	Very low	26.1	Very low	102 Å²	102	131.5 Å²	131.5	71%	0.713	74%	0.735	S	S	*	*			trans	50.6	118.1	170.7	55.6	0	0	0	0	118
921	N	22.6	Very low	26	Very low	157 Å²	157	132.6 Å²	132.6	84%	0.84	74%	0.736	S	S	*	*			cis	59.4	135.5	12.4	-133.2	25.8	0	0	0	115.1
922	E	24	Very low	26	Very low	184 Å²	184	130.5 Å²	130.5	86%	0.86	73%	0.732	S	S	*	*			trans	77.4	141.2	-156.4	-60.3	-177.3	-164.1	0	0	113.8
923	S	26.5	Very low	26.1	Very low	96 Å²	96	129.8 Å²	129.8	67%	0.671	74%	0.736	S	S	*	*			cis	-160.1	157.4	-13	43.9	0	0	0	0	107.6
924	L	26.6	Very low	26.2	Very low	148 Å²	148	131.2 Å²	131.2	78%	0.775	74%	0.741	S	S	*	*			cis	-153.9	145.6	7.7	-117.4	147.8	0	0	0	106.9
925	S	24.3	Very low	26.3	Very low	94 Å²	94	131.9 Å²	131.9	66%	0.657	74%	0.743	S	S	*	*				60.1	155.2	129.9	85.3	0	0	0	0	121.8
926	L	25.9	Very low	27	Very low	139 Å²	139	128.1 Å²	128.1	73%	0.728	74%	0.739	S	S	*	*			cis	-164.5	144.7	-7.4	-119.7	168.8	0	0	0	108.9
927	T	24.1	Very low	27.4	Very low	92 Å²	92	128.2 Å²	128.2	56%	0.564	74%	0.742	S	S	*	*			trans	49.2	141.2	147.2	42.4	0	0	0	0	125
928	Q	27.7	Very low	27.6	Very low	161 Å²	161	128.7 Å²	128.7	75%	0.752	74%	0.744	S	S	*	*			trans	75	105.9	134.1	-70	160.5	12.1	0	0	120.7
929	S	23.5	Very low	28.3	Very low	100 Å²	100	126.3 Å²	126.3	70%	0.699	75%	0.746	S	S	*	*				32.2	158.6	92.8	79.6	0	0	0	0	120
930	P	35.4	Very low	28.6	Very low	102 Å²	102	125 Å²	125	66%	0.662	75%	0.747	S	S	*	*			cis	-138.9	-165.3	-5.4	41.1	-21.9	0	0	0	114.1
931	L	27.7	Very low	28.9	Very low	157 Å²	157	126.1 Å²	126.1	82%	0.822	75%	0.752	S	S	*	*			trans	62.8	157.2	156	-92.2	62.1	0	0	0	117.8
932	S	25.2	Very low	29.5	Very low	90 Å²	90	124.8 Å²	124.8	63%	0.629	75%	0.752	S	S	*	*			cis	178.2	141.8	-33.1	50.7	0	0	0	0	108.7
933	S	29	Very low	29.7	Very low	107 Å²	107	120.4 Å²	120.4	75%	0.748	74%	0.742	S	S	*	*				157.1	134.1	128.7	54	0	0	0	0	115.6
934	T	31.5	Very low	29.6	Very low	126 Å²	126	125.4 Å²	125.4	77%	0.773	75%	0.747	S	S	*	*			trans	44.5	111.8	145	57.4	0	0	0	0	122.3
935	P	31.6	Very low	29.7	Very low	124 Å²	124	125.3 Å²	125.3	81%	0.805	74%	0.742	S	S	*	*			trans	-103.6	147.1	139.1	36.3	-29.1	0	0	0	112.2
936	P	37.8	Very low	29.8	Very low	124 Å²	124	127.2 Å²	127.2	81%	0.805	75%	0.745	S	S	*	*			trans	-105.2	159.2	162.6	34.6	-26.8	0	0	0	113.1
937	P	35	Very low	29.9	Very low	123 Å²	123	126.7 Å²	126.7	80%	0.799	75%	0.748	S	S	*	*			trans	-126.5	177.9	-146.7	41.5	-27.4	0	0	0	116.9
938	L	26.2	Very low	29.9	Very low	165 Å²	165	127.8 Å²	127.8	86%	0.864	75%	0.754	S	S	*	*			trans	-89.6	148.9	160.4	-74.6	83.9	0	0	0	111.2
939	P	38.6	Very low	30	Very low	123 Å²	123	127.7 Å²	127.7	80%	0.799	75%	0.753	S	S	*	*			trans	-88.5	149.1	165.8	34.6	-32.8	0	0	0	113.1
940	P	32.6	Very low	30.2	Very low	112 Å²	112	128.1 Å²	128.1	73%	0.727	75%	0.748	S	S	*	*			trans	-107.6	168.8	-179.5	40.5	-35.3	0	0	0	114.9
941	P	30.7	Very low	29.8	Very low	124 Å²	124	130.3 Å²	130.3	81%	0.805	75%	0.753	S	S	*	*			trans	-101.3	148.7	169.2	37.2	-31.5	0	0	0	113.9
942	P	36	Very low	30	Very low	129 Å²	129	130.2 Å²	130.2	84%	0.838	75%	0.751	S	S	*	*			trans	-114.7	169	177.6	40.5	-33.1	0	0	0	116.2
943	S	26.6	Very low	30.2	Very low	93 Å²	93	134.1 Å²	134.1	65%	0.65	76%	0.757	S	S	*	*			trans	-159.7	151	167.8	54.2	0	0	0	0	106.4
944	Y	25.9	Very low	30.2	Very low	201 Å²	201	135.6 Å²	135.6	79%	0.788	76%	0.757	S	S	*	*				-175.1	172.6	52.8	-114.5	-74.6	0	0	0	110.4
945	H	27.9	Very low	30.1	Very low	146 Å²	146	136.4 Å²	136.4	68%	0.676	75%	0.752	S	S	*	*			trans	72.7	115.7	148.4	-93.4	-79.1	0	0	0	124.4
946	N	27.1	Very low	29.9	Very low	133 Å²	133	137.2 Å²	137.2	71%	0.711	75%	0.747	S	S	*	*			trans	14.8	143.5	130.5	-41.4	0.6	0	0	0	119.6
947	V	27.2	Very low	29.5	Very low	129 Å²	129	137.7 Å²	137.7	78%	0.782	74%	0.739	S	S	*	*				-171.9	136.8	71.2	160.3	0	0	0	0	113.1
948	V	24.8	Very low	29.4	Very low	115 Å²	115	136.5 Å²	136.5	70%	0.697	73%	0.729	S	S	*	*			trans	3.4	126.7	148.9	-167	0	0	0	0	121.6
949	H	29	Very low	29.3	Very low	159 Å²	159	130.2 Å²	130.2	74%	0.736	70%	0.699	S	S	*	*				-170.3	128.4	117.8	-122.3	-106.5	0	0	0	116.1
950	N	29.1	Very low	28.6	Very low	109 Å²	109	131.6 Å²	131.6	58%	0.583	69%	0.693	S	S	*	*			trans	42.3	118.1	142.7	-66.9	16.4	0	0	0	121.7
951	L	25.9	Very low	28.3	Very low	148 Å²	148	131.1 Å²	131.1	78%	0.775	69%	0.688	S	S	*	*				86.9	129	69.1	-81.1	170.2	0	0	0	114.4
952	I	31.5	Very low	28	Very low	154 Å²	154	130.6 Å²	130.6	79%	0.79	69%	0.687	S	S	*	*			trans	167.5	122.1	132.1	-88.6	159.1	0	0	0	114.3
953	K	30.8	Very low	27.4	Very low	173 Å²	173	129.3 Å²	129.3	75%	0.752	67%	0.673	S	S	*	*			trans	54.5	104	146.7	-62.6	-179.9	-179.8	-175.8	0	125.1
954	D	28.6	Very low	27.3	Very low	138 Å²	138	131.2 Å²	131.2	74%	0.738	68%	0.681	S	S	*	*				55.4	127.5	95.1	-44.8	-25.3	0	0	0	124.8
955	H	28.5	Very low	27.3	Very low	143 Å²	143	130.2 Å²	130.2	66%	0.662	68%	0.684	S	S	*	*			trans	57.8	127.4	143.1	-75.8	-66.9	0	0	0	124.3	P975 I976	H955-P975 PolarHBondContact CE1-O 3.15Å; H955-P975 PolarHBondContact ND1-O 2.9Å; H955-I976 PolarHBondContact ND1-O 2.69Å
956	I	29.2	Very low	27.3	Very low	140 Å²	140	131.7 Å²	131.7	72%	0.718	69%	0.691	S	S	*	*			trans	-141.9	152.3	156.2	-83.9	-169.6	0	0	0	110.5	I976	I956-I976 WeakPolarHBondContact O-CB 3.44Å; I956-I976 WeakPolarHBondContact O-CG2 3.36Å
957	Q	28.2	Very low	27.3	Very low	135 Å²	135	130.2 Å²	130.2	63%	0.631	69%	0.691	S	S	*	*			trans	-63.3	166.6	-172.8	-52.3	-166.7	-100.4	0	0	114.3	E974	Q957-E974 WeakPolarHBondContact CB-OE2 3.42Å; Q957-E974 WeakPolarHBondContact CG-OE2 3.41Å; Q957-E974 PolarHBondContact NE2-OE2 3.18Å
958	T	32.6	Very low	27.3	Very low	97 Å²	97	128.9 Å²	128.9	60%	0.595	69%	0.686	S	S	*	*			cis	-140.7	166.8	20.6	47.7	0	0	0	0	112.8	P975 I976	T958-P975 VanDerWaalsContact CA-CG 3.42Å; T958-P975 WeakPolarHBondContact O-CB 3.47Å; T958-P975 WeakPolarHBondContact O-CG 3.36Å; T958-I976 WeakPolarHBondContact O-CD1 3.21Å
959	S	25.5	Very low	27.5	Very low	33 Å²	33	129.9 Å²	129.9	23%	0.231	68%	0.683	C	S	.	*			trans	-110.8	161.7	-179.8	58.1	0	0	0	0	115.1	E973 E974	S959-E973 WeakPolarHBondContact CB-O 3.42Å; S959-E973 VanDerWaalsContact OG-C 3.23Å; S959-E973 WeakPolarHBondContact OG-CA 3.42Å; S959-E973 PolarHBondContact OG-N 3.34Å; S959-E974 WeakPolarHBondContact CB-OE1 3.35Å; S959-E974 PolarHBondContact N-OE1 3.03Å; S959-E974 PolarHBondContact OG-OE1 2.92Å
960	F	23.9	Very low	27.6	Very low	153 Å²	153	129 Å²	129	67%	0.671	68%	0.679	S	S	*	*			trans	33.8	107.5	162.5	-79.9	-80.7	0	0	0	121
961	V	25.4	Very low	27.6	Very low	102 Å²	102	129.8 Å²	129.8	62%	0.618	68%	0.681	S	S	*	*				46.2	112	126.7	-176.3	0	0	0	0	119.1	N963	V961-N963 WeakPolarHBondContact CG1-OD1 3.42Å
962	S	23.9	Very low	27.8	Very low	113 Å²	113	128.3 Å²	128.3	79%	0.79	67%	0.669	S	S	*	*			trans	-156.4	121.6	139	-62.6	0	0	0	0	107.3
963	N	24.1	Very low	27.7	Very low	101 Å²	101	125.6 Å²	125.6	54%	0.54	65%	0.652	S	S	.	*				88.7	93.1	52.4	-70.8	8.9	0	0	0	113.3	V961	V961-N963 WeakPolarHBondContact CG1-OD1 3.42Å
964	T	24.6	Very low	27.7	Very low	134 Å²	134	121.3 Å²	121.3	82%	0.822	64%	0.635	S	S	*	*	S	Bend	trans	-164.3	121.4	148.2	22.2	0	0	0	0	106.8
965	E	25.7	Very low	28	Very low	179 Å²	179	116.1 Å²	116.1	84%	0.836	61%	0.609	S	S	*	*	S	Bend	cis	-121.5	151.2	-4.1	-71.2	141.9	175.1	0	0	107.9
966	E	27	Very low	28.1	Very low	178 Å²	178	113.1 Å²	113.1	83%	0.832	60%	0.597	S	S	*	*	S	Bend	cis	-152.7	160.3	20.5	-149.1	170.2	-164.9	0	0	111.5
967	S	27.5	Very low	28.3	Very low	102 Å²	102	113.6 Å²	113.6	71%	0.713	60%	0.599	S	S	*	*			trans	70.4	101.7	167.8	-55.7	0	0	0	0	120.4
968	C	27	Very low	28.3	Very low	100 Å²	100	114 Å²	114	68%	0.676	61%	0.605	S	S	*	*			trans	47.7	101	148.9	-59.8	0	0	0	0	119.4
969	E	29.8	Very low	28.1	Very low	136 Å²	136	114.5 Å²	114.5	64%	0.636	61%	0.613	S	S	*	*				77	142.2	81.5	-76.2	173	93.2	0	0	113.7
970	Q	30.7	Very low	28.2	Very low	140 Å²	140	118.7 Å²	118.7	65%	0.654	64%	0.637	S	S	*	*			cis	-160.1	172.4	-0.4	-94.3	168.1	43.2	0	0	104.7
971	M	29	Very low	28.3	Very low	126 Å²	126	120.3 Å²	120.3	62%	0.621	65%	0.647	S	S	*	*			cis	-174	175	-21.7	-97.6	-164	-50	0	0	104.5
972	K	30.3	Very low	28.3	Very low	118 Å²	118	119.7 Å²	119.7	51%	0.513	65%	0.653	S	S	.	*			cis	-163.5	-179	2.7	-132	174.6	154.4	-74.5	0	108.9
973	E	30.1	Very low	28.6	Very low	97 Å²	97	122.6 Å²	122.6	45%	0.453	65%	0.654	S	S	.	*			trans	65.9	161.6	161.3	-86.9	45.8	-52.7	0	0	118.3	S959	S959-E973 WeakPolarHBondContact CB-O 3.42Å; S959-E973 VanDerWaalsContact OG-C 3.23Å; S959-E973 WeakPolarHBondContact OG-CA 3.42Å; S959-E973 PolarHBondContact OG-N 3.34Å
974	E	29.9	Very low	28.7	Very low	83 Å²	83	124.7 Å²	124.7	39%	0.388	67%	0.665	S	S	.	*				-150.2	157.8	-52.5	-102.7	-44.6	80.1	0	0	107.6	Q957 S959	Q957-E974 WeakPolarHBondContact CB-OE2 3.42Å; Q957-E974 WeakPolarHBondContact CG-OE2 3.41Å; Q957-E974 PolarHBondContact NE2-OE2 3.18Å; S959-E974 WeakPolarHBondContact CB-OE1 3.35Å; S959-E974 PolarHBondContact N-OE1 3.03Å; S959-E974 PolarHBondContact OG-OE1 2.92Å
975	P	35.8	Very low	28.8	Very low	28 Å²	28	124.1 Å²	124.1	18%	0.182	66%	0.661	C	S	.	*				-151	-178.7	-119.2	43.4	-22	0	0	0	119.1	H955 T958	H955-P975 PolarHBondContact CE1-O 3.15Å; H955-P975 PolarHBondContact ND1-O 2.9Å; T958-P975 VanDerWaalsContact CA-CG 3.42Å; T958-P975 WeakPolarHBondContact O-CB 3.47Å; T958-P975 WeakPolarHBondContact O-CG 3.36Å
976	I	30.3	Very low	29	Very low	81 Å²	81	123.8 Å²	123.8	42%	0.415	66%	0.659	S	S	.	*			trans	64	142	146.9	-80.7	177.2	0	0	0	120.1	H955 I956 T958	H955-I976 PolarHBondContact ND1-O 2.69Å; I956-I976 WeakPolarHBondContact O-CB 3.44Å; I956-I976 WeakPolarHBondContact O-CG2 3.36Å; T958-I976 WeakPolarHBondContact O-CD1 3.21Å
977	I	32.4	Very low	28.9	Very low	149 Å²	149	120 Å²	120	76%	0.764	65%	0.652	S	S	*	*			cis	-160.7	-152.3	-21.3	-154.7	168.4	0	0	0	110.6
978	N	28.4	Very low	29.2	Very low	143 Å²	143	121.6 Å²	121.6	77%	0.765	66%	0.658	S	S	*	*			trans	-123.6	157.3	-172.6	-73.5	-45.1	0	0	0	114.9
979	S	28.3	Very low	29.5	Very low	108 Å²	108	121.9 Å²	121.9	76%	0.755	66%	0.661	S	S	*	*			trans	73.2	115.8	144.3	-66	0	0	0	0	124.8
980	V	28.4	Very low	29.7	Very low	122 Å²	122	122.4 Å²	122.4	74%	0.739	67%	0.666	S	S	*	*				64.5	114.3	128.6	-176.4	0	0	0	0	121.5
981	E	25	Very low	29.7	Very low	187 Å²	187	123 Å²	123	87%	0.874	67%	0.669	S	S	*	*			trans	39.5	135.2	141.8	-59.4	-171.9	142.6	0	0	120.9
982	A	26.4	Very low	29.8	Very low	89 Å²	89	124.3 Å²	124.3	74%	0.736	67%	0.674	S	S	*	*			cis	-166.4	-177.3	23.3	0	0	0	0	0	113.9
983	Q	28.8	Very low	29.8	Very low	174 Å²	174	126.2 Å²	126.2	81%	0.813	68%	0.682	S	S	*	*			trans	92.4	103.2	158.1	-52	-167.2	15	0	0	121.3
984	N	26.8	Very low	29.8	Very low	145 Å²	145	127.5 Å²	127.5	78%	0.775	69%	0.692	S	S	*	*				46.6	135.8	127	-52.2	-20.1	0	0	0	123.8
985	V	27.8	Very low	29.8	Very low	121 Å²	121	129.4 Å²	129.4	73%	0.733	71%	0.705	S	S	*	*				151.3	118.6	114.3	168.4	0	0	0	0	114
986	H	29.9	Very low	29.5	Very low	172 Å²	172	133 Å²	133	80%	0.796	73%	0.726	S	S	*	*			trans	46.9	166.9	154.2	-69.3	-46.4	0	0	0	124.1
987	S	24.8	Very low	29.5	Very low	98 Å²	98	134.9 Å²	134.9	69%	0.685	74%	0.742	S	S	*	*			cis	173.4	118.3	-45.7	-87.4	0	0	0	0	111.8
988	T	33.4	Very low	29.2	Very low	137 Å²	137	135.3 Å²	135.3	84%	0.84	74%	0.74	S	S	*	*			trans	-164.5	142.4	164.3	42.1	0	0	0	0	115.3
989	S	33.4	Very low	28.9	Very low	105 Å²	105	133.8 Å²	133.8	73%	0.734	74%	0.736	S	S	*	*			trans	66.3	146.9	151.9	-60.7	0	0	0	0	120.4
990	I	34.4	Very low	29	Very low	147 Å²	147	134.5 Å²	134.5	75%	0.754	74%	0.736	S	S	*	*			cis	-151.5	169.5	-6.3	-112.1	162.8	0	0	0	110.3
991	Q	30.8	Very low	28.8	Very low	154 Å²	154	136.6 Å²	136.6	72%	0.72	74%	0.738	S	S	*	*			trans	-56.7	163.2	-176.1	-60.4	126.7	-28.3	0	0	115.2
992	H	31.2	Very low	28.9	Very low	153 Å²	153	133 Å²	133	71%	0.708	73%	0.725	S	S	*	*			cis	-138.8	169.6	24.1	-83.2	-97.4	0	0	0	111.1
993	F	29	Very low	29	Very low	158 Å²	158	135.6 Å²	135.6	69%	0.693	72%	0.721	S	S	*	*			cis	-153.8	130.1	6	-132.6	-56.6	0	0	0	109
994	N	30.5	Very low	28.9	Very low	124 Å²	124	135.4 Å²	135.4	66%	0.663	72%	0.718	S	S	*	*			trans	49.6	141.9	157.7	-70.6	11.8	0	0	0	121.6
995	N	30	Very low	28.8	Very low	122 Å²	122	133.5 Å²	133.5	65%	0.652	72%	0.716	S	S	*	*			cis	-165.3	152.5	-6.6	-122.5	4.2	0	0	0	114
996	T	30.5	Very low	28.9	Very low	103 Å²	103	132.5 Å²	132.5	63%	0.632	72%	0.715	S	S	*	*			trans	29.3	111.4	143.2	56.5	0	0	0	0	120.2
997	T	28.5	Very low	28.7	Very low	121 Å²	121	131 Å²	131	74%	0.742	71%	0.713	S	S	*	*				95.8	133.8	62.2	58	0	0	0	0	116.1
998	H	26.6	Very low	28.8	Very low	158 Å²	158	131.4 Å²	131.4	73%	0.731	71%	0.711	S	S	*	*			trans	61.8	112.5	142.9	-89.7	-84.4	0	0	0	123.3
999	T	23.4	Very low	28.5	Very low	111 Å²	111	132 Å²	132	68%	0.681	71%	0.706	S	S	*	*			trans	57.5	160.4	130.5	51.9	0	0	0	0	122.1
1000	T	28.8	Very low	28.1	Very low	124 Å²	124	133.7 Å²	133.7	76%	0.761	71%	0.707	S	S	*	*			trans	70.5	124.6	178.8	63.4	0	0	0	0	113.4
1001	E	24.7	Very low	27.8	Very low	166 Å²	166	132 Å²	132	78%	0.776	71%	0.709	S	S	*	*				57.6	136.8	89.7	-61.7	-162.8	-142.7	0	0	114
1002	N	26.7	Very low	27.6	Very low	112 Å²	112	129.7 Å²	129.7	60%	0.599	71%	0.709	S	S	*	*			cis	-161.7	170.8	-7.6	-124	-40.1	0	0	0	110.4
1003	H	28.6	Very low	27.3	Very low	142 Å²	142	131.7 Å²	131.7	66%	0.657	72%	0.716	S	S	*	*			trans	69.6	138.6	152.5	-75.3	-48.2	0	0	0	123.8
1004	F	27.6	Very low	27	Very low	170 Å²	170	128.1 Å²	128.1	75%	0.746	71%	0.711	S	S	*	*			trans	42.5	106.3	150	-61.7	-63.3	0	0	0	119.7
1005	S	24	Very low	26.7	Very low	106 Å²	106	127.7 Å²	127.7	74%	0.741	71%	0.713	S	S	*	*				67.9	119.6	76.2	-57.1	0	0	0	0	113.3
1006	S	29.2	Very low	26.5	Very low	100 Å²	100	128.7 Å²	128.7	70%	0.699	72%	0.717	S	S	*	*				-176.6	168.6	78.9	52.6	0	0	0	0	112.1
1007	N	27.2	Very low	26.3	Very low	141 Å²	141	131 Å²	131	75%	0.754	72%	0.721	S	S	*	*			trans	49.7	138.6	136.7	-67.5	6.7	0	0	0	121.4
1008	T	27.3	Very low	26.6	Very low	106 Å²	106	131.9 Å²	131.9	65%	0.65	72%	0.721	S	S	*	*			cis	-174.9	166.7	-7.5	15.3	0	0	0	0	108.7
1009	M	26.2	Very low	26.5	Very low	148 Å²	148	131.8 Å²	131.8	73%	0.729	73%	0.726	S	S	*	*			trans	52.9	105.4	142.7	-64.7	-72.1	168	0	0	117.7
1010	N	24.9	Very low	27.1	Very low	141 Å²	141	131.7 Å²	131.7	75%	0.754	73%	0.727	S	S	*	*				93.2	161.2	78	-88.9	8.8	0	0	0	114.3
1011	S	28.2	Very low	27.2	Very low	113 Å²	113	131 Å²	131	79%	0.79	72%	0.723	S	S	*	*			trans	86.9	135.1	176.7	82.7	0	0	0	0	115
1012	S	26.2	Very low	27.4	Very low	105 Å²	105	129.7 Å²	129.7	73%	0.734	72%	0.721	S	S	*	*			cis	-161.4	-178.4	-10.3	-119	0	0	0	0	113.1
1013	F	24.4	Very low	27.6	Very low	195 Å²	195	130.4 Å²	130.4	86%	0.855	73%	0.725	S	S	*	*			trans	-18.3	152.3	146.4	-80.6	-113.7	0	0	0	116.6
1014	S	23.7	Very low	27.6	Very low	82 Å²	82	129.7 Å²	129.7	57%	0.573	73%	0.726	S	S	*	*			cis	-179.4	178.9	-10.6	54.6	0	0	0	0	110.4
1015	T	23.8	Very low	27.7	Very low	115 Å²	115	128.5 Å²	128.5	71%	0.706	73%	0.726	S	S	*	*			trans	39.4	113.9	145.3	54.6	0	0	0	0	119.4
1016	L	26.6	Very low	28.5	Very low	144 Å²	144	129.2 Å²	129.2	75%	0.754	73%	0.728	S	S	*	*				-163.2	154.5	110.3	-127.6	68.4	0	0	0	112.2
1017	E	26.8	Very low	28.3	Very low	152 Å²	152	135.5 Å²	135.5	71%	0.71	74%	0.736	S	S	*	*			trans	68	145	147.2	-82	173.6	-163.6	0	0	124.1
1018	N	33.7	Very low	28.3	Very low	138 Å²	138	132.9 Å²	132.9	74%	0.738	74%	0.735	S	S	*	*			trans	77	76.3	152.1	-55.3	-24.1	0	0	0	121.1
1019	N	25	Very low	28	Very low	157 Å²	157	135.5 Å²	135.5	84%	0.84	74%	0.744	S	S	*	*				-4.2	149.4	116.9	-82.3	-10.9	0	0	0	117.1
1020	P	36	Very low	27.9	Very low	108 Å²	108	133.3 Å²	133.3	70%	0.701	74%	0.743	S	S	*	*			cis	-145.7	179.7	48.3	43.4	-25.2	0	0	0	119
1021	T	30.5	Very low	28	Very low	110 Å²	110	134.1 Å²	134.1	68%	0.675	75%	0.747	S	S	*	*			trans	69.6	98.4	159.4	46.4	0	0	0	0	120.5
1022	D	29.3	Very low	27.9	Very low	138 Å²	138	136.9 Å²	136.9	74%	0.738	75%	0.751	S	S	*	*				92.9	112.3	119.2	-52.5	-15	0	0	0	123.1
1023	D	29.9	Very low	28	Very low	127 Å²	127	136.7 Å²	136.7	68%	0.679	75%	0.75	S	S	*	*			trans	82.6	99.1	136.1	-72.3	-25.3	0	0	0	124.7
1024	N	29.7	Very low	28.1	Very low	127 Å²	127	135.7 Å²	135.7	68%	0.679	75%	0.748	S	S	*	*				56.3	151.8	92.8	-71.8	-32.8	0	0	0	120.8
1025	I	29.7	Very low	28.2	Very low	145 Å²	145	137.2 Å²	137.2	74%	0.744	76%	0.758	S	S	*	*			cis	-164.4	-168.7	-20.7	-141.4	-179.9	0	0	0	108.2
1026	P	41	Very low	28.5	Very low	121 Å²	121	136.9 Å²	136.9	79%	0.786	76%	0.756	S	S	*	*				-123.8	-110.3	-116.8	44.5	-26.6	0	0	0	117.2
1027	R	24.7	Very low	28.4	Very low	232 Å²	232	137.9 Å²	137.9	88%	0.875	76%	0.757	S	S	*	*			trans	-115.6	123.5	-160.2	169.5	-163.6	-82.1	-163.6	-2.6	112.1
1028	A	25.9	Very low	28.3	Very low	87 Å²	87	137.8 Å²	137.8	72%	0.719	76%	0.761	S	S	*	*			trans	73	145.4	149.6	0	0	0	0	0	121.9
1029	L	22.1	Very low	28.1	Very low	161 Å²	161	134.9 Å²	134.9	84%	0.843	76%	0.756	S	S	*	*			trans	72.3	142	163.7	-66.6	169.1	0	0	0	118.6
1030	S	23.2	Very low	28.2	Very low	101 Å²	101	134.8 Å²	134.8	71%	0.706	75%	0.75	S	S	*	*			trans	64.1	138.8	170.8	11.7	0	0	0	0	114.5
1031	D	27.9	Very low	28	Very low	159 Å²	159	135.9 Å²	135.9	85%	0.85	76%	0.755	S	S	*	*			cis	-149.5	-164.4	16.8	-96.3	-42.6	0	0	0	112.7
1032	I	25.2	Very low	27.9	Very low	170 Å²	170	136 Å²	136	87%	0.872	75%	0.751	S	S	*	*			trans	-113.4	116	177.7	-60.9	171.3	0	0	0	110.9
1033	S	27.9	Very low	28	Very low	102 Å²	102	136.6 Å²	136.6	71%	0.713	75%	0.749	S	S	*	*			trans	-164.1	122.4	154.2	38.4	0	0	0	0	106.4
1034	E	28.5	Very low	27.8	Very low	173 Å²	173	137.3 Å²	137.3	81%	0.808	75%	0.748	S	S	*	*				57.7	109.7	92.6	-72.7	-172.3	131.5	0	0	112.3
1035	C	24.9	Very low	27.7	Very low	115 Å²	115	135.2 Å²	135.2	78%	0.777	74%	0.743	S	S	*	*				70.7	131.4	85.6	-65.2	0	0	0	0	111.4
1036	T	29.2	Very low	27.5	Very low	108 Å²	108	135.6 Å²	135.6	66%	0.663	75%	0.747	S	S	*	*			cis	-144.2	166.3	19.4	-6.5	0	0	0	0	110.3
1037	E	24.7	Very low	26.6	Very low	165 Å²	165	135.1 Å²	135.1	77%	0.771	75%	0.747	S	S	*	*				36.2	132	100	-59.5	168.6	177.9	0	0	114.2
1038	D	24.7	Very low	26.7	Very low	150 Å²	150	130.8 Å²	130.8	80%	0.802	74%	0.739	S	S	*	*			cis	-162.5	-161.6	10.2	-136.7	-23.9	0	0	0	112.6
1039	A	29.7	Very low	26.8	Very low	77 Å²	77	135.2 Å²	135.2	64%	0.636	74%	0.742	S	S	*	*			trans	90.9	143.1	155.9	0	0	0	0	0	117.9
1040	E	27.7	Very low	26.9	Very low	154 Å²	154	135.4 Å²	135.4	72%	0.72	74%	0.739	S	S	*	*			cis	-159.5	138	-9.5	-122.1	169.1	-172.1	0	0	111.4	I1042	E1040-I1042 HydrophobicContact CB-CD1 4.39Å; E1040-I1042 HydrophobicContact CG-CD1 3.92Å; E1040-I1042 HydrophobicContact CG-CG1 4.47Å
1041	T	30.7	Very low	27	Very low	131 Å²	131	135.3 Å²	135.3	80%	0.804	74%	0.738	S	S	*	*				177.6	119.1	126.6	26.9	0	0	0	0	108.7
1042	I	30.1	Very low	26.9	Very low	113 Å²	113	134.4 Å²	134.4	58%	0.579	73%	0.732	S	S	*	*				74	122.8	58	-61.9	164.6	0	0	0	110.3	E1040	E1040-I1042 HydrophobicContact CB-CD1 4.39Å; E1040-I1042 HydrophobicContact CG-CD1 3.92Å; E1040-I1042 HydrophobicContact CG-CG1 4.47Å
1043	H	31	Very low	27.1	Very low	150 Å²	150	133.1 Å²	133.1	69%	0.694	73%	0.725	S	S	*	*			cis	-151.9	174.2	1.7	-136.5	-123.7	0	0	0	114.6
1044	E	25	Very low	27.1	Very low	143 Å²	143	134.6 Å²	134.6	67%	0.668	73%	0.725	S	S	*	*			trans	-55.4	-179.6	174.3	-41	168.9	126.3	0	0	119.1
1045	S	27.5	Very low	27.2	Very low	83 Å²	83	133.4 Å²	133.4	58%	0.58	72%	0.723	S	S	*	*			trans	83.6	96.4	131.2	-76.4	0	0	0	0	122.3
1046	N	25.8	Very low	27.3	Very low	152 Å²	152	132.4 Å²	132.4	81%	0.813	72%	0.718	S	S	*	*				56.9	106.4	107.3	-68.6	-43.1	0	0	0	121.2
1047	S	23.1	Very low	27.4	Very low	112 Å²	112	133.6 Å²	133.6	78%	0.783	72%	0.719	S	S	*	*				104.2	152.3	119.4	-148.4	0	0	0	0	120.6
1048	I	25.9	Very low	27.5	Very low	140 Å²	140	133 Å²	133	72%	0.718	72%	0.716	S	S	*	*			trans	79.4	103.2	164.9	-56.3	-176.3	0	0	0	119.1
1049	K	27.1	Very low	27.7	Very low	181 Å²	181	132 Å²	132	79%	0.787	71%	0.712	S	S	*	*			trans	71.7	130.2	144.2	-73.7	178	179	-179.8	0	122.8
1050	Q	25.4	Very low	27.7	Very low	165 Å²	165	136 Å²	136	77%	0.771	72%	0.717	S	S	*	*			trans	56.5	102.7	137.4	-71.5	-175	-39.5	0	0	118
1051	S	24.8	Very low	27.7	Very low	99 Å²	99	135.4 Å²	135.4	69%	0.692	72%	0.718	S	S	*	*				85.6	146.5	100.5	78	0	0	0	0	112.8
1052	I	26.9	Very low	27.5	Very low	140 Å²	140	133.5 Å²	133.5	72%	0.718	71%	0.71	S	S	*	*				-170.3	149.8	50.5	-142.7	158.2	0	0	0	108.3
1053	I	29.1	Very low	27.5	Very low	142 Å²	142	133.4 Å²	133.4	73%	0.728	72%	0.715	S	S	*	*			trans	63.5	139.6	162.7	-69.3	171.4	0	0	0	116
1054	N	27.1	Very low	27.4	Very low	134 Å²	134	133.5 Å²	133.5	72%	0.717	72%	0.72	S	S	*	*			cis	-166.3	170.9	-10.2	-105.8	9.3	0	0	0	106.2
1055	L	30.9	Very low	27.6	Very low	147 Å²	147	134.5 Å²	134.5	77%	0.77	73%	0.729	S	S	*	*			cis	-122.6	177.1	-0.8	-90.2	115.2	0	0	0	108
1056	S	27	Very low	27.8	Very low	94 Å²	94	137.1 Å²	137.1	66%	0.657	74%	0.736	S	S	*	*			cis	70	127.9	47.9	-116.6	0	0	0	0	114.3
1057	L	30.7	Very low	28	Very low	133 Å²	133	135.1 Å²	135.1	70%	0.696	73%	0.73	S	S	*	*			cis	-137.9	136.1	21.3	-73.9	160.3	0	0	0	113.8
1058	Q	27.7	Very low	28.4	Very low	152 Å²	152	135.9 Å²	135.9	71%	0.71	73%	0.73	S	S	*	*			trans	58.8	147.2	133.6	-54.7	-173.1	-85.1	0	0	122.3
1059	D	29.4	Very low	28.5	Very low	131 Å²	131	138.5 Å²	138.5	70%	0.701	74%	0.736	S	S	*	*			cis	-176.5	149.1	-18	-81.2	-31.3	0	0	0	104.2
1060	E	28.3	Very low	28.6	Very low	159 Å²	159	137.1 Å²	137.1	74%	0.743	74%	0.736	S	S	*	*			cis	-147.4	157.2	-8.9	-98	-143.8	97.5	0	0	106.2
1061	L	27.9	Very low	28.8	Very low	143 Å²	143	136.1 Å²	136.1	75%	0.749	74%	0.736	S	S	*	*				72.7	134.3	55.7	-67.5	170.1	0	0	0	115.3
1062	S	25.8	Very low	28.9	Very low	90 Å²	90	136.1 Å²	136.1	63%	0.629	73%	0.732	S	S	*	*			cis	-161.5	142.5	-7.4	-155.1	0	0	0	0	116.7
1063	T	30.4	Very low	28.8	Very low	112 Å²	112	137 Å²	137	69%	0.687	73%	0.73	S	S	*	*			trans	31	127.3	141.7	59.5	0	0	0	0	126.9
1064	D	30	Very low	28.4	Very low	151 Å²	151	136.6 Å²	136.6	81%	0.807	73%	0.73	S	S	*	*			trans	45.5	132.8	130.1	-56.9	-21.9	0	0	0	126.3
1065	L	29.3	Very low	28.4	Very low	164 Å²	164	135.1 Å²	135.1	86%	0.859	72%	0.722	S	S	*	*				169.4	155.3	100.9	-157.5	64.4	0	0	0	116.1
1066	L	31.1	Very low	28.3	Very low	139 Å²	139	133.6 Å²	133.6	73%	0.728	71%	0.714	S	S	*	*			trans	-8.5	139.7	175.5	-96.6	77.8	0	0	0	127.5
1067	T	30.7	Very low	28.4	Very low	110 Å²	110	133 Å²	133	68%	0.675	71%	0.709	S	S	*	*			trans	70.5	93.5	138.3	50.5	0	0	0	0	125.6
1068	T	31.8	Very low	28.1	Very low	127 Å²	127	133.8 Å²	133.8	78%	0.779	72%	0.719	S	S	*	*				71.1	124.7	123	56	0	0	0	0	124.9
1069	K	27.1	Very low	28.5	Very low	195 Å²	195	131 Å²	131	85%	0.848	72%	0.716	S	S	*	*			trans	95.1	107.4	152.9	-71.2	-177.3	177.8	179	0	120
1070	L	29	Very low	28.6	Very low	152 Å²	152	129.8 Å²	129.8	80%	0.796	72%	0.717	S	S	*	*			trans	4.4	136.1	130.4	-60.6	156.9	0	0	0	116.4
1071	L	29.7	Very low	28.5	Very low	145 Å²	145	129.6 Å²	129.6	76%	0.759	72%	0.716	S	S	*	*			cis	-155.6	161.1	-6.7	-86	160.9	0	0	0	103.8
1072	T	26.3	Very low	28.3	Very low	99 Å²	99	129.7 Å²	129.7	61%	0.607	72%	0.717	S	S	*	*			cis	-157.1	-157.8	24.6	-23.3	0	0	0	0	107
1073	F	24.8	Very low	28.6	Very low	157 Å²	157	130.3 Å²	130.3	69%	0.689	72%	0.719	S	S	*	*	S	Bend	trans	-108.5	128.3	134.1	-137.8	-86.7	0	0	0	106.4	N1075 L1076	F1073-N1075 VanDerWaalsContact CG-N 3.34Å; F1073-L1076 HydrophobicContact CE1-CD1 4.19Å; F1073-L1076 HydrophobicContact CZ-CB 4.3Å; F1073-L1076 HydrophobicContact CZ-CD1 3.82Å; F1073-L1076 HydrophobicContact CZ-CG 4.32Å
1074	D	21.2	Very low	28.4	Very low	135 Å²	135	131.8 Å²	131.8	72%	0.722	72%	0.721	S	S	*	*	S	Bend	cis	-4	94.2	-6.6	-76.1	9.1	0	0	0	119.4
1075	N	28.3	Very low	28.1	Very low	103 Å²	103	129 Å²	129	55%	0.551	71%	0.713	S	S	*	*			trans	73.4	157.9	148.6	-57.7	-56.5	0	0	0	119	F1073	F1073-N1075 VanDerWaalsContact CG-N 3.34Å
1076	L	27.6	Very low	27.8	Very low	115 Å²	115	125.6 Å²	125.6	60%	0.602	70%	0.703	S	S	*	*			cis	-171.1	141	-35.2	-163	104.2	0	0	0	106.3	F1073	F1073-L1076 HydrophobicContact CE1-CD1 4.19Å; F1073-L1076 HydrophobicContact CZ-CB 4.3Å; F1073-L1076 HydrophobicContact CZ-CD1 3.82Å; F1073-L1076 HydrophobicContact CZ-CG 4.32Å
1077	C	30.4	Very low	27.7	Very low	81 Å²	81	126.8 Å²	126.8	55%	0.547	71%	0.707	S	S	.	*			trans	63.1	140.9	174.2	-69	0	0	0	0	116.1
1078	T	23.8	Very low	27.5	Very low	150 Å²	150	127.4 Å²	127.4	92%	0.92	71%	0.706	S	S	*	*			cis	64.9	46.8	4	-7.7	0	0	0	0	115.4
1079	S	35.6	Very low	27.2	Very low	92 Å²	92	127 Å²	127	64%	0.643	70%	0.699	S	S	*	*			trans	-142.9	101.9	157.3	61.4	0	0	0	0	111.7
1080	C	31.3	Very low	27.3	Very low	106 Å²	106	123.7 Å²	123.7	72%	0.716	69%	0.686	S	S	*	*			trans	52.6	122.3	136.4	-58.1	0	0	0	0	118.9
1081	Q	25.5	Very low	27.2	Very low	156 Å²	156	123.8 Å²	123.8	73%	0.729	68%	0.68	S	S	*	*				57.3	115.5	69.9	-70.9	177.6	-65.2	0	0	113.9
1082	L	24.8	Very low	27.1	Very low	144 Å²	144	123.7 Å²	123.7	75%	0.754	68%	0.676	S	S	*	*			trans	72	163.5	137.7	-61.9	173.2	0	0	0	115.8
1083	P	32.5	Very low	27.2	Very low	104 Å²	104	124.1 Å²	124.1	68%	0.675	68%	0.675	S	S	*	*			cis	-119.3	163.7	8	49.3	-36.5	0	0	0	112.3
1084	I	25.4	Very low	27.6	Very low	142 Å²	142	123.7 Å²	123.7	73%	0.728	67%	0.674	S	S	*	*				56.9	133.2	103	-59	177.9	0	0	0	113.6
1085	S	23.3	Very low	27.7	Very low	93 Å²	93	123.5 Å²	123.5	65%	0.65	67%	0.673	S	S	*	*			cis	-172.2	-168.9	-13.1	-92.9	0	0	0	0	106.5
1086	S	24.1	Very low	27.9	Very low	93 Å²	93	125.6 Å²	125.6	65%	0.65	68%	0.683	S	S	*	*			trans	39.2	126.2	138	60.4	0	0	0	0	118.9
1087	M	29.1	Very low	27.8	Very low	163 Å²	163	124.5 Å²	124.5	80%	0.803	69%	0.685	S	S	*	*			cis	-130.5	133.1	44.3	-75.5	-171.3	70	0	0	111.6
1088	L	25.5	Very low	27.6	Very low	124 Å²	124	127.9 Å²	127.9	65%	0.649	70%	0.698	S	S	*	*				66.2	129	70.7	-84.2	167.7	0	0	0	112.9
1089	N	26.3	Very low	27.8	Very low	119 Å²	119	129 Å²	129	64%	0.636	70%	0.697	S	S	*	*			trans	70.7	143.4	161.9	-67.6	16	0	0	0	116.7
1090	E	28.9	Very low	27.4	Very low	124 Å²	124	129 Å²	129	58%	0.579	70%	0.697	S	S	*	*			cis	-147.2	153.5	-1.5	-120.7	165.4	134.7	0	0	110.8
1091	K	26.8	Very low	27.3	Very low	155 Å²	155	130.4 Å²	130.4	67%	0.674	70%	0.703	S	S	*	*				41.8	139.1	108.8	-67.6	179.1	-152	156.7	0	114.7
1092	Q	27.2	Very low	27.4	Very low	143 Å²	143	130.4 Å²	130.4	67%	0.668	70%	0.704	S	S	*	*			cis	-170	170.1	18	-131.2	174.2	-2.1	0	0	111.4
1093	N	29.5	Very low	27.5	Very low	108 Å²	108	128.2 Å²	128.2	58%	0.578	70%	0.697	S	S	*	*			trans	65	154.1	150.9	-60.2	-14.4	0	0	0	118
1094	H	31.9	Very low	27.5	Very low	147 Å²	147	129.8 Å²	129.8	68%	0.681	70%	0.7	S	S	*	*			cis	-144.5	137.2	-22.7	-96	-34.2	0	0	0	105.3
1095	N	24.8	Very low	27.6	Very low	131 Å²	131	127.8 Å²	127.8	70%	0.701	69%	0.694	S	S	*	*				73.8	142.3	71.4	-150	21	0	0	0	113.5
1096	I	31	Very low	28	Very low	147 Å²	147	127.4 Å²	127.4	75%	0.754	70%	0.697	S	S	*	*			trans	72.2	139.5	170.7	-53.4	165.7	0	0	0	115.8
1097	S	27.1	Very low	28.3	Very low	92 Å²	92	128.8 Å²	128.8	64%	0.643	70%	0.702	S	S	*	*			cis	-176.2	156.2	-46.2	54.3	0	0	0	0	109.2
1098	N	26.1	Very low	28.4	Very low	153 Å²	153	126.9 Å²	126.9	82%	0.818	70%	0.7	S	S	*	*			trans	17.4	129.7	151.6	-54.1	-11.6	0	0	0	120.8
1099	L	27.6	Very low	28.7	Very low	172 Å²	172	125.7 Å²	125.7	90%	0.901	70%	0.698	S	S	*	*				-172.4	163.1	100.5	-163.6	54.8	0	0	0	111.8
1100	S	26.7	Very low	29	Very low	93 Å²	93	126.5 Å²	126.5	65%	0.65	70%	0.702	S	S	*	*			trans	-124.9	149	-178.1	56.4	0	0	0	0	112.9
1101	T	30.3	Very low	29.2	Very low	136 Å²	136	126.3 Å²	126.3	83%	0.834	71%	0.705	S	S	*	*			trans	-166.9	124.3	149.3	5.8	0	0	0	0	116.8
1102	M	26	Very low	29.3	Very low	155 Å²	155	125.2 Å²	125.2	76%	0.764	71%	0.706	S	S	*	*			trans	23.4	119.7	139.6	-67	-170.7	67.7	0	0	126
1103	T	28.1	Very low	29.5	Very low	99 Å²	99	125.6 Å²	125.6	61%	0.607	72%	0.718	S	S	*	*				79.3	148.3	122	64.6	0	0	0	0	125.5
1104	N	31.3	Very low	29.5	Very low	137 Å²	137	131.7 Å²	131.7	73%	0.733	73%	0.733	S	S	*	*			trans	72.4	155	151.5	-62.5	-15.2	0	0	0	120.3
1105	T	28.6	Very low	29.7	Very low	99 Å²	99	129.7 Å²	129.7	61%	0.607	73%	0.733	S	S	*	*				-173	148.8	-60.5	25.6	0	0	0	0	110.5
1106	A	31.5	Very low	29.9	Very low	86 Å²	86	128.9 Å²	128.9	71%	0.711	73%	0.733	S	S	*	*			trans	69.4	148.9	162.6	0	0	0	0	0	117.6
1107	T	30.1	Very low	29.6	Very low	122 Å²	122	129.5 Å²	129.5	75%	0.748	73%	0.733	S	S	*	*			cis	174.2	149.2	-5.1	27.6	0	0	0	0	106.2
1108	T	30.7	Very low	29.7	Very low	123 Å²	123	130.8 Å²	130.8	76%	0.755	74%	0.737	S	S	*	*			cis	-146.9	-95.7	-19.2	12.3	0	0	0	0	111.1
1109	T	32.3	Very low	29.7	Very low	99 Å²	99	128.4 Å²	128.4	61%	0.607	72%	0.723	S	S	*	*			cis	-165.6	140.4	-20.2	-25.7	0	0	0	0	112
1110	N	33.1	Very low	29.9	Very low	135 Å²	135	126.8 Å²	126.8	72%	0.722	72%	0.715	S	S	*	*			trans	64.8	147.9	161.8	-63.1	-19.3	0	0	0	120.8
1111	N	32.7	Very low	30.1	Very low	121 Å²	121	128.7 Å²	128.7	65%	0.647	72%	0.718	S	S	*	*			cis	-166.5	154	-20.2	-107.3	-19.5	0	0	0	114.2
1112	N	29.2	Very low	30.2	Very low	132 Å²	132	130.1 Å²	130.1	71%	0.706	72%	0.719	S	S	*	*			trans	53.3	119.3	153.1	-55.8	-30	0	0	0	120.9
1113	T	32.1	Very low	30.4	Very low	150 Å²	150	125.2 Å²	125.2	92%	0.92	71%	0.708	S	S	*	*				179.6	-177.9	85.5	34.9	0	0	0	0	112.7
1114	R	28.6	Very low	30.3	Very low	236 Å²	236	129.7 Å²	129.7	89%	0.891	71%	0.714	S	S	*	*			trans	-133.6	161.7	-177.5	-133.5	-175	-178.7	-168.5	0	108.3
1115	P	36.9	Very low	30.1	Very low	105 Å²	105	130.3 Å²	130.3	68%	0.682	71%	0.712	S	S	*	*				-161.2	-174.1	75.6	42.1	-19	0	0	0	118.1
1116	T	27.5	Very low	29.9	Very low	114 Å²	114	132.2 Å²	132.2	70%	0.699	72%	0.717	S	S	*	*			trans	32.2	135.3	147.1	47.7	0	0	0	0	122.8
1117	E	25.1	Very low	29.9	Very low	161 Å²	161	136.4 Å²	136.4	75%	0.752	72%	0.715	S	S	*	*			cis	101.8	135.2	40.3	-176.6	-177	-85.4	0	0	113.1
1118	V	29	Very low	29.7	Very low	119 Å²	119	138.2 Å²	138.2	72%	0.721	72%	0.715	S	S	*	*			trans	155	111	142.8	155.6	0	0	0	0	107.8
1119	L	27.4	Very low	29.7	Very low	102 Å²	102	135.5 Å²	135.5	53%	0.534	71%	0.705	S	S	.	*				60.7	131	78.7	-69.5	161.1	0	0	0	111.3
1120	L	31.9	Very low	29.2	Very low	139 Å²	139	134.7 Å²	134.7	73%	0.728	70%	0.703	S	S	*	*			cis	-147.4	-178	41.2	-69.3	163.9	0	0	0	109.8
1121	D	30.7	Very low	28.7	Very low	133 Å²	133	137.4 Å²	137.4	71%	0.711	71%	0.709	S	S	*	*	S	Bend	cis	-147.7	-163	7.4	-144.2	-37.7	0	0	0	112.4
1122	I	31.9	Very low	28.2	Very low	166 Å²	166	136.2 Å²	136.2	85%	0.851	71%	0.709	S	S	*	*			trans	71.6	56.9	-173.1	-41.3	-177.5	0	0	0	112.6
1123	G	29.9	Very low	28.2	Very low	52 Å²	52	136.6 Å²	136.6	54%	0.536	71%	0.711	S	S	.	*			trans	-75.2	-176.4	149.9	0	0	0	0	0	112.4
1124	R	26.5	Very low	28	Very low	192 Å²	192	134.4 Å²	134.4	73%	0.725	69%	0.693	S	S	*	*			cis	-177.5	163.9	-5.4	-97.2	155.7	-167.4	-174.3	3.1	104.5
1125	Q	26	Very low	28	Very low	151 Å²	151	132.5 Å²	132.5	71%	0.706	69%	0.688	S	S	*	*			cis	-166.4	174.4	8.8	-132.8	175.7	27.8	0	0	111.1
1126	I	25.1	Very low	27.4	Very low	138 Å²	138	133 Å²	133	71%	0.708	69%	0.689	S	S	*	*			trans	72.1	107.9	149.6	-64.9	160.7	0	0	0	120.8	E1128	I1126-E1128 PolarHBondContact O-N 3.34Å
1127	R	31.2	Very low	27.2	Very low	174 Å²	174	135 Å²	135	66%	0.657	69%	0.694	S	S	*	*			trans	17.9	90.8	131.9	-168.2	-162.4	-64.8	153.1	0.5	119.4	N141	N141-R1127 WeakPolarHBondContact O-CG 3.49Å
1128	E	25.5	Very low	27.3	Very low	160 Å²	160	132.2 Å²	132.2	75%	0.748	69%	0.689	S	S	*	*			trans	-162.3	179.5	141	-126	175.5	-141.5	0	0	109.7	I1126	I1126-E1128 PolarHBondContact O-N 3.34Å
1129	A	31.7	Very low	27.2	Very low	67 Å²	67	132.7 Å²	132.7	55%	0.554	69%	0.693	S	S	*	*			trans	60.9	143.8	178.5	0	0	0	0	0	116.4	I142	I142-A1129 WeakPolarHBondContact CD1-O 3.5Å
1130	S	21.4	Very low	26.9	Very low	82 Å²	82	133.5 Å²	133.5	57%	0.573	71%	0.707	S	S	*	*			cis	72.5	105.4	1.9	98	0	0	0	0	119.1
1131	K	23	Very low	26.6	Very low	191 Å²	191	137.1 Å²	137.1	83%	0.83	71%	0.713	S	S	*	*			trans	71.3	126.3	155.6	-78.5	-166.5	172.7	-168	0	120.1
1132	C	22.4	Very low	26.4	Very low	96 Å²	96	136.3 Å²	136.3	65%	0.649	71%	0.712	S	S	*	*			trans	69.2	140.4	139.3	-55.7	0	0	0	0	116.3
1133	N	28.8	Very low	26.2	Very low	140 Å²	140	133.9 Å²	133.9	75%	0.749	71%	0.705	S	S	*	*			cis	-108.7	136.8	23.3	-71.4	-35	0	0	0	112.2
1134	N	28	Very low	26.2	Very low	104 Å²	104	136.9 Å²	136.9	56%	0.556	71%	0.713	S	S	*	*				75.9	150.1	84.1	-50.1	-16.2	0	0	0	112.8
1135	Y	28.5	Very low	26.2	Very low	197 Å²	197	133.2 Å²	133.2	77%	0.773	71%	0.712	S	S	*	*			cis	-152.7	147.1	9	-130.6	-53.3	0	0	0	110.5
1136	T	24.6	Very low	26.3	Very low	115 Å²	115	129.4 Å²	129.4	71%	0.706	70%	0.696	S	S	*	*			trans	67.2	133.3	161.3	14.5	0	0	0	0	116.4
1137	I	22.5	Very low	26.4	Very low	156 Å²	156	126.2 Å²	126.2	80%	0.8	68%	0.683	S	S	*	*			cis	66.5	131.8	31.2	-62.6	179.3	0	0	0	112.6
1138	P	28.5	Very low	26.8	Very low	102 Å²	102	123.4 Å²	123.4	66%	0.662	69%	0.687	S	S	*	*			trans	-122.2	-158.9	-137.8	43	-30	0	0	0	114.3
1139	T	25.6	Very low	27.1	Very low	129 Å²	129	123.4 Å²	123.4	79%	0.791	69%	0.687	S	S	*	*			trans	64.7	84.7	159.4	48.6	0	0	0	0	117.1
1140	S	21.8	Very low	26.9	Very low	119 Å²	119	129.6 Å²	129.6	83%	0.832	70%	0.698	S	S	*	*			trans	-73.9	158.2	141.2	51.6	0	0	0	0	111.1
1141	Y	24.1	Very low	27.3	Very low	216 Å²	216	132.5 Å²	132.5	85%	0.847	71%	0.706	S	S	*	*			trans	-64.8	148.2	-177	-91.7	-134.4	0	0	0	115.6
1142	V	27	Very low	27.7	Very low	116 Å²	116	130.6 Å²	130.6	70%	0.703	71%	0.705	S	S	*	*			trans	63	101.4	132	-179.9	0	0	0	0	120.3
1143	T	28.2	Very low	28.4	Very low	115 Å²	115	135.3 Å²	135.3	71%	0.706	72%	0.717	S	S	*	*				11.5	153.6	124.3	53.1	0	0	0	0	121.2
1144	T	30.9	Very low	28.8	Very low	114 Å²	114	136.1 Å²	136.1	70%	0.699	72%	0.721	S	S	*	*			cis	-160.9	159.8	22.9	-13.9	0	0	0	0	114
1145	V	25.5	Very low	28.8	Very low	116 Å²	116	137.2 Å²	137.2	70%	0.703	73%	0.727	S	S	*	*			trans	-154.3	176.6	168.7	81.7	0	0	0	0	113.1	F1171	V1145-F1171 VanDerWaalsContact O-CD1 3.31Å; V1145-F1171 WeakPolarHBondContact O-CD1 3.42Å; V1145-F1171 WeakPolarHBondContact O-CE1 3.43Å
1146	N	29.1	Very low	28.8	Very low	71 Å²	71	134.2 Å²	134.2	38%	0.38	72%	0.72	S	S	.	*			trans	-122.3	-165.5	-149.6	-62	6.5	0	0	0	113.3	I1172 N1173	N1146-I1172 WeakPolarHBondContact CA-O 3.45Å; N1146-I1172 WeakPolarHBondContact CB-O 3.16Å; N1146-I1172 PolarHBondContact ND2-O 2.98Å; N1146-I1172 PolarHBondContact OD1-O 3.25Å; N1146-N1173 HydrophobicContact CB-CB 4.3Å; N1146-N1173 PolarHBondContact ND2-OD1 2.71Å
1147	V	26.4	Very low	29.1	Very low	71 Å²	71	134.8 Å²	134.8	43%	0.43	72%	0.718	S	S	.	*			cis	-149.8	-58.9	20.6	-56.6	0	0	0	0	120.2	N1173	V1147-N1173 HydrophobicContact CB-CB 4.27Å; V1147-N1173 HydrophobicContact CG1-CB 4.48Å; V1147-N1173 HydrophobicContact CG2-CB 3.69Å
1148	P	40.3	Very low	29.3	Very low	115 Å²	115	135.6 Å²	135.6	75%	0.747	72%	0.719	S	S	*	*				-110.5	176.9	-128.9	39.1	-35.3	0	0	0	121.3
1149	Q	30.6	Very low	29.2	Very low	160 Å²	160	138.4 Å²	138.4	75%	0.748	72%	0.723	S	S	*	*			trans	-131.6	169.3	178.6	-74.2	177.1	-29.1	0	0	110.3
1150	Y	28	Very low	29.2	Very low	197 Å²	197	138.8 Å²	138.8	77%	0.773	72%	0.72	S	S	*	*			cis	-157.7	-178.4	8.9	-124.9	-49.2	0	0	0	111.2
1151	L	29.5	Very low	29.4	Very low	143 Å²	143	139.6 Å²	139.6	75%	0.749	71%	0.713	S	S	*	*			trans	93.6	113	163.1	-78.3	160.2	0	0	0	122.2
1152	N	30.9	Very low	29.6	Very low	151 Å²	151	136.4 Å²	136.4	81%	0.807	71%	0.71	S	S	*	*			trans	40.5	149.6	142.8	-61.3	9.7	0	0	0	124.1
1153	H	37.8	Very low	29.4	Very low	194 Å²	194	136.2 Å²	136.2	90%	0.898	71%	0.705	S	S	*	*			trans	-121.2	155.4	178.9	-106.3	-78.3	0	0	0	112.5
1154	L	36	Very low	29.5	Very low	158 Å²	158	138.2 Å²	138.2	83%	0.827	71%	0.71	S	S	*	*			trans	-136.3	165.2	167.4	-102.8	167.9	0	0	0	109.6
1155	N	29.8	Very low	29.4	Very low	127 Å²	127	140.4 Å²	140.4	68%	0.679	72%	0.718	S	S	*	*			trans	-61.9	137.6	176.7	-71	14.1	0	0	0	110.7
1156	E	28.3	Very low	29.7	Very low	134 Å²	134	137.9 Å²	137.9	63%	0.626	72%	0.716	S	S	*	*				77.3	151.2	95.6	-134.9	151.1	-114	0	0	108.3
1157	D	30.5	Very low	29.6	Very low	127 Å²	127	139.7 Å²	139.7	68%	0.679	73%	0.729	S	S	*	*				178.1	165.1	70.6	-89.8	-61	0	0	0	107.8
1158	E	26.8	Very low	29.6	Very low	172 Å²	172	145 Å²	145	80%	0.804	75%	0.747	S	S	*	*	S	Bend	cis	-116.7	154.6	4.3	-68.5	177.7	147.6	0	0	111.3
1159	E	25.8	Very low	28.8	Very low	162 Å²	162	143.9 Å²	143.9	76%	0.757	74%	0.741	S	S	*	*			trans	44.8	121.4	145.7	-70.7	-150.5	135.4	0	0	120.7
1160	L	26.8	Very low	28.4	Very low	137 Å²	137	141 Å²	141	72%	0.717	74%	0.739	S	S	*	*			cis	-151.5	174.8	-6	-39.8	85.2	0	0	0	107.7
1161	I	24.4	Very low	28.1	Very low	135 Å²	135	138.2 Å²	138.2	69%	0.692	73%	0.731	S	S	*	*			cis	-154.6	166.6	1.4	-148.6	174.8	0	0	0	109.3
1162	L	28.6	Very low	27.8	Very low	150 Å²	150	137.2 Å²	137.2	79%	0.785	73%	0.725	S	S	*	*			trans	47.6	71.1	164.4	-65.7	177.2	0	0	0	117.2
1163	N	24	Very low	27.5	Very low	112 Å²	112	134.1 Å²	134.1	60%	0.599	71%	0.709	S	S	*	*				25.9	136.2	99.8	-99.9	-39.2	0	0	0	117.9
1164	L	28.5	Very low	26.9	Very low	156 Å²	156	132.5 Å²	132.5	82%	0.817	70%	0.701	S	S	*	*			cis	-138.8	158.9	19.3	-91.7	155.7	0	0	0	112.7
1165	N	30.4	Very low	26.3	Very low	160 Å²	160	131.6 Å²	131.6	86%	0.856	70%	0.697	S	S	*	*			trans	-139.7	154.2	179.3	-106.3	-59.5	0	0	0	112.5
1166	G	31.4	Very low	26.1	Very low	64 Å²	64	135.1 Å²	135.1	66%	0.66	71%	0.706	S	S	*	*			trans	158.2	104.9	170	0	0	0	0	0	112.3
1167	T	27.3	Very low	25.9	Very low	108 Å²	108	137 Å²	137	66%	0.663	72%	0.715	S	S	*	*			cis	74.5	140.2	33.3	91.9	0	0	0	0	114.1
1168	K	25.3	Very low	25.9	Very low	183 Å²	183	135.5 Å²	135.5	80%	0.796	71%	0.712	S	S	*	*			cis	-162.5	150.3	8.2	-129.1	159	-166.3	168.2	0	113.6
1169	S	24.1	Very low	25.8	Very low	91 Å²	91	134.3 Å²	134.3	64%	0.636	71%	0.71	S	S	*	*			trans	0.4	149.8	149.5	62.6	0	0	0	0	125
1170	S	22.6	Very low	25.8	Very low	100 Å²	100	131.5 Å²	131.5	70%	0.699	70%	0.704	S	S	*	*			trans	72.5	163.3	140	78.9	0	0	0	0	118.4
1171	F	21.4	Very low	25.7	Very low	139 Å²	139	133 Å²	133	61%	0.61	71%	0.709	S	S	*	*			cis	-146.7	161.4	-16.1	-135.9	-141.4	0	0	0	108.2	V1145	V1145-F1171 VanDerWaalsContact O-CD1 3.31Å; V1145-F1171 WeakPolarHBondContact O-CD1 3.42Å; V1145-F1171 WeakPolarHBondContact O-CE1 3.43Å
1172	I	22.7	Very low	25.6	Very low	122 Å²	122	132.7 Å²	132.7	63%	0.626	70%	0.704	S	S	*	*			trans	-76.1	149.4	-166.8	-169.5	167.1	0	0	0	114.8	N1146	N1146-I1172 WeakPolarHBondContact CA-O 3.45Å; N1146-I1172 WeakPolarHBondContact CB-O 3.16Å; N1146-I1172 PolarHBondContact ND2-O 2.98Å; N1146-I1172 PolarHBondContact OD1-O 3.25Å
1173	N	23.9	Very low	25.5	Very low	86 Å²	86	131.9 Å²	131.9	46%	0.46	70%	0.701	S	S	.	*			trans	-156.2	-178.7	164	-163.9	57.9	0	0	0	112.2	N1146 V1147	N1146-N1173 HydrophobicContact CB-CB 4.3Å; N1146-N1173 PolarHBondContact ND2-OD1 2.71Å; V1147-N1173 HydrophobicContact CB-CB 4.27Å; V1147-N1173 HydrophobicContact CG1-CB 4.48Å; V1147-N1173 HydrophobicContact CG2-CB 3.69Å
1174	Q	27.2	Very low	25.5	Very low	159 Å²	159	133.5 Å²	133.5	74%	0.743	71%	0.707	S	S	*	*			trans	-156.9	166.7	-175.1	-142.7	178.2	27.6	0	0	114.4
1175	L	22.8	Very low	25.3	Very low	140 Å²	140	133.7 Å²	133.7	73%	0.733	71%	0.707	S	S	*	*			trans	82.2	97.9	156.9	-63.3	167.4	0	0	0	122.1
1176	K	25.2	Very low	25.1	Very low	200 Å²	200	131.5 Å²	131.5	87%	0.87	70%	0.699	S	S	*	*				-177	110.5	123.6	-96.7	170.9	-179	-177.6	0	107
1177	Q	23.4	Very low	24.8	Very low	173 Å²	173	135 Å²	135	81%	0.808	71%	0.708	S	S	*	*				67.7	147.8	73.7	-77.2	-158.3	36.4	0	0	114.8
1178	P	31.5	Very low	24.9	Very low	96 Å²	96	134.8 Å²	134.8	62%	0.623	71%	0.711	S	S	*	*			cis	-130.4	-167.8	-2.9	40.8	-23.7	0	0	0	113.9
1179	I	24.3	Very low	25.1	Very low	148 Å²	148	133 Å²	133	76%	0.759	71%	0.71	S	S	*	*			trans	70.2	135.6	163	-68.5	169.8	0	0	0	114.8
1180	T	25.6	Very low	25.7	Very low	103 Å²	103	133.9 Å²	133.9	63%	0.632	72%	0.716	S	S	*	*			cis	-158.9	164.8	-18.1	26.8	0	0	0	0	106.6
1181	M	24.3	Very low	25.7	Very low	169 Å²	169	138.7 Å²	138.7	83%	0.833	73%	0.725	S	S	*	*			cis	-106.4	173.6	-0.9	-58	-168.7	-59.4	0	0	109.1
1182	H	24.1	Very low	25.9	Very low	127 Å²	127	137.9 Å²	137.9	59%	0.588	73%	0.727	S	S	*	*			cis	78.4	105.4	22.6	-59	78.3	0	0	0	114.4
1183	D	26.4	Very low	25.8	Very low	134 Å²	134	135.1 Å²	135.1	72%	0.717	71%	0.711	S	S	*	*			cis	-128.6	140.3	-0.7	-63.8	-49.8	0	0	0	109.7
1184	M	22.6	Very low	25.8	Very low	145 Å²	145	137.9 Å²	137.9	71%	0.714	73%	0.725	S	S	*	*			cis	84.5	98.6	29.3	-165.2	-173.6	70.2	0	0	115.6
1185	I	25.3	Very low	25.5	Very low	160 Å²	160	135.2 Å²	135.2	82%	0.821	72%	0.719	S	S	*	*			trans	-160.4	125.6	145.3	-111.7	158.2	0	0	0	113.5
1186	V	25.4	Very low	25.5	Very low	114 Å²	114	135.9 Å²	135.9	69%	0.691	72%	0.723	S	S	*	*			trans	74.6	99.5	148.6	177.6	0	0	0	0	122.4
1187	T	25	Very low	25.6	Very low	137 Å²	137	131.1 Å²	131.1	84%	0.84	72%	0.715	S	S	*	*			trans	73.2	156.3	143.6	59.9	0	0	0	0	121.9
1188	S	29	Very low	26.3	Very low	104 Å²	104	128.4 Å²	128.4	73%	0.727	71%	0.712	S	S	*	*			trans	-151.9	149.9	-160.3	61.8	0	0	0	0	116.9
1189	N	29.5	Very low	25.9	Very low	145 Å²	145	129.4 Å²	129.4	78%	0.775	72%	0.721	S	S	*	*			trans	74.2	103	144.2	-67.9	-2.4	0	0	0	123.3
1190	S	37.3	Very low	26.1	Very low	111 Å²	111	129.5 Å²	129.5	78%	0.776	72%	0.721	S	S	*	*				86.8	141.6	123	81	0	0	0	0	120.7
1191	K	23.6	Very low	26	Very low	200 Å²	200	132.2 Å²	132.2	87%	0.87	73%	0.732	S	S	*	*			trans	61.8	154.4	-172	-73.7	-176.4	177.7	176.5	0	114.8
1192	N	24.4	Very low	25.9	Very low	122 Å²	122	132.1 Å²	132.1	65%	0.652	73%	0.727	S	S	*	*			trans	63.9	131.8	-165.7	-65.5	-14.1	0	0	0	112.6
1193	Q	22.1	Very low	26.2	Very low	64 Å²	64	132.9 Å²	132.9	30%	0.299	74%	0.741	S	S	.	*				65.3	124.7	71.5	-130.9	-167.1	1.3	0	0	111.2	H163 H164	H163-Q1193 WeakPolarHBondContact CD2-CG 3.35Å; H163-Q1193 PolarHBondContact CD2-NE2 2.77Å; H163-Q1193 WeakPolarHBondContact NE2-CG 3.5Å; H164-Q1193 PolarHBondContact O-NE2 2.9Å
1194	I	22	Very low	26	Very low	145 Å²	145	133.4 Å²	133.4	74%	0.744	74%	0.739	S	S	*	*			trans	85.3	131.9	166.5	-55.1	166.1	0	0	0	115
1195	T	21.5	Very low	26.2	Very low	102 Å²	102	132.5 Å²	132.5	63%	0.626	74%	0.738	S	S	*	*			cis	177.7	137	-25.8	-100.8	0	0	0	0	106.6
1196	L	23.2	Very low	26.3	Very low	155 Å²	155	131.3 Å²	131.3	81%	0.812	73%	0.733	S	S	*	*			trans	60.7	131.2	163.9	-69.5	164.6	0	0	0	120.6
1197	S	26.2	Very low	26.4	Very low	100 Å²	100	133.4 Å²	133.4	70%	0.699	74%	0.735	S	S	*	*			trans	-39.5	-178.9	138.4	29.6	0	0	0	0	116.2
1198	P	40	Very low	26.6	Very low	116 Å²	116	133 Å²	133	75%	0.753	73%	0.727	S	S	*	*			cis	-130.3	-175	-8	36.3	-18.8	0	0	0	113.7
1199	S	22.5	Very low	26.4	Very low	117 Å²	117	134.8 Å²	134.8	82%	0.818	73%	0.728	S	S	*	*				170.5	164.2	118	-73.4	0	0	0	0	113.3
1200	I	27.9	Very low	26.3	Very low	149 Å²	149	134.4 Å²	134.4	76%	0.764	73%	0.726	S	S	*	*			trans	-114.2	154.9	-174.7	-62.7	161	0	0	0	109.8
1201	N	22.9	Very low	25.9	Very low	161 Å²	161	138.6 Å²	138.6	86%	0.861	73%	0.73	S	S	*	*			trans	-159.2	166.3	146.3	-110.5	-22.4	0	0	0	114.4
1202	F	24	Very low	26	Very low	166 Å²	166	133.9 Å²	133.9	73%	0.728	72%	0.718	S	S	*	*			trans	-92.9	153.7	-166.7	-78.6	-113.3	0	0	0	115.4
1203	T	28.5	Very low	26.1	Very low	144 Å²	144	135.6 Å²	135.6	88%	0.883	73%	0.726	S	S	*	*				175.7	168.8	127.1	24.4	0	0	0	0	111.4
1204	E	23.7	Very low	26.2	Very low	144 Å²	144	136.3 Å²	136.3	67%	0.673	74%	0.738	S	S	*	*				-150.7	157.9	-90.3	-145	178.5	-119	0	0	112.8
1205	N	25.1	Very low	26.4	Very low	127 Å²	127	138.1 Å²	138.1	68%	0.679	74%	0.743	S	S	*	*			trans	80.5	151.2	158.2	-59.1	-45.9	0	0	0	123.2
1206	N	29.2	Very low	26.6	Very low	134 Å²	134	137.8 Å²	137.8	72%	0.717	75%	0.745	S	S	*	*			trans	71.2	102.6	172.4	-65.2	21.4	0	0	0	118.2
1207	E	26.4	Very low	27.3	Very low	159 Å²	159	135.9 Å²	135.9	74%	0.743	74%	0.742	S	S	*	*				90.3	140.9	78.5	-81.3	-165.8	151.3	0	0	112
1208	I	28.9	Very low	27.3	Very low	129 Å²	129	139.2 Å²	139.2	66%	0.662	75%	0.75	S	S	*	*			cis	-150.4	143.1	-8.8	-98.8	155.1	0	0	0	107.7
1209	N	24.9	Very low	26.5	Very low	141 Å²	141	139.5 Å²	139.5	75%	0.754	75%	0.749	S	S	*	*			trans	36.5	136.1	164.1	-77.8	-22.5	0	0	0	122.8
1210	N	27.6	Very low	26.9	Very low	137 Å²	137	138.7 Å²	138.7	73%	0.733	74%	0.741	S	S	*	*			trans	74.6	143.9	166.9	-56	-41.9	0	0	0	115.7	T1212	N1210-T1212 HydrophobicContact CB-CG2 4.48Å
1211	K	28.2	Very low	26.7	Very low	199 Å²	199	140 Å²	140	87%	0.865	74%	0.742	S	S	*	*	S	Bend	cis	-99.8	110.6	15.3	-75.2	178.4	-179.8	178.7	0	112.6
1212	T	26.2	Very low	26.7	Very low	100 Å²	100	138.5 Å²	138.5	61%	0.613	73%	0.734	S	S	*	*				67.9	134.4	99	59.5	0	0	0	0	114.6	N1210	N1210-T1212 HydrophobicContact CB-CG2 4.48Å
1213	I	27.3	Very low	26.7	Very low	158 Å²	158	135.8 Å²	135.8	81%	0.81	73%	0.731	S	S	*	*			cis	-118.9	129.4	27.8	-70.5	172.9	0	0	0	113.7
1214	S	24.9	Very low	26.5	Very low	79 Å²	79	133.5 Å²	133.5	55%	0.552	72%	0.721	S	S	*	*			trans	31.3	120.2	159.3	69	0	0	0	0	122.5
1215	Q	25.1	Very low	26.5	Very low	184 Å²	184	133.8 Å²	133.8	86%	0.86	73%	0.725	S	S	*	*				64.3	147.3	120.6	-64.9	166.7	-6.9	0	0	119.8
1216	S	26.2	Very low	26.4	Very low	94 Å²	94	133.7 Å²	133.7	66%	0.657	73%	0.725	S	S	*	*			cis	-165.4	150.5	-12.6	43.3	0	0	0	0	109.6
1217	P	38.5	Very low	26.3	Very low	115 Å²	115	133.8 Å²	133.8	75%	0.747	73%	0.725	S	S	*	*			trans	-72.1	154.4	162.5	34	-34.7	0	0	0	110.1
1218	I	26	Very low	26.2	Very low	170 Å²	170	134.5 Å²	134.5	87%	0.872	73%	0.728	S	S	*	*			trans	-177.7	136.8	144.6	-99.1	154.6	0	0	0	111.8
1219	V	22.8	Very low	26	Very low	122 Å²	122	133.3 Å²	133.3	74%	0.739	73%	0.731	S	S	*	*			trans	-54.9	141.1	165.5	152.4	0	0	0	0	110.4
1220	P	31.2	Very low	26.1	Very low	100 Å²	100	134.1 Å²	134.1	65%	0.649	73%	0.73	S	S	*	*				-153.6	172.4	60.2	31.9	-7	0	0	0	120.3
1221	F	23.8	Very low	26	Very low	178 Å²	178	134.7 Å²	134.7	78%	0.781	73%	0.728	S	S	*	*			trans	50.9	114.4	140.5	-69.4	-45.2	0	0	0	121
1222	N	22.9	Very low	25.9	Very low	129 Å²	129	132.8 Å²	132.8	69%	0.69	72%	0.722	S	S	*	*				88.4	108.1	86.9	-95.1	19.2	0	0	0	113.1
1223	T	24	Very low	25.9	Very low	108 Å²	108	132.5 Å²	132.5	66%	0.663	73%	0.725	S	S	*	*				71.6	118.5	91	64.2	0	0	0	0	116.6
1224	S	23.6	Very low	25.8	Very low	97 Å²	97	131.3 Å²	131.3	68%	0.678	72%	0.72	S	S	*	*			trans	75.7	139.8	136.2	75.5	0	0	0	0	121.6
1225	I	24	Very low	25.8	Very low	149 Å²	149	134 Å²	134	76%	0.764	72%	0.724	S	S	*	*			trans	79.6	126.8	143.8	-70.8	159.3	0	0	0	118.2
1226	N	23.4	Very low	25.8	Very low	125 Å²	125	132.9 Å²	132.9	67%	0.668	72%	0.718	S	S	*	*			trans	37.1	132.3	151.1	-70.8	50.4	0	0	0	123.6
1227	D	25.5	Very low	25.8	Very low	136 Å²	136	135.4 Å²	135.4	73%	0.727	73%	0.725	S	S	*	*				69.2	138	130	-63.2	-39.6	0	0	0	122.9
1228	Q	25.7	Very low	25.3	Very low	174 Å²	174	138.8 Å²	138.8	81%	0.813	72%	0.724	S	S	*	*			trans	74.5	108.2	153.7	-72	-173.4	13.4	0	0	122
1229	C	23.3	Very low	25.4	Very low	105 Å²	105	139.8 Å²	139.8	71%	0.709	72%	0.718	S	S	*	*				90.2	142	117.7	-71.8	0	0	0	0	122.5
1230	Q	27	Very low	25.5	Very low	158 Å²	158	140 Å²	140	74%	0.738	72%	0.715	S	S	*	*			trans	73.8	117.4	153.1	-76.7	178	4.7	0	0	116.6
1231	Q	27.3	Very low	25.4	Very low	149 Å²	149	142.4 Å²	142.4	70%	0.696	72%	0.717	S	S	*	*				77.2	144.1	85.6	-80.6	179.5	-2	0	0	112.9
1232	Q	25.3	Very low	25.5	Very low	159 Å²	159	139.4 Å²	139.4	74%	0.743	71%	0.709	S	S	*	*			cis	-169.2	167.3	-18.8	-139	176.1	1	0	0	108
1233	S	26.1	Very low	25.8	Very low	94 Å²	94	141.1 Å²	141.1	66%	0.657	71%	0.713	S	S	*	*			trans	70.6	128.8	157.2	86.1	0	0	0	0	116.2
1234	N	25.5	Very low	26	Very low	133 Å²	133	143 Å²	143	71%	0.711	72%	0.716	S	S	*	*				86.1	144.4	77.6	-68.6	3.7	0	0	0	112.9
1235	Q	25.7	Very low	26	Very low	136 Å²	136	147.2 Å²	147.2	64%	0.636	72%	0.722	S	S	*	*			cis	-158.8	162.8	-4.2	-122.1	164.7	-35.8	0	0	111.4
1236	Q	23.9	Very low	26.3	Very low	160 Å²	160	148.6 Å²	148.6	75%	0.748	73%	0.731	S	S	*	*			trans	51.5	130	147	-73.3	157.7	-33.9	0	0	120.9
1237	D	27.2	Very low	26.5	Very low	147 Å²	147	149.9 Å²	149.9	79%	0.786	73%	0.733	S	S	*	*				-153	146.5	127.6	-118	-18.7	0	0	0	113.6
1238	Y	27.8	Very low	26.7	Very low	186 Å²	186	153.2 Å²	153.2	73%	0.729	74%	0.737	S	S	*	*			trans	49.4	108.1	164.2	-75	-93.9	0	0	0	125.2
1239	Y	27.9	Very low	26.8	Very low	191 Å²	191	149.8 Å²	149.8	75%	0.749	73%	0.732	S	S	*	*				69.9	114.9	122.4	-89.1	-110.4	0	0	0	124.7
1240	N	25.5	Very low	27	Very low	126 Å²	126	152 Å²	152	67%	0.674	74%	0.735	S	S	*	*				61.3	131.3	127.3	-84.6	2.5	0	0	0	125.4
1241	H	27.6	Very low	27	Very low	151 Å²	151	155.4 Å²	155.4	70%	0.699	74%	0.741	S	S	*	*			trans	73.6	125	141.4	-89.5	-54.1	0	0	0	122.7
1242	N	27.1	Very low	27	Very low	114 Å²	114	152.6 Å²	152.6	61%	0.61	74%	0.738	S	S	*	*			trans	82.6	112.9	130.7	-71.8	-4.8	0	0	0	122.2
1243	Q	29.2	Very low	27	Very low	165 Å²	165	154.3 Å²	154.3	77%	0.771	74%	0.743	S	S	*	*				102.3	129.7	122.2	-77.5	-179.8	23.5	0	0	121.1
1244	M	26.8	Very low	27.1	Very low	147 Å²	147	157.5 Å²	157.5	72%	0.724	75%	0.752	S	S	*	*			trans	68.9	99	150.7	-67.5	-63.3	-174.4	0	0	120.3
1245	K	24.8	Very low	27.1	Very low	187 Å²	187	158.1 Å²	158.1	81%	0.813	76%	0.755	S	S	*	*			trans	54.4	98.1	135	-63.4	-179.1	179.1	-179.3	0	117.8
1246	D	29.9	Very low	27.3	Very low	177 Å²	177	157.6 Å²	157.6	95%	0.947	76%	0.762	S	S	*	*			trans	-127.5	156.2	138	-111	-41.9	0	0	0	109.7
1247	Q	27	Very low	27.7	Very low	153 Å²	153	156.1 Å²	156.1	72%	0.715	77%	0.766	S	S	*	*			trans	-134.3	129.5	-160.1	-138.4	-176.7	7.2	0	0	113
1248	Y	29.3	Very low	27.6	Very low	205 Å²	205	156.5 Å²	156.5	80%	0.804	77%	0.766	S	S	*	*			trans	62.6	138.3	172.1	-57.4	-74.5	0	0	0	118
1249	S	28.9	Very low	27.6	Very low	102 Å²	102	154.1 Å²	154.1	71%	0.713	77%	0.771	S	S	*	*			cis	-153.3	137.5	-25.6	-145.3	0	0	0	0	112
1250	I	28.5	Very low	27.4	Very low	151 Å²	151	150.1 Å²	150.1	77%	0.774	76%	0.762	S	S	*	*			trans	-22.3	117.7	168.6	-59.3	172.3	0	0	0	113.5
1251	R	26.8	Very low	27.6	Very low	231 Å²	231	152 Å²	152	87%	0.872	76%	0.764	S	S	*	*				55.4	152.3	88.5	-90.6	-171.4	174.7	173	-2.3	115.7
1252	S	26.6	Very low	27.6	Very low	89 Å²	89	153 Å²	153	62%	0.622	77%	0.767	S	S	*	*			cis	-177.6	127	-35.3	49.3	0	0	0	0	110.8
1253	K	26.2	Very low	27.7	Very low	196 Å²	196	154.5 Å²	154.5	85%	0.852	77%	0.774	S	S	*	*			trans	52.1	141.6	147	-74	-173.1	176.2	-178.6	0	122.7
1254	L	26.2	Very low	27.7	Very low	160 Å²	160	152 Å²	152	84%	0.838	77%	0.77	S	S	*	*			trans	88.4	159.3	146.5	-75.3	161.2	0	0	0	120
1255	N	25.8	Very low	27.9	Very low	147 Å²	147	151.5 Å²	151.5	79%	0.786	77%	0.771	S	S	*	*			trans	-94.5	157.5	-154.7	-74.2	-12.8	0	0	0	115.4
1256	T	30.1	Very low	28	Very low	125 Å²	125	150.7 Å²	150.7	77%	0.767	78%	0.775	S	S	*	*			trans	-13.4	152.3	158	62.1	0	0	0	0	119
1257	P	32.8	Very low	27.8	Very low	128 Å²	128	147.9 Å²	147.9	83%	0.831	77%	0.769	S	S	*	*				-131.5	164.6	93	39	-31.9	0	0	0	116.2
1258	I	24.3	Very low	27.9	Very low	155 Å²	155	147.5 Å²	147.5	80%	0.795	77%	0.771	S	S	*	*			trans	-68.1	138.3	177.4	-61.9	147.1	0	0	0	112.4
1259	V	27.9	Very low	28	Very low	137 Å²	137	144.6 Å²	144.6	83%	0.83	77%	0.765	S	S	*	*			trans	-148.9	104.7	138.1	177.1	0	0	0	0	110.4
1260	D	25.1	Very low	28	Very low	107 Å²	107	145.6 Å²	145.6	57%	0.572	76%	0.762	S	S	*	*			trans	46.6	139.8	130	-126.4	-9.2	0	0	0	124.2
1261	K	29.9	Very low	27.9	Very low	165 Å²	165	142.6 Å²	142.6	72%	0.717	76%	0.755	S	S	*	*			trans	68.4	145.2	149.7	-73.7	149.3	-172.6	153.2	0	120.6
1262	K	27.1	Very low	27.9	Very low	172 Å²	172	138.2 Å²	138.2	75%	0.748	75%	0.748	S	S	*	*			cis	-172.7	156.9	-23.2	-135.6	-174.7	-174.5	-178.1	0	109.6
1263	L	29.2	Very low	27.9	Very low	146 Å²	146	140.1 Å²	140.1	76%	0.764	75%	0.752	S	S	*	*			trans	68.8	154.4	163.6	-56.2	157.4	0	0	0	114.3
1264	T	29	Very low	27.9	Very low	112 Å²	112	137.3 Å²	137.3	69%	0.687	75%	0.746	S	S	*	*			cis	-145.3	174.5	8.6	-23.8	0	0	0	0	111.3
1265	N	30.1	Very low	27.8	Very low	137 Å²	137	135 Å²	135	73%	0.733	74%	0.739	S	S	*	*			trans	71.1	83.5	163.8	-59.4	-5.2	0	0	0	118.4
1266	N	28.5	Very low	27.7	Very low	170 Å²	170	133.8 Å²	133.8	91%	0.909	74%	0.737	S	S	*	*				-175.2	99.6	113.7	-92.6	-21.2	0	0	0	110.9
1267	S	24.5	Very low	27.5	Very low	117 Å²	117	133.9 Å²	133.9	82%	0.818	74%	0.737	S	S	*	*			trans	-165.4	126.7	169.9	-168.8	0	0	0	0	111.3
1268	L	29.3	Very low	27.2	Very low	145 Å²	145	133.4 Å²	133.4	76%	0.759	73%	0.732	S	S	*	*			trans	176.5	145.6	161.1	-116	61.5	0	0	0	105.3
1269	H	30.9	Very low	27.3	Very low	144 Å²	144	131.9 Å²	131.9	67%	0.667	73%	0.726	S	S	*	*			cis	-149.9	151.5	8.8	-126.1	-40	0	0	0	112
1270	N	29.3	Very low	27.4	Very low	124 Å²	124	132.2 Å²	132.2	66%	0.663	72%	0.723	S	S	*	*			trans	49.1	96.5	145.9	-65.7	7.8	0	0	0	123.2
1271	S	26.9	Very low	27.8	Very low	88 Å²	88	134.5 Å²	134.5	62%	0.615	73%	0.733	S	S	*	*				29.7	139.2	102.1	71.7	0	0	0	0	122.9
1272	N	26.5	Very low	27.6	Very low	139 Å²	139	130.8 Å²	130.8	74%	0.743	73%	0.728	S	S	*	*			trans	87	125.1	139	-66.6	-3.4	0	0	0	122.4
1273	N	26.7	Very low	27.6	Very low	129 Å²	129	128.9 Å²	128.9	69%	0.69	73%	0.726	S	S	*	*			trans	74.1	128.2	137.4	-62.5	-4.2	0	0	0	122.5
1274	N	25.5	Very low	27.5	Very low	136 Å²	136	129 Å²	129	73%	0.727	72%	0.722	S	S	*	*			trans	71.8	119.1	137.2	-64.1	-1.6	0	0	0	122.2
1275	T	24.9	Very low	27.3	Very low	112 Å²	112	130 Å²	130	69%	0.687	72%	0.723	S	S	*	*			trans	57.9	92.9	133.4	61.8	0	0	0	0	121
1276	T	23.5	Very low	27	Very low	122 Å²	122	128.8 Å²	128.8	75%	0.748	72%	0.721	S	S	*	*				61.3	156.7	120.6	56.2	0	0	0	0	122.6
1277	T	26.4	Very low	26.9	Very low	127 Å²	127	126.3 Å²	126.3	78%	0.779	71%	0.712	S	S	*	*			trans	81.2	138	165.2	69.8	0	0	0	0	117.7
1278	T	25.6	Very low	27.1	Very low	117 Å²	117	125.7 Å²	125.7	72%	0.718	70%	0.704	S	S	*	*			cis	-162.6	172.6	-38.7	0.9	0	0	0	0	110
1279	N	26.8	Very low	27.1	Very low	124 Å²	124	125.3 Å²	125.3	66%	0.663	70%	0.702	S	S	*	*			trans	77.3	143.8	173.2	-50	-28	0	0	0	113.6
1280	N	29.8	Very low	27.1	Very low	143 Å²	143	125.4 Å²	125.4	77%	0.765	71%	0.706	S	S	*	*			cis	-151	166.8	29.8	-143.4	-7.2	0	0	0	114.4
1281	I	32.8	Very low	27.1	Very low	156 Å²	156	124.6 Å²	124.6	80%	0.8	71%	0.706	S	S	*	*			trans	75.4	148	164.2	-61.8	166.7	0	0	0	117.2
1282	S	26.5	Very low	27.2	Very low	86 Å²	86	127 Å²	127	60%	0.601	71%	0.712	S	S	*	*			trans	-131.3	172.2	-165.2	60.8	0	0	0	0	112.6
1283	N	27.8	Very low	27.3	Very low	133 Å²	133	125.5 Å²	125.5	71%	0.711	71%	0.708	S	S	*	*			trans	68.9	130.2	147	-74.1	-7.7	0	0	0	121.2
1284	H	26.7	Very low	27.4	Very low	148 Å²	148	125 Å²	125	69%	0.685	71%	0.709	S	S	*	*			trans	61.9	112.4	135.2	-76.2	-58.5	0	0	0	121.4
1285	N	23.9	Very low	27.6	Very low	132 Å²	132	125 Å²	125	71%	0.706	71%	0.709	S	S	*	*				96.3	147.5	115	-75.3	-0.9	0	0	0	120.1
1286	V	25.7	Very low	27.8	Very low	113 Å²	113	124.9 Å²	124.9	69%	0.685	70%	0.704	S	S	*	*			trans	75.7	99.6	142.9	160.9	0	0	0	0	116.2
1287	T	25.4	Very low	28.1	Very low	117 Å²	117	125.1 Å²	125.1	72%	0.718	70%	0.701	S	S	*	*			trans	72.9	146.2	140.9	63	0	0	0	0	117.3
1288	T	29.4	Very low	28.2	Very low	105 Å²	105	123.8 Å²	123.8	64%	0.644	70%	0.696	S	S	*	*			cis	-155.5	168.8	-1.9	1.6	0	0	0	0	109.1
1289	N	28.3	Very low	28.2	Very low	137 Å²	137	124.7 Å²	124.7	73%	0.733	70%	0.696	S	S	*	*			trans	39.2	134.1	141.1	-54.9	-14.7	0	0	0	119
1290	I	31.9	Very low	28.2	Very low	146 Å²	146	124.8 Å²	124.8	75%	0.749	69%	0.691	S	S	*	*			cis	-161.3	168	40.9	-141.7	151.5	0	0	0	112.4
1291	T	28.8	Very low	27.9	Very low	106 Å²	106	124.3 Å²	124.3	65%	0.65	68%	0.678	S	S	*	*			trans	-29	157.7	166.3	57.7	0	0	0	0	117.5
1292	N	29.6	Very low	27.5	Very low	140 Å²	140	120.1 Å²	120.1	75%	0.749	66%	0.66	S	S	*	*			cis	-157.1	178.1	19.1	-135.2	-8.5	0	0	0	115.6
1293	T	26.5	Very low	27.3	Very low	106 Å²	106	119.8 Å²	119.8	65%	0.65	66%	0.663	S	S	*	*			trans	-66.5	-177	167.3	50.6	0	0	0	0	114.1
1294	T	29.3	Very low	27.1	Very low	119 Å²	119	119.8 Å²	119.8	73%	0.73	66%	0.658	S	S	*	*			trans	103.6	142.6	156.6	74.4	0	0	0	0	118.1
1295	L	30.7	Very low	27	Very low	137 Å²	137	122.4 Å²	122.4	72%	0.717	66%	0.662	S	S	*	*			cis	-164.2	160.9	-16	-107.9	172.1	0	0	0	111.7
1296	N	28.5	Very low	26.9	Very low	109 Å²	109	121.3 Å²	121.3	58%	0.583	66%	0.66	S	S	*	*			trans	62.3	126	139.4	-74.7	-15.6	0	0	0	125.1
1297	N	30.2	Very low	26.7	Very low	127 Å²	127	121 Å²	121	68%	0.679	66%	0.662	S	S	*	*				66.1	168	119.7	-49.2	-15.2	0	0	0	118.7
1298	S	27.2	Very low	26.7	Very low	98 Å²	98	120.2 Å²	120.2	69%	0.685	66%	0.662	S	S	*	*			cis	-151.5	140.7	16.7	-41.8	0	0	0	0	114.2
1299	L	26.3	Very low	26.4	Very low	136 Å²	136	122.7 Å²	122.7	71%	0.712	67%	0.67	S	S	*	*				44.6	166.9	119.8	-64.1	164.2	0	0	0	123.2
1300	F	26.2	Very low	26.2	Very low	126 Å²	126	121.3 Å²	121.3	55%	0.553	67%	0.671	S	S	*	*			trans	80.6	144.6	151	-73	-36.5	0	0	0	118.5	W880	W880-F1300 HydrophobicContact CD2-CD1 4.32Å; W880-F1300 AromaticContact CD2-CE1 3.92Å; W880-F1300 HydrophobicContact CD2-CE1 3.92Å; W880-F1300 AromaticContact CE2-CD1 3.98Å; W880-F1300 HydrophobicContact CE3-CD1 4.14Å; W880-F1300 AromaticContact CE3-CE1 3.69Å; W880-F1300 HydrophobicContact CE3-CE1 3.69Å; W880-F1300 AromaticContact CH2-CD1 3.49Å; W880-F1300 HydrophobicContact CH2-CD1 3.49Å; W880-F1300 VanDerWaalsContact CH2-CD1 3.49Å; W880-F1300 AromaticContact CH2-CE1 3.93Å; W880-F1300 HydrophobicContact CH2-CE1 3.93Å; W880-F1300 AromaticContact CZ2-CD1 3.57Å; W880-F1300 HydrophobicContact CZ2-CD1 3.57Å; W880-F1300 HydrophobicContact CZ2-CE1 4.03Å; W880-F1300 AromaticContact CZ3-CD1 3.76Å; W880-F1300 HydrophobicContact CZ3-CD1 3.76Å; W880-F1300 AromaticContact CZ3-CE1 3.72Å; W880-F1300 HydrophobicContact CZ3-CE1 3.72Å
1301	R	25	Very low	26	Very low	133 Å²	133	120.7 Å²	120.7	50%	0.502	67%	0.674	S	S	.	*			cis	-146.9	134.3	-4.2	-70.4	-140.4	146.1	179.2	-11.6	116.8	E878 W880	E878-R1301 VanDerWaalsContact OE1-CD 3.25Å; E878-R1301 WeakPolarHBondContact OE1-CD 3.23Å; E878-R1301 IonicContact OE1-CZ 3.53Å; E878-R1301 IonicContact OE1-NE 3.64Å; E878-R1301 IonicContact OE1-NH1 3.83Å; E878-R1301 PolarHBondContact OE1-NH1 2.97Å; E878-R1301 IonicContact OE2-CZ 2.69Å; E878-R1301 IonicContact OE2-NH1 3.66Å; E878-R1301 PolarHBondContact OE2-NH1 3.45Å; W880-R1301 HydrophobicContact CH2-CB 4.49Å; W880-R1301 HydrophobicContact CH2-CG 4.44Å; W880-R1301 HydrophobicContact CZ2-CB 3.64Å; W880-R1301 HydrophobicContact CZ2-CG 3.52Å; W880-R1301 VanDerWaalsContact NE1-CD 3.33Å; W880-R1301 VanDerWaalsContact NE1-NE 3.11Å
1302	V	23.5	Very low	26.2	Very low	68 Å²	68	121.4 Å²	121.4	41%	0.412	68%	0.681	S	S	.	*				48.5	159.4	128	134.3	0	0	0	0	127.7	T879 W880	T879-V1302 WeakPolarHBondContact O-CG2 3.43Å; T879-V1302 WeakPolarHBondContact OG1-CG1 3.29Å; T879-V1302 WeakPolarHBondContact OG1-CG2 3.47Å; W880-V1302 HydrophobicContact CD2-CG2 4.26Å; W880-V1302 HydrophobicContact CH2-CB 4.22Å; W880-V1302 HydrophobicContact CH2-CG2 3.74Å; W880-V1302 HydrophobicContact CZ2-CB 3.49Å; W880-V1302 VanDerWaalsContact CZ2-CB 3.49Å; W880-V1302 HydrophobicContact CZ2-CG2 3.3Å; W880-V1302 HydrophobicContact CZ3-CG2 4.43Å
1303	A	23.4	Very low	26	Very low	80 Å²	80	123.7 Å²	123.7	66%	0.661	68%	0.68	S	S	*	*			trans	78	147.5	161.9	0	0	0	0	0	120.1
1304	E	22.4	Very low	25.9	Very low	133 Å²	133	125.7 Å²	125.7	62%	0.621	69%	0.686	S	S	*	*			cis	-157.6	166	-17.1	-113.2	-151.9	144	0	0	114.1
1305	W	23.9	Very low	25.6	Very low	203 Å²	203	124.4 Å²	124.4	77%	0.769	68%	0.681	S	S	*	*			trans	67.5	114.3	152.3	-82.4	46.8	0	0	0	127.1
1306	V	22.2	Very low	25.2	Very low	109 Å²	109	126.5 Å²	126.5	66%	0.661	69%	0.687	S	S	*	*				60.7	103.9	121	-177.3	0	0	0	0	121.5
1307	S	22.9	Very low	25.1	Very low	105 Å²	105	126 Å²	126	73%	0.734	69%	0.692	S	S	*	*				179	147.5	114.1	-85.1	0	0	0	0	118.4
1308	S	23.8	Very low	24.8	Very low	101 Å²	101	128.8 Å²	128.8	71%	0.706	70%	0.703	S	S	*	*			trans	59.4	109.8	141.8	68	0	0	0	0	125.1
1309	I	23.6	Very low	24.8	Very low	157 Å²	157	130 Å²	130	81%	0.805	70%	0.702	S	S	*	*				70.8	135.3	111.7	-65.5	161.8	0	0	0	122.5
1310	S	24	Very low	25	Very low	109 Å²	109	131.4 Å²	131.4	76%	0.762	71%	0.71	S	S	*	*			trans	85.9	122.8	151.5	66.6	0	0	0	0	122.2
1311	T	27.4	Very low	25	Very low	132 Å²	132	130.7 Å²	130.7	81%	0.81	71%	0.711	S	S	*	*			trans	-79.6	161.5	148.1	54.7	0	0	0	0	109.5
1312	P	34.1	Very low	25.3	Very low	122 Å²	122	132.1 Å²	132.1	79%	0.792	73%	0.729	S	S	*	*				-151	-168	94	40.8	-22	0	0	0	116.1
1313	Y	25.6	Very low	25.5	Very low	188 Å²	188	134.6 Å²	134.6	74%	0.737	75%	0.745	S	S	*	*			trans	-68.6	174.9	-172.5	-89.8	-114.3	0	0	0	116.9
1314	L	23.9	Very low	25.8	Very low	147 Å²	147	138.9 Å²	138.9	77%	0.77	76%	0.755	S	S	*	*			trans	-10.4	148.2	147.9	-81.5	67	0	0	0	116.2
1315	C	22.3	Very low	26	Very low	93 Å²	93	139.9 Å²	139.9	63%	0.628	76%	0.764	S	S	*	*			cis	-161.9	168.1	37.4	-147.6	0	0	0	0	114.7
1316	Q	23.8	Very low	26.2	Very low	180 Å²	180	135.4 Å²	135.4	84%	0.841	76%	0.763	S	S	*	*			trans	60	125.8	150.4	-87.6	164.6	-35.3	0	0	121.3
1317	S	26.1	Very low	26.5	Very low	99 Å²	99	134.7 Å²	134.7	69%	0.692	76%	0.763	S	S	*	*			trans	-68.2	146.3	165	50.7	0	0	0	0	114.1
1318	M	24.6	Very low	26.8	Very low	185 Å²	185	137.6 Å²	137.6	91%	0.911	77%	0.769	S	S	*	*			trans	-127.7	117.6	137.9	-66.3	-172.5	-172.3	0	0	105.8
1319	N	26.6	Very low	26.9	Very low	124 Å²	124	137.5 Å²	137.5	66%	0.663	77%	0.767	S	S	*	*				72	104.9	72.8	-80.9	21.5	0	0	0	113.5
1320	L	29.4	Very low	27.2	Very low	166 Å²	166	137.9 Å²	137.9	87%	0.869	77%	0.771	S	S	*	*				-143.7	149.4	125.3	-82.2	111.8	0	0	0	107.5
1321	D	27.7	Very low	27.4	Very low	110 Å²	110	138 Å²	138	59%	0.588	77%	0.767	S	S	*	*			cis	-163.7	142	-37.2	-118.5	-26.3	0	0	0	108.3
1322	N	29.8	Very low	27.4	Very low	163 Å²	163	137 Å²	137	87%	0.872	76%	0.764	S	S	*	*			trans	170.8	153	136.3	-92.8	-48.7	0	0	0	111.5
1323	T	27.9	Very low	26.9	Very low	121 Å²	121	141.4 Å²	141.4	74%	0.742	77%	0.767	S	S	*	*			trans	-124.6	161.2	-171.3	52.9	0	0	0	0	111.6
1324	I	29.4	Very low	27.1	Very low	170 Å²	170	139.8 Å²	139.8	87%	0.872	77%	0.769	S	S	*	*				-177.2	157.4	126.7	-94.8	157	0	0	0	110
1325	N	27	Very low	27.3	Very low	153 Å²	153	137.8 Å²	137.8	82%	0.818	76%	0.759	S	S	*	*			trans	-113.7	138	-170.9	-106.7	-39.9	0	0	0	113.2
1326	C	28	Very low	27.5	Very low	110 Å²	110	136 Å²	136	74%	0.743	74%	0.744	S	S	*	*			trans	47	125.6	132	-146.2	0	0	0	0	121.2
1327	S	28	Very low	27.8	Very low	94 Å²	94	131.7 Å²	131.7	66%	0.657	73%	0.733	S	S	*	*				150.6	141.5	97.4	62.1	0	0	0	0	116.5
1328	L	30	Very low	27.9	Very low	165 Å²	165	131.5 Å²	131.5	86%	0.864	72%	0.724	S	S	*	*			trans	57.7	158.4	153.9	-84.9	82.4	0	0	0	120.1
1329	C	26.5	Very low	28.4	Very low	100 Å²	100	128.6 Å²	128.6	68%	0.676	72%	0.722	S	S	*	*			cis	-169.3	139.5	-32.4	-157.6	0	0	0	0	109.8
1330	N	30.4	Very low	28.7	Very low	164 Å²	164	126.6 Å²	126.6	88%	0.877	72%	0.723	S	S	*	*			trans	-165	167	141.5	-124.4	-26	0	0	0	112.6
1331	T	27	Very low	28.9	Very low	111 Å²	111	125.3 Å²	125.3	68%	0.681	72%	0.717	S	S	*	*			trans	-131.9	135.4	-160.6	-46.7	0	0	0	0	112.5
1332	C	27.5	Very low	29	Very low	111 Å²	111	125.5 Å²	125.5	75%	0.75	72%	0.718	S	S	*	*			trans	166.9	135.2	131.4	-93.3	0	0	0	0	114.2
1333	Y	24.5	Very low	29.2	Very low	216 Å²	216	123 Å²	123	85%	0.847	71%	0.709	S	S	*	*			trans	25.9	114	137.5	-80.7	-91.9	0	0	0	118.1
1334	I	28.1	Very low	29.5	Very low	153 Å²	153	122.6 Å²	122.6	79%	0.785	71%	0.706	S	S	*	*				-157.7	157.6	68.4	-101.3	164.5	0	0	0	112.6	N1336	I1334-N1336 PolarHBondContact O-N 3.45Å
1335	N	28	Very low	29.5	Very low	105 Å²	105	119.2 Å²	119.2	56%	0.561	69%	0.694	S	S	*	*			trans	-72.6	110	168.6	-84.2	-2.4	0	0	0	112.5
1336	N	27.2	Very low	29.9	Very low	57 Å²	57	117.9 Å²	117.9	31%	0.305	69%	0.691	S	S	.	*				82.6	150.9	109.3	-74.6	-32.1	0	0	0	123.5	I1334 Q1534 H1535	I1334-N1336 PolarHBondContact O-N 3.45Å; N1336-Q1534 CarbonylContact C-O 3.38Å; N1336-Q1534 WeakPolarHBondContact CA-O 3.39Å; N1336-Q1534 WeakPolarHBondContact CB-O 2.99Å; N1336-Q1534 VanDerWaalsContact CG-O 3.26Å; N1336-Q1534 PolarHBondContact ND2-OE1 2.92Å; N1336-Q1534 WeakPolarHBondContact OD1-CB 3.24Å; N1336-Q1534 PolarHBondContact OD1-O 2.95Å; N1336-H1535 CarbonylContact C-O 3.54Å; N1336-H1535 HydrophobicContact CB-CB 3.34Å; N1336-H1535 VanDerWaalsContact CB-O 3.29Å; N1336-H1535 WeakPolarHBondContact CB-O 3.36Å; N1336-H1535 WeakPolarHBondContact ND2-CB 3.41Å
1337	S	29.5	Very low	30.1	Very low	88 Å²	88	118.1 Å²	118.1	62%	0.615	69%	0.69	S	S	*	*			trans	-152	122.7	158.3	59.7	0	0	0	0	109.5	Q1534 H1535	S1337-Q1534 CarbonylContact C-O 3.53Å; S1337-Q1534 VanDerWaalsContact CA-O 3.29Å; S1337-Q1534 WeakPolarHBondContact CA-O 3.43Å; S1337-Q1534 PolarHBondContact N-O 3Å; S1337-Q1534 CarbonylContact O-C 3.47Å; S1337-Q1534 PolarHBondContact O-N 3.19Å; S1337-H1535 CarbonylContact C-O 3.4Å; S1337-H1535 WeakPolarHBondContact CA-O 3.25Å; S1337-H1535 PolarHBondContact N-O 3.07Å
1338	N	29.1	Very low	30.4	Very low	95 Å²	95	118.9 Å²	118.9	51%	0.508	69%	0.69	S	S	.	*				66.4	126	51.7	-109.9	31.8	0	0	0	115.9	Q1534 H1535 H1536	N1338-Q1534 PolarHBondContact N-O 3.07Å; N1338-H1535 WeakPolarHBondContact CB-O 3.08Å; N1338-H1536 PolarHBondContact ND2-N 3.36Å; N1338-H1536 PolarHBondContact ND2-O 3.28Å; N1338-H1536 PolarHBondContact OD1-N 3.43Å
1339	S	34.2	Very low	30.3	Very low	125 Å²	125	116.8 Å²	116.8	87%	0.874	68%	0.684	S	S	*	*			trans	168.5	161.1	150.6	50.5	0	0	0	0	110.4
1340	A	34.4	Very low	30.5	Very low	82 Å²	82	117.5 Å²	117.5	68%	0.678	69%	0.686	S	S	*	*			cis	-132.6	-175.4	2.2	0	0	0	0	0	111.9
1341	N	32.4	Very low	30.5	Very low	138 Å²	138	115 Å²	115	74%	0.738	68%	0.677	S	S	*	*	S	Bend	trans	69.6	107.3	-177.4	-62.9	81.8	0	0	0	115.4
1342	D	30.1	Very low	30.5	Very low	114 Å²	114	115.3 Å²	115.3	61%	0.61	68%	0.679	S	S	*	*			cis	-145	149.2	-4.2	-94.9	-52.4	0	0	0	114.1
1343	T	34.1	Very low	30.4	Very low	111 Å²	111	115.6 Å²	115.6	68%	0.681	68%	0.677	S	S	*	*			trans	16.2	119.8	160.3	53.6	0	0	0	0	120
1344	T	34	Very low	30.5	Very low	112 Å²	112	111 Å²	111	69%	0.687	67%	0.671	S	S	*	*				59.7	110.4	65.4	70	0	0	0	0	113.6
1345	T	29.2	Very low	30.4	Very low	100 Å²	100	109.6 Å²	109.6	61%	0.613	67%	0.67	S	S	*	*				58.4	124	64.8	71.5	0	0	0	0	115.5
1346	T	35.4	Very low	30.3	Very low	125 Å²	125	109.7 Å²	109.7	77%	0.767	68%	0.675	S	S	*	*			trans	171.2	109.2	135	29.9	0	0	0	0	107.1
1347	T	32.2	Very low	30.4	Very low	115 Å²	115	112.8 Å²	112.8	71%	0.706	70%	0.696	S	S	*	*				62.4	138.3	82.3	64.4	0	0	0	0	113.3
1348	T	34.5	Very low	30.7	Very low	110 Å²	110	114.1 Å²	114.1	68%	0.675	70%	0.701	S	S	*	*				-169	145.9	74.9	34.4	0	0	0	0	113.9
1349	T	28.5	Very low	30.8	Very low	120 Å²	120	115 Å²	115	74%	0.736	71%	0.71	S	S	*	*			trans	62.8	148.4	140	59.2	0	0	0	0	120.2
1350	T	30.2	Very low	30.6	Very low	115 Å²	115	114.6 Å²	114.6	71%	0.706	70%	0.702	S	S	*	*			cis	-159	175	8	-2.7	0	0	0	0	112.2
1351	T	30.5	Very low	30.5	Very low	112 Å²	112	118 Å²	118	69%	0.687	70%	0.704	S	S	*	*			trans	57.9	99.4	147.1	50.5	0	0	0	0	121.4
1352	T	28	Very low	30.3	Very low	118 Å²	118	117.1 Å²	117.1	72%	0.724	70%	0.699	S	S	*	*				50.2	99.8	115.3	57.9	0	0	0	0	121.7
1353	T	25.2	Very low	30.4	Very low	117 Å²	117	119.1 Å²	119.1	72%	0.718	71%	0.709	S	S	*	*				58.4	108	121.4	57.8	0	0	0	0	123.5
1354	T	25.7	Very low	30.3	Very low	118 Å²	118	118.6 Å²	118.6	72%	0.724	71%	0.71	S	S	*	*				78	160.6	123.4	61.9	0	0	0	0	123.6
1355	T	25.2	Very low	30.1	Very low	124 Å²	124	118.5 Å²	118.5	76%	0.761	71%	0.71	S	S	*	*			trans	82.2	150.2	161.5	73.7	0	0	0	0	117.3
1356	T	26.6	Very low	30	Very low	107 Å²	107	118.8 Å²	118.8	66%	0.656	71%	0.711	S	S	*	*			cis	-158.3	175.4	-10.8	13.7	0	0	0	0	109.7
1357	T	30.4	Very low	29.6	Very low	123 Å²	123	120.4 Å²	120.4	76%	0.755	71%	0.71	S	S	*	*				174.2	153	78.1	37.9	0	0	0	0	110.2
1358	T	34.1	Very low	29.2	Very low	116 Å²	116	119.3 Å²	119.3	71%	0.712	71%	0.707	S	S	*	*			cis	-136	-84.4	-27.4	4.6	0	0	0	0	109.1
1359	T	32.1	Very low	28.7	Very low	114 Å²	114	121.3 Å²	121.3	70%	0.699	71%	0.712	S	S	*	*			cis	-166.8	143.9	-33.3	-18.7	0	0	0	0	106.8
1360	T	30.5	Very low	28.6	Very low	116 Å²	116	123.4 Å²	123.4	71%	0.712	71%	0.713	S	S	*	*			cis	-89.4	-148	-13.5	54.8	0	0	0	0	108.7
1361	H	31.3	Very low	28.3	Very low	153 Å²	153	122 Å²	122	71%	0.708	71%	0.708	S	S	*	*			cis	-144.2	128.3	-4.8	-132.2	-38	0	0	0	108.4
1362	N	29.8	Very low	28.2	Very low	120 Å²	120	123.6 Å²	123.6	64%	0.642	71%	0.711	S	S	*	*			trans	41.7	126.4	153.1	-55.5	13.6	0	0	0	121.2
1363	N	30.9	Very low	28.5	Very low	155 Å²	155	124.2 Å²	124.2	83%	0.829	72%	0.715	S	S	*	*			trans	74	143.2	144.5	-60.8	-0.1	0	0	0	117.6
1364	S	31.4	Very low	29	Very low	100 Å²	100	123.5 Å²	123.5	70%	0.699	71%	0.712	S	S	*	*			cis	-160.5	163.8	-5.4	50	0	0	0	0	113.5
1365	T	31.1	Very low	28.9	Very low	111 Å²	111	122.2 Å²	122.2	68%	0.681	71%	0.708	S	S	*	*			trans	2.6	142.4	145.9	62.8	0	0	0	0	121.6
1366	T	27.1	Very low	29.1	Very low	105 Å²	105	121.8 Å²	121.8	64%	0.644	71%	0.705	S	S	*	*			trans	71.6	140.9	130.4	55.5	0	0	0	0	123.7
1367	H	27.5	Very low	29.3	Very low	160 Å²	160	125 Å²	125	74%	0.741	71%	0.71	S	S	*	*			trans	70.1	135.3	153.9	-59.3	-42.2	0	0	0	118
1368	S	22.7	Very low	29.1	Very low	92 Å²	92	124.7 Å²	124.7	64%	0.643	70%	0.704	S	S	*	*			cis	86.3	113.3	27.2	-52.7	0	0	0	0	115.1
1369	I	24.7	Very low	29	Very low	152 Å²	152	126.3 Å²	126.3	78%	0.779	71%	0.709	S	S	*	*			trans	74.3	159.8	159.6	-48.6	156.9	0	0	0	114.2
1370	H	26.4	Very low	29	Very low	163 Å²	163	124.6 Å²	124.6	76%	0.755	70%	0.701	S	S	*	*			trans	67.9	114.2	-176.5	-67.3	-67.3	0	0	0	114.4
1371	S	22.9	Very low	28.8	Very low	87 Å²	87	124 Å²	124	61%	0.608	71%	0.708	S	S	*	*				76.1	158.4	55.4	82.9	0	0	0	0	113.5
1372	I	29.5	Very low	28.8	Very low	145 Å²	145	121.4 Å²	121.4	74%	0.744	70%	0.699	S	S	*	*			trans	76.8	93	-179.1	-52.1	169.4	0	0	0	112.8	P1374	I1372-P1374 WeakPolarHBondContact O-CD 3.41Å
1373	T	33.1	Very low	28.8	Very low	131 Å²	131	119.4 Å²	119.4	80%	0.804	71%	0.706	S	S	*	*			trans	-54.3	134	144.6	47	0	0	0	0	110.3
1374	P	36.6	Very low	28.8	Very low	101 Å²	101	117 Å²	117	66%	0.656	70%	0.702	S	S	*	*				-124.9	122	122.8	32.5	-23.9	0	0	0	108.7	I1372	I1372-P1374 WeakPolarHBondContact O-CD 3.41Å
1375	S	23.9	Very low	28.7	Very low	91 Å²	91	115.5 Å²	115.5	64%	0.636	69%	0.691	S	S	*	*				65.2	142.1	57.6	85	0	0	0	0	113.6
1376	T	27.7	Very low	28.6	Very low	115 Å²	115	114.7 Å²	114.7	71%	0.706	68%	0.678	S	S	*	*			trans	72.9	115	169.1	56.4	0	0	0	0	119.3
1377	F	30.8	Very low	28.6	Very low	174 Å²	174	116.2 Å²	116.2	76%	0.763	67%	0.673	S	S	*	*			trans	75.1	120.3	146.3	-74.5	-123.7	0	0	0	116
1378	N	27.6	Very low	28.8	Very low	118 Å²	118	111.9 Å²	111.9	63%	0.631	66%	0.658	S	S	*	*				64.4	120	86	-55.9	-1.9	0	0	0	110.4
1379	D	31.2	Very low	29.3	Very low	150 Å²	150	113.8 Å²	113.8	80%	0.802	66%	0.655	S	S	*	*			cis	-127.5	150.9	35.9	-80.8	-44.4	0	0	0	116.1
1380	S	32	Very low	29.5	Very low	77 Å²	77	114 Å²	114	54%	0.538	65%	0.653	S	S	.	*			cis	95	32.7	36.6	-46.3	0	0	0	0	117.2
1381	A	27.2	Very low	29.6	Very low	104 Å²	104	111.8 Å²	111.8	86%	0.86	65%	0.646	S	S	*	*			trans	63.2	-152.4	142.3	0	0	0	0	0	117.5
1382	I	30.4	Very low	29.9	Very low	99 Å²	99	113.9 Å²	113.9	51%	0.508	65%	0.651	S	S	.	*			trans	83.9	96.3	173.3	-51.6	-175.8	0	0	0	116.7	K1386	I1382-K1386 VanDerWaalsContact CD1-NZ 3.35Å
1383	G	29.8	Very low	29.9	Very low	78 Å²	78	111 Å²	111	80%	0.804	64%	0.643	S	S	*	*	S	Bend		-154.8	101.1	118.8	0	0	0	0	0	110.5
1384	S	31.2	Very low	29.6	Very low	105 Å²	105	114.1 Å²	114.1	73%	0.734	65%	0.646	S	S	*	*	S	Bend	cis	-146	126.5	-9.7	-72	0	0	0	0	107.7
1385	S	28.9	Very low	29.1	Very low	68 Å²	68	115 Å²	115	48%	0.476	64%	0.644	S	S	.	*				59.7	121.5	71.6	173	0	0	0	0	112.4
1386	K	29.3	Very low	29.3	Very low	94 Å²	94	116.6 Å²	116.6	41%	0.409	65%	0.645	S	S	.	*			cis	-159.6	-179	6.6	-104.3	161.5	-167.6	167.5	0	106	I1382 P1626	I1382-K1386 VanDerWaalsContact CD1-NZ 3.35Å; K1386-P1626 WeakPolarHBondContact O-CB 3.4Å; K1386-P1626 WeakPolarHBondContact O-CG 3.44Å
1387	Y	27.8	Very low	29.3	Very low	136 Å²	136	113.8 Å²	113.8	53%	0.533	63%	0.63	S	S	.	*			cis	-165.4	172.2	0	-124	-30.7	0	0	0	109	I1628	Y1387-I1628 HydrophobicContact CD2-CD1 4.23Å; Y1387-I1628 HydrophobicContact CD2-CG1 3.9Å
1388	T	31	Very low	29.2	Very low	70 Å²	70	110.3 Å²	110.3	43%	0.429	62%	0.618	S	S	.	*			trans	62.3	143.5	158.6	52.4	0	0	0	0	119.9	I1628	T1388-I1628 PolarHBondContact OG1-N 2.81Å
1389	K	32.6	Very low	29.1	Very low	132 Å²	132	113.6 Å²	113.6	57%	0.574	62%	0.623	S	S	*	*			cis	-149	123.9	-3.8	-108.7	156.9	-178.5	175.2	0	107.7
1390	Q	29.5	Very low	29.1	Very low	157 Å²	157	112 Å²	112	73%	0.734	61%	0.613	S	S	*	*				68.2	137.2	93.6	-69.7	-162.9	-46	0	0	115
1391	N	29.4	Very low	29	Very low	115 Å²	115	113 Å²	113	62%	0.615	62%	0.621	S	S	*	*			cis	-165.3	-177.4	7.5	-102.2	2.3	0	0	0	108
1392	N	28.9	Very low	29.2	Very low	132 Å²	132	117.7 Å²	117.7	71%	0.706	62%	0.622	S	S	*	*			cis	-176.6	166.7	-36.2	-94.3	9.9	0	0	0	108
1393	S	28.7	Very low	29.2	Very low	83 Å²	83	115.8 Å²	115.8	58%	0.58	63%	0.627	S	S	*	*			cis	-177.1	141.4	-31.8	58.4	0	0	0	0	112.6
1394	F	27	Very low	29.2	Very low	197 Å²	197	118.9 Å²	118.9	86%	0.864	63%	0.625	S	S	*	*			trans	68.2	138.5	149	-78.6	-61.4	0	0	0	125
1395	I	26.5	Very low	29	Very low	121 Å²	121	120.8 Å²	120.8	62%	0.621	62%	0.622	S	S	*	*			trans	76.3	96.7	142.2	-59.7	168.1	0	0	0	123.8	S1429	I1395-S1429 PolarHBondContact O-OG 3.19Å
1396	N	27.3	Very low	29	Very low	124 Å²	124	123 Å²	123	66%	0.663	63%	0.628	S	S	*	*				54.9	124.9	116.2	-150.4	21	0	0	0	124.1	L1428 S1429	N1396-L1428 PolarHBondContact N-O 3.38Å; N1396-S1429 WeakPolarHBondContact O-CB 3.43Å; N1396-S1429 PolarHBondContact O-OG 3.01Å
1397	S	27.7	Very low	29.1	Very low	56 Å²	56	126 Å²	126	39%	0.392	64%	0.641	S	S	.	*			trans	84.1	157.1	161	81.3	0	0	0	0	120.1	L1427 L1428 S1429	S1397-L1427 CarbonylContact C-O 3.57Å; S1397-L1427 WeakPolarHBondContact CA-O 3.35Å; S1397-L1427 PolarHBondContact N-O 3.37Å; S1397-L1427 VanDerWaalsContact N-O 3.11Å; S1397-L1428 CarbonylContact O-C 3.58Å; S1397-L1428 WeakPolarHBondContact O-CA 3.28Å; S1397-L1428 VanDerWaalsContact O-CB 3.26Å; S1397-L1428 WeakPolarHBondContact O-CB 3.18Å; S1397-L1428 PolarHBondContact O-N 3.37Å; S1397-S1429 WeakPolarHBondContact O-CA 3Å; S1397-S1429 WeakPolarHBondContact O-CB 3.48Å
1398	I	28.1	Very low	29.3	Very low	100 Å²	100	124.3 Å²	124.3	51%	0.513	64%	0.641	S	S	.	*			trans	95.7	176.5	179.1	-53.4	163.4	0	0	0	115.5	L1428	I1398-L1428 HydrophobicContact CB-CB 4.49Å; I1398-L1428 HydrophobicContact CG2-CD1 4.48Å
1399	Y	27.4	Very low	29.4	Very low	187 Å²	187	126 Å²	126	73%	0.733	65%	0.648	S	S	*	*			trans	-130.9	147.8	-147.4	-136	-127.1	0	0	0	115
1400	I	30.2	Very low	29.5	Very low	116 Å²	116	127.7 Å²	127.7	60%	0.595	66%	0.655	S	S	*	*			trans	48.9	105.2	150.5	-62.8	-175.9	0	0	0	122.5
1401	S	29.2	Very low	30.3	Very low	100 Å²	100	128.9 Å²	128.9	70%	0.699	66%	0.66	S	S	*	*			trans	63.4	158.6	137.1	88.2	0	0	0	0	121.3
1402	K	31.6	Very low	30.3	Very low	201 Å²	201	126.9 Å²	126.9	87%	0.874	67%	0.667	S	S	*	*			cis	-163.2	148.6	16	-150.4	168.2	-175.6	178	0	112.8
1403	G	31.2	Very low	30.3	Very low	60 Å²	60	128.1 Å²	128.1	62%	0.619	67%	0.672	S	S	*	*			trans	96.5	135.7	164.7	0	0	0	0	0	115.4
1404	N	29.8	Very low	30.2	Very low	142 Å²	142	128.9 Å²	128.9	76%	0.759	68%	0.677	S	S	*	*			cis	87.8	124.7	47.5	-81.3	62.5	0	0	0	111.5
1405	E	27.8	Very low	30.2	Very low	146 Å²	146	124.8 Å²	124.8	68%	0.682	66%	0.664	S	S	*	*			cis	-140.3	136.8	11.5	-65.2	-150.7	146.6	0	0	114.4
1406	I	28.5	Very low	30.2	Very low	115 Å²	115	128.7 Å²	128.7	59%	0.59	67%	0.672	S	S	*	*				73.9	150.5	97.7	-45.2	164.7	0	0	0	115.3
1407	F	31.3	Very low	30.2	Very low	156 Å²	156	126.9 Å²	126.9	68%	0.684	67%	0.669	S	S	*	*			trans	84.6	149	164.5	-66.9	-58.5	0	0	0	117.2
1408	N	32.1	Very low	30.2	Very low	100 Å²	100	129.4 Å²	129.4	54%	0.535	69%	0.687	S	S	.	*			cis	-151.4	168.2	5.9	-129.3	-31.2	0	0	0	108.2
1409	N	32.1	Very low	30.2	Very low	106 Å²	106	129.5 Å²	129.5	57%	0.567	70%	0.697	S	S	*	*	S	Bend	cis	-147.9	155.7	22.8	-69	-86.7	0	0	0	110.6
1410	K	35.3	Very low	30.2	Very low	168 Å²	168	129.1 Å²	129.1	73%	0.73	71%	0.706	S	S	*	*			cis	-143.8	116.7	-15.2	-114.4	164.2	175.4	112.9	0	105.4
1411	Q	47.1	Very low	30	Very low	181 Å²	181	128.7 Å²	128.7	85%	0.846	71%	0.714	S	S	*	*			trans	-145.9	162.8	-150.9	-68.2	174.3	-11	0	0	113.3
1412	G	27.6	Very low	30	Very low	74 Å²	74	130.5 Å²	130.5	76%	0.763	72%	0.72	S	S	*	*			trans	123.2	152.5	-171.6	0	0	0	0	0	110.2
1413	I	29.6	Very low	30.1	Very low	157 Å²	157	126.1 Å²	126.1	81%	0.805	71%	0.713	S	S	*	*			cis	-155.7	166.6	-1.5	-123.1	169.2	0	0	0	106.1
1414	S	26.3	Very low	30.4	Very low	99 Å²	99	129 Å²	129	69%	0.692	72%	0.72	S	S	*	*			cis	-109.9	-173.8	17.5	68	0	0	0	0	112.2
1415	L	27.6	Very low	30.5	Very low	112 Å²	112	127.8 Å²	127.8	59%	0.586	72%	0.72	S	S	*	*			cis	77	124.6	22.5	-36.9	-171.9	0	0	0	116.1
1416	Y	26.5	Very low	30.3	Very low	202 Å²	202	125.2 Å²	125.2	79%	0.792	72%	0.718	S	S	*	*			cis	-148.8	156.7	-5.2	-118.4	-51.4	0	0	0	113.4
1417	S	27.7	Very low	30.1	Very low	86 Å²	86	124.8 Å²	124.8	60%	0.601	72%	0.717	S	S	*	*			trans	-28.3	154.6	174.3	53.7	0	0	0	0	120.9
1418	S	28.2	Very low	29.8	Very low	109 Å²	109	121.5 Å²	121.5	76%	0.762	71%	0.706	S	S	*	*			cis	79.2	159.7	21	90.8	0	0	0	0	117.2
1419	S	27.8	Very low	29.5	Very low	102 Å²	102	119.3 Å²	119.3	71%	0.713	70%	0.698	S	S	*	*				-174.4	141.4	-50.5	54.8	0	0	0	0	113.1
1420	L	26.7	Very low	29.3	Very low	179 Å²	179	118.2 Å²	118.2	94%	0.937	70%	0.699	S	S	*	*			trans	59.5	-177.5	156.4	-102.9	69.8	0	0	0	119.8
1421	S	25.9	Very low	28.9	Very low	108 Å²	108	116.2 Å²	116.2	76%	0.755	70%	0.696	S	S	*	*			trans	-139.1	175.1	-165.4	60.2	0	0	0	0	114.1
1422	V	28.4	Very low	28.1	Very low	137 Å²	137	113.3 Å²	113.3	83%	0.83	69%	0.686	S	S	*	*			trans	122.1	138.8	170.6	174.4	0	0	0	0	112.6
1423	P	35.3	Very low	28	Very low	110 Å²	110	115.3 Å²	115.3	71%	0.714	68%	0.68	S	S	*	*			trans	-104.5	-176.5	-162.3	41.6	-34.1	0	0	0	114.3
1424	P	37.8	Very low	27.9	Very low	120 Å²	120	113.6 Å²	113.6	78%	0.779	68%	0.677	S	S	*	*			cis	-121.5	-137.7	1.7	34.5	-10	0	0	0	111.2
1425	P	30.9	Very low	28.1	Very low	116 Å²	116	115.5 Å²	115.5	75%	0.753	68%	0.679	S	S	*	*			cis	-135.4	-136.4	-11.2	43.8	-21.2	0	0	0	115.2
1426	S	24.2	Very low	27.9	Very low	93 Å²	93	115.8 Å²	115.8	65%	0.65	68%	0.68	S	S	*	*			trans	-123.4	162	-176.1	58.6	0	0	0	0	112.9
1427	L	24	Very low	28.3	Very low	106 Å²	106	111.2 Å²	111.2	56%	0.555	68%	0.675	S	S	*	*			cis	84.8	134.9	20.6	-53	169.3	0	0	0	114.6	S1397	S1397-L1427 CarbonylContact C-O 3.57Å; S1397-L1427 WeakPolarHBondContact CA-O 3.35Å; S1397-L1427 PolarHBondContact N-O 3.37Å; S1397-L1427 VanDerWaalsContact N-O 3.11Å
1428	L	24.7	Very low	28.2	Very low	86 Å²	86	116.1 Å²	116.1	45%	0.45	69%	0.686	S	S	.	*			cis	-125.4	-119.4	-11.6	-71.7	179.5	0	0	0	112.3	N1396 S1397 I1398	N1396-L1428 PolarHBondContact N-O 3.38Å; S1397-L1428 CarbonylContact O-C 3.58Å; S1397-L1428 WeakPolarHBondContact O-CA 3.28Å; S1397-L1428 VanDerWaalsContact O-CB 3.26Å; S1397-L1428 WeakPolarHBondContact O-CB 3.18Å; S1397-L1428 PolarHBondContact O-N 3.37Å; I1398-L1428 HydrophobicContact CB-CB 4.49Å; I1398-L1428 HydrophobicContact CG2-CD1 4.48Å
1429	S	25.4	Very low	28	Very low	54 Å²	54	120.9 Å²	120.9	38%	0.378	69%	0.689	S	S	.	*			cis	-138.8	-99.4	38.9	65.6	0	0	0	0	122.9	I1395 N1396 S1397	I1395-S1429 PolarHBondContact O-OG 3.19Å; N1396-S1429 WeakPolarHBondContact O-CB 3.43Å; N1396-S1429 PolarHBondContact O-OG 3.01Å; S1397-S1429 WeakPolarHBondContact O-CA 3Å; S1397-S1429 WeakPolarHBondContact O-CB 3.48Å
1430	S	27.4	Very low	27.8	Very low	83 Å²	83	119.6 Å²	119.6	58%	0.58	68%	0.68	S	S	*	*			trans	-158.1	-171.3	-132.6	63.6	0	0	0	0	116.5
1431	N	27.8	Very low	27.5	Very low	127 Å²	127	114.6 Å²	114.6	68%	0.679	66%	0.66	S	S	*	*			cis	-163.8	-173.2	6.8	-151.1	63.5	0	0	0	112.8
1432	N	29.4	Very low	27.4	Very low	119 Å²	119	116.8 Å²	116.8	64%	0.636	66%	0.658	S	S	*	*			trans	67.1	147.9	169.4	-66.4	51.1	0	0	0	117.9
1433	D	25.6	Very low	27.1	Very low	116 Å²	116	116.7 Å²	116.7	62%	0.62	65%	0.652	S	S	*	*			cis	-162.2	144.7	-7.2	-105.9	-20.1	0	0	0	115.4
1434	T	27.2	Very low	26.5	Very low	122 Å²	122	117.4 Å²	117.4	75%	0.748	65%	0.649	S	S	*	*			trans	74.1	150.3	150.8	61.2	0	0	0	0	125.6
1435	N	30.8	Very low	25.8	Very low	138 Å²	138	119.7 Å²	119.7	74%	0.738	65%	0.646	S	S	*	*			trans	68.5	118.5	176.9	-59.5	-26.5	0	0	0	117.4
1436	I	24.8	Very low	25.5	Very low	118 Å²	118	118.8 Å²	118.8	61%	0.605	64%	0.643	S	S	*	*			cis	75.4	132.2	41.9	-55.3	168.5	0	0	0	112.4
1437	P	34.3	Very low	25.5	Very low	107 Å²	107	119.9 Å²	119.9	70%	0.695	64%	0.641	S	S	*	*			cis	-118.1	-171.6	1.6	43	-30.7	0	0	0	113.3
1438	F	25.1	Very low	25.5	Very low	188 Å²	188	122.5 Å²	122.5	83%	0.825	65%	0.65	S	S	*	*	S	Bend	cis	-110.3	144.2	-18.3	-76.1	-109.8	0	0	0	107.1
1439	Y	24.9	Very low	25.4	Very low	209 Å²	209	125.7 Å²	125.7	82%	0.82	67%	0.667	S	S	*	*	S	Bend	cis	-117	153.7	-11.9	-129.2	-87.6	0	0	0	108.1
1440	S	23	Very low	25.3	Very low	76 Å²	76	127.9 Å²	127.9	53%	0.531	68%	0.681	S	S	.	*			trans	-17.8	137	161	-123.3	0	0	0	0	116.1
1441	S	21.3	Very low	25.5	Very low	74 Å²	74	132.1 Å²	132.1	52%	0.517	69%	0.689	S	S	.	*			cis	53.8	143.5	42	103.6	0	0	0	0	112.2
1442	H	23	Very low	25.3	Very low	154 Å²	154	132.7 Å²	132.7	71%	0.713	69%	0.691	S	S	*	*			cis	-168.5	158.5	2.1	-141.3	-51.2	0	0	0	106.1
1443	L	22.5	Very low	25.3	Very low	134 Å²	134	131.5 Å²	131.5	70%	0.702	69%	0.69	S	S	*	*			trans	64.2	167.6	147.7	-86.6	156.6	0	0	0	119.7
1444	I	21.9	Very low	25.3	Very low	126 Å²	126	134.2 Å²	134.2	65%	0.646	70%	0.699	S	S	*	*			trans	63.9	133.4	148.9	-72.3	156.7	0	0	0	118.4
1445	K	22.6	Very low	25.3	Very low	168 Å²	168	132.4 Å²	132.4	73%	0.73	69%	0.691	S	S	*	*			trans	67.5	133.7	169.1	-72.1	161.7	-166.2	174.9	0	114.4
1446	S	25.6	Very low	25	Very low	97 Å²	97	134.3 Å²	134.3	68%	0.678	70%	0.695	S	S	*	*			cis	48.2	75.7	23	85.7	0	0	0	0	113
1447	D	23.2	Very low	25.1	Very low	115 Å²	115	134.1 Å²	134.1	62%	0.615	70%	0.704	S	S	*	*			trans	76.5	154.6	157.1	-32.1	-61.4	0	0	0	115.8
1448	H	24.8	Very low	24.4	Very low	161 Å²	161	135.3 Å²	135.3	75%	0.745	71%	0.71	S	S	*	*			cis	-147.6	177.8	11.9	-84.2	-74.6	0	0	0	110.5
1449	L	22.4	Very low	24.9	Very low	153 Å²	153	131.3 Å²	131.3	80%	0.801	70%	0.703	S	S	*	*			trans	68.6	130.6	157.7	-62.6	136.1	0	0	0	115.7
1450	C	23.9	Very low	24.7	Very low	101 Å²	101	127.9 Å²	127.9	68%	0.682	70%	0.697	S	S	*	*	S	Bend	cis	-137.8	160.3	15.7	-83.9	0	0	0	0	109.8
1451	K	30.6	Very low	24.7	Very low	171 Å²	171	132.3 Å²	132.3	74%	0.743	71%	0.707	S	S	*	*			cis	-148.5	128.6	2.7	-115	158.3	-177	-178.9	0	106.5
1452	I	24.3	Very low	24.9	Very low	139 Å²	139	137.3 Å²	137.3	71%	0.713	73%	0.727	S	S	*	*				64.3	124.2	101.3	-65.7	-173.5	0	0	0	113.6
1453	P	28.7	Very low	24.9	Very low	94 Å²	94	133.1 Å²	133.1	61%	0.61	72%	0.715	S	S	*	*			cis	-141.2	-161.5	-18.4	37.7	-15.3	0	0	0	113.5
1454	Q	27.1	Very low	25	Very low	174 Å²	174	132 Å²	132	81%	0.813	71%	0.714	S	S	*	*			trans	34.3	145.8	136.9	-70.6	155.7	-8.7	0	0	121.6
1455	S	25.9	Very low	25.2	Very low	84 Å²	84	133.4 Å²	133.4	59%	0.587	72%	0.715	S	S	*	*			cis	-179.7	160.7	-8.2	52.9	0	0	0	0	112.2
1456	H	25.9	Very low	25.4	Very low	177 Å²	177	132 Å²	132	82%	0.819	71%	0.711	S	S	*	*			trans	69.1	164.8	149	-72.6	-56.6	0	0	0	121.8
1457	S	25.6	Very low	25.4	Very low	114 Å²	114	131.8 Å²	131.8	80%	0.797	71%	0.706	S	S	*	*			trans	78.1	137.7	158.6	34.6	0	0	0	0	120.7
1458	T	19.8	Very low	25.4	Very low	132 Å²	132	134.9 Å²	134.9	81%	0.81	71%	0.714	S	S	*	*			trans	-82.2	-141.1	158.7	41.6	0	0	0	0	109
1459	P	36.8	Very low	25.5	Very low	105 Å²	105	134.4 Å²	134.4	68%	0.682	72%	0.716	S	S	*	*				-105.3	-144.8	-123.3	34.5	-13.7	0	0	0	111.8
1460	I	20.6	Very low	25.8	Very low	136 Å²	136	134.4 Å²	134.4	70%	0.697	71%	0.712	S	S	*	*			trans	83.5	120	156.4	-79.1	162.6	0	0	0	117.2
1461	F	21.2	Very low	26	Very low	169 Å²	169	135.5 Å²	135.5	74%	0.741	71%	0.711	S	S	*	*			trans	49.6	123.9	148	-72.6	-126.4	0	0	0	119.6
1462	L	26.8	Very low	25.7	Very low	180 Å²	180	133.9 Å²	133.9	94%	0.942	71%	0.709	S	S	*	*				-136.6	128.7	102.1	-109	168.2	0	0	0	109.4
1463	S	22.1	Very low	25.7	Very low	65 Å²	65	135.1 Å²	135.1	46%	0.455	71%	0.712	S	S	.	*			trans	-111.7	174.7	-178.9	59.2	0	0	0	0	110.8
1464	T	25.1	Very low	25.7	Very low	110 Å²	110	135.8 Å²	135.8	68%	0.675	72%	0.719	S	S	*	*			trans	66.7	118	158.8	50.4	0	0	0	0	120.2
1465	K	25.5	Very low	25.6	Very low	156 Å²	156	131.2 Å²	131.2	68%	0.678	71%	0.707	S	S	*	*				74.9	157.6	125.7	-65.5	179	163.3	-73.8	0	118.3
1466	E	27	Very low	25.7	Very low	139 Å²	139	136.5 Å²	136.5	65%	0.65	72%	0.715	S	S	*	*			cis	-165.2	169.9	-25.3	-109.7	161.3	-169.1	0	0	106.7
1467	T	25.4	Very low	25.6	Very low	93 Å²	93	132.7 Å²	132.7	57%	0.571	71%	0.708	S	S	*	*			cis	-152.1	161.1	7.2	-4.7	0	0	0	0	109.3
1468	K	24.4	Very low	25.5	Very low	179 Å²	179	130.3 Å²	130.3	78%	0.778	69%	0.692	S	S	*	*			trans	60.7	132.5	151	-61	155.6	-176.5	167.9	0	119.2
1469	L	26.3	Very low	25.9	Very low	152 Å²	152	133 Å²	133	80%	0.796	69%	0.688	S	S	*	*				-163.7	138.2	101.9	-125.7	80.6	0	0	0	113.6
1470	H	28.4	Very low	25.4	Very low	152 Å²	152	136.5 Å²	136.5	70%	0.704	69%	0.689	S	S	*	*			trans	59.9	138.8	155.9	-91.8	-80.1	0	0	0	124.9
1471	N	28.4	Very low	25.4	Very low	125 Å²	125	137.6 Å²	137.6	67%	0.668	69%	0.691	S	S	*	*			trans	63	111.5	156.9	-57	-13.9	0	0	0	118.1
1472	L	24	Very low	25.5	Very low	136 Å²	136	133.8 Å²	133.8	71%	0.712	69%	0.685	S	S	*	*			cis	72.9	121.5	47.9	-63.4	167.5	0	0	0	114.9
1473	Q	23.8	Very low	25.5	Very low	166 Å²	166	133.2 Å²	133.2	78%	0.776	68%	0.682	S	S	*	*			trans	58.2	139.1	148.4	-65	158.4	-56	0	0	117.9
1474	S	29.1	Very low	25.8	Very low	108 Å²	108	137.3 Å²	137.3	76%	0.755	70%	0.698	S	S	*	*			cis	-110.7	144.4	11.9	57.1	0	0	0	0	112.3
1475	S	26.7	Very low	25.9	Very low	78 Å²	78	137.5 Å²	137.5	55%	0.545	70%	0.702	S	S	.	*				61.6	135.4	56.2	-72.1	0	0	0	0	112.5
1476	Y	26.5	Very low	26	Very low	195 Å²	195	135.8 Å²	135.8	77%	0.765	70%	0.704	S	S	*	*			cis	-148.5	147.5	-0.4	-119.4	-75.9	0	0	0	103.8
1477	S	23.8	Very low	25.9	Very low	96 Å²	96	133.3 Å²	133.3	67%	0.671	70%	0.702	S	S	*	*			cis	53.9	142.3	48.9	-175.7	0	0	0	0	110.6
1478	S	24.6	Very low	26	Very low	65 Å²	65	135.1 Å²	135.1	46%	0.455	71%	0.708	S	S	.	*			cis	-154.2	-177.7	-1.7	30.9	0	0	0	0	106.1
1479	Y	27.1	Very low	26.2	Very low	189 Å²	189	132.5 Å²	132.5	74%	0.741	70%	0.703	S	S	*	*				-172.7	124.6	84.9	-104.2	-100.7	0	0	0	107.5
1480	Y	26	Very low	26.2	Very low	177 Å²	177	133.6 Å²	133.6	69%	0.694	71%	0.709	S	S	*	*				62.4	117.5	105	-82.7	-95.5	0	0	0	113.2
1481	Q	21.5	Very low	26	Very low	160 Å²	160	132.6 Å²	132.6	75%	0.748	71%	0.708	S	S	*	*			cis	62.9	111.6	44.9	-161.9	70.4	17.9	0	0	112.2
1482	S	22.6	Very low	25.9	Very low	88 Å²	88	135.7 Å²	135.7	62%	0.615	72%	0.718	S	S	*	*			trans	47.9	134.5	157.2	65.2	0	0	0	0	120.5
1483	L	26.8	Very low	25.9	Very low	168 Å²	168	134.3 Å²	134.3	88%	0.88	71%	0.712	S	S	*	*				-157.1	145.5	102.6	-106.2	161.2	0	0	0	112.3
1484	L	29.6	Very low	25.8	Very low	151 Å²	151	135.1 Å²	135.1	79%	0.791	71%	0.709	S	S	*	*			trans	-83.7	168.3	163.4	-64.9	137.6	0	0	0	108.4
1485	P	27.2	Very low	25.5	Very low	115 Å²	115	137.6 Å²	137.6	75%	0.747	71%	0.706	S	S	*	*				-132.1	172.8	86.3	34.9	-19.5	0	0	0	110.6
1486	V	27.6	Very low	25.3	Very low	119 Å²	119	143.9 Å²	143.9	72%	0.721	72%	0.719	S	S	*	*			cis	-154.5	121	41	152.7	0	0	0	0	105.1
1487	S	24.3	Very low	25.5	Very low	88 Å²	88	141.4 Å²	141.4	62%	0.615	72%	0.719	S	S	*	*				59.4	135.5	73.6	72.1	0	0	0	0	113.4
1488	D	28.2	Very low	25.9	Very low	131 Å²	131	141.4 Å²	141.4	70%	0.701	72%	0.717	S	S	*	*			cis	-152.3	154.6	17.1	-108.4	-33.6	0	0	0	114.2
1489	N	27.6	Very low	25.9	Very low	123 Å²	123	143.5 Å²	143.5	66%	0.658	72%	0.723	S	S	*	*			trans	43.3	111.8	144.2	-54.9	-41.2	0	0	0	122.2
1490	L	26.4	Very low	25.8	Very low	176 Å²	176	145.6 Å²	145.6	92%	0.921	73%	0.731	S	S	*	*				-133.5	93.8	107	-107.4	175.8	0	0	0	109.6
1491	L	24.7	Very low	25.9	Very low	131 Å²	131	141.8 Å²	141.8	69%	0.686	72%	0.723	S	S	*	*			trans	-131.8	107.5	171.2	178.6	75.5	0	0	0	107.8
1492	E	25.4	Very low	26	Very low	190 Å²	190	141.6 Å²	141.6	89%	0.888	73%	0.726	S	S	*	*			trans	-98	84.8	165.2	-73.8	-163	141.1	0	0	110
1493	D	23.8	Very low	26.3	Very low	107 Å²	107	140.5 Å²	140.5	57%	0.572	73%	0.728	S	S	*	*			trans	-75.4	129.9	143.9	-91.4	-50.3	0	0	0	107.8
1494	Y	23.3	Very low	26.4	Very low	182 Å²	182	138.5 Å²	138.5	71%	0.714	72%	0.718	S	S	*	*				167.2	130.1	106.6	-94.8	-63.3	0	0	0	115.4
1495	K	21.3	Very low	26.4	Very low	161 Å²	161	138.4 Å²	138.4	70%	0.7	71%	0.714	S	S	*	*			trans	73.6	150.4	137.5	-86.2	156.2	-173	156.6	0	122.6
1496	Y	23.2	Very low	26.3	Very low	210 Å²	210	139.5 Å²	139.5	82%	0.824	71%	0.712	S	S	*	*			trans	66.8	80	153.1	-82.9	-69	0	0	0	120.7
1497	N	30.4	Very low	26.1	Very low	142 Å²	142	139.8 Å²	139.8	76%	0.759	71%	0.71	S	S	*	*			trans	-43.3	142.2	135.3	176.5	22.2	0	0	0	112.6
1498	P	32	Very low	26.4	Very low	97 Å²	97	141.3 Å²	141.3	63%	0.63	71%	0.711	S	S	*	*			trans	-144.2	140.5	135.1	35.9	-20.4	0	0	0	117
1499	N	25.8	Very low	26.2	Very low	108 Å²	108	142.8 Å²	142.8	58%	0.578	71%	0.714	S	S	*	*			trans	70.6	149.9	148.3	-55.9	-16.4	0	0	0	118.5	N1501	N1499-N1501 PolarHBondContact ND2-ND2 3.35Å; N1499-N1501 PolarHBondContact OD1-ND2 3.41Å; N1499-N1501 PolarHBondContact OD1-OD1 3.28Å
1500	Y	25	Very low	26.1	Very low	233 Å²	233	144.2 Å²	144.2	91%	0.914	72%	0.721	S	S	*	*			cis	-78.7	136	6.3	-77.4	-107.1	0	0	0	112.3
1501	N	26.7	Very low	26.2	Very low	98 Å²	98	141.3 Å²	141.3	52%	0.524	71%	0.71	S	S	.	*				59.4	110.8	52.7	-73.8	-14.5	0	0	0	113.7	N1499	N1499-N1501 PolarHBondContact ND2-ND2 3.35Å; N1499-N1501 PolarHBondContact OD1-ND2 3.41Å; N1499-N1501 PolarHBondContact OD1-OD1 3.28Å
1502	I	24.6	Very low	26.3	Very low	156 Å²	156	141.5 Å²	141.5	80%	0.8	71%	0.712	S	S	*	*			cis	75.6	110.4	32.2	-47.1	176.4	0	0	0	114.6
1503	G	28.1	Very low	26.4	Very low	64 Å²	64	139.8 Å²	139.8	66%	0.66	70%	0.703	S	S	*	*			trans	-156.5	117.9	149.9	0	0	0	0	0	105.8
1504	N	29.8	Very low	26.4	Very low	127 Å²	127	141.3 Å²	141.3	68%	0.679	71%	0.707	S	S	*	*				74.2	135.2	76.7	-70.5	-2.2	0	0	0	112.8
1505	Q	28.4	Very low	26.4	Very low	149 Å²	149	140.3 Å²	140.3	70%	0.696	71%	0.709	S	S	*	*			cis	-164.2	154.3	-8.1	-118.8	169.9	-14.7	0	0	110.2
1506	L	25.9	Very low	26.8	Very low	138 Å²	138	140 Å²	140	72%	0.723	71%	0.713	S	S	*	*			trans	39.6	129	143.3	-62.4	165	0	0	0	122.7
1507	N	23.9	Very low	26.9	Very low	125 Å²	125	136.6 Å²	136.6	67%	0.668	71%	0.709	S	S	*	*				96.3	140.2	127.8	-86.2	44.3	0	0	0	124.8
1508	D	29.1	Very low	26.9	Very low	120 Å²	120	137.1 Å²	137.1	64%	0.642	71%	0.707	S	S	*	*			trans	71.8	79.7	143.8	-54.1	-25.6	0	0	0	123.3
1509	Q	24.9	Very low	26.7	Very low	162 Å²	162	138.8 Å²	138.8	76%	0.757	71%	0.711	S	S	*	*				41.8	116.9	111.8	-70	-163.3	42.9	0	0	121.3
1510	L	25.8	Very low	26.9	Very low	153 Å²	153	141.9 Å²	141.9	80%	0.801	72%	0.722	S	S	*	*				163.7	146.5	106.1	-95.3	150.4	0	0	0	116.2
1511	V	28.8	Very low	26.9	Very low	115 Å²	115	138.8 Å²	138.8	70%	0.697	72%	0.718	S	S	*	*			trans	69.2	97.6	153.4	-178.1	0	0	0	0	121.4
1512	N	25.5	Very low	26.9	Very low	135 Å²	135	140.7 Å²	140.7	72%	0.722	73%	0.733	S	S	*	*				55.3	126.5	123.4	-58.9	-1	0	0	0	125.6
1513	H	27.7	Very low	27.2	Very low	153 Å²	153	140.2 Å²	140.2	71%	0.708	73%	0.732	S	S	*	*			trans	70.5	101.2	132.6	-80.3	-99.4	0	0	0	122.5
1514	E	23.6	Very low	27.3	Very low	139 Å²	139	143.9 Å²	143.9	65%	0.65	74%	0.736	S	S	*	*				110.3	129.3	109.6	-102.7	-174.2	-107.5	0	0	123
1515	Q	24.5	Very low	27.3	Very low	162 Å²	162	143.8 Å²	143.8	76%	0.757	74%	0.735	S	S	*	*			trans	77.4	162.4	151.2	-64.4	-166.2	37.9	0	0	121.6
1516	I	29.7	Very low	27.6	Very low	153 Å²	153	143.5 Å²	143.5	79%	0.785	74%	0.738	S	S	*	*			trans	78.2	82	169.8	-43.7	-172.7	0	0	0	117.4
1517	N	25.6	Very low	27.8	Very low	139 Å²	139	145.5 Å²	145.5	74%	0.743	74%	0.741	S	S	*	*				56.3	131.1	118.1	-120.5	-16.5	0	0	0	121.9
1518	Q	28.7	Very low	28	Very low	154 Å²	154	147.5 Å²	147.5	72%	0.72	75%	0.746	S	S	*	*			trans	79.8	126.7	153.4	-58.5	-173.6	10.5	0	0	121.4
1519	N	29.7	Very low	27.9	Very low	131 Å²	131	147.1 Å²	147.1	70%	0.701	74%	0.744	S	S	*	*			trans	76.6	108.3	142.4	-65.2	-22.6	0	0	0	121.8
1520	Q	28.9	Very low	28	Very low	173 Å²	173	146.1 Å²	146.1	81%	0.808	74%	0.739	S	S	*	*			trans	85.4	132.2	144.3	-60	-174	11.2	0	0	120.4
1521	M	25.3	Very low	28.1	Very low	169 Å²	169	144 Å²	144	83%	0.833	73%	0.728	S	S	*	*			trans	60.4	98.7	164.1	-58.3	-165.1	-168.3	0	0	119.9
1522	T	27.1	Very low	27.9	Very low	138 Å²	138	147.3 Å²	147.3	85%	0.847	73%	0.73	S	S	*	*			trans	177.3	154.5	140	24.5	0	0	0	0	108.4
1523	N	29.9	Very low	28	Very low	146 Å²	146	148.8 Å²	148.8	78%	0.781	73%	0.726	S	S	*	*			cis	-150.1	-174.6	-38.8	-144.4	-31.5	0	0	0	109.7
1524	L	30.1	Very low	27.9	Very low	140 Å²	140	145.5 Å²	145.5	73%	0.733	71%	0.711	S	S	*	*			trans	-78.4	153.8	-161.7	-76	155.2	0	0	0	118.7
1525	N	31.2	Very low	28	Very low	125 Å²	125	143 Å²	143	67%	0.668	70%	0.699	S	S	*	*			trans	68.7	121.8	155.3	-58.5	-20.7	0	0	0	119.6
1526	L	33.9	Very low	28	Very low	143 Å²	143	139 Å²	139	75%	0.749	68%	0.681	S	S	*	*			cis	82	123.9	44.1	-72.4	133.8	0	0	0	114.2
1527	F	29.2	Very low	27.9	Very low	180 Å²	180	139.3 Å²	139.3	79%	0.789	68%	0.678	S	S	*	*			cis	-170.8	108.2	-16.6	-143.6	-88.1	0	0	0	111.1
1528	H	28	Very low	28.3	Very low	167 Å²	167	140.4 Å²	140.4	77%	0.773	68%	0.679	S	S	*	*			trans	-171.4	134.5	163.9	-116.6	61.3	0	0	0	114.5
1529	N	27.3	Very low	28.6	Very low	113 Å²	113	137.1 Å²	137.1	60%	0.604	67%	0.67	S	S	*	*			trans	51	150.9	145.5	-68.2	2.2	0	0	0	121.7
1530	H	28.6	Very low	28.6	Very low	141 Å²	141	137.9 Å²	137.9	65%	0.653	67%	0.67	S	S	*	*			cis	-148.6	153.6	12.5	-108	-44	0	0	0	112.6
1531	N	26.6	Very low	28.6	Very low	107 Å²	107	135.8 Å²	135.8	57%	0.572	66%	0.659	S	S	*	*			trans	33.6	151.5	136	-49.2	6.2	0	0	0	121.1
1532	Y	25.7	Very low	28.8	Very low	185 Å²	185	133.5 Å²	133.5	73%	0.725	65%	0.647	S	S	*	*			cis	-173.2	156.8	47.8	-127.6	-49.8	0	0	0	114.7
1533	Y	26.3	Very low	29	Very low	167 Å²	167	132.3 Å²	132.3	66%	0.655	63%	0.631	S	S	*	*			trans	66.3	135.2	164.8	-79.1	-94.2	0	0	0	118.1
1534	Q	25.7	Very low	28.9	Very low	84 Å²	84	133.1 Å²	133.1	39%	0.393	63%	0.63	S	S	.	*			cis	177.4	165.3	-7.8	177.2	-167.1	45.3	0	0	107.7	N1336 S1337 N1338	N1336-Q1534 CarbonylContact C-O 3.38Å; N1336-Q1534 WeakPolarHBondContact CA-O 3.39Å; N1336-Q1534 WeakPolarHBondContact CB-O 2.99Å; N1336-Q1534 VanDerWaalsContact CG-O 3.26Å; N1336-Q1534 PolarHBondContact ND2-OE1 2.92Å; N1336-Q1534 WeakPolarHBondContact OD1-CB 3.24Å; N1336-Q1534 PolarHBondContact OD1-O 2.95Å; S1337-Q1534 CarbonylContact C-O 3.53Å; S1337-Q1534 VanDerWaalsContact CA-O 3.29Å; S1337-Q1534 WeakPolarHBondContact CA-O 3.43Å; S1337-Q1534 PolarHBondContact N-O 3Å; S1337-Q1534 CarbonylContact O-C 3.47Å; S1337-Q1534 PolarHBondContact O-N 3.19Å; N1338-Q1534 PolarHBondContact N-O 3.07Å
1535	H	26.6	Very low	28.9	Very low	85 Å²	85	134.7 Å²	134.7	39%	0.394	63%	0.633	S	S	.	*			trans	59.7	148.9	151	-98.1	-55.4	0	0	0	127.4	N1336 S1337 N1338	N1336-H1535 CarbonylContact C-O 3.54Å; N1336-H1535 HydrophobicContact CB-CB 3.34Å; N1336-H1535 VanDerWaalsContact CB-O 3.29Å; N1336-H1535 WeakPolarHBondContact CB-O 3.36Å; N1336-H1535 WeakPolarHBondContact ND2-CB 3.41Å; S1337-H1535 CarbonylContact C-O 3.4Å; S1337-H1535 WeakPolarHBondContact CA-O 3.25Å; S1337-H1535 PolarHBondContact N-O 3.07Å; N1338-H1535 WeakPolarHBondContact CB-O 3.08Å
1536	H	24.9	Very low	28.8	Very low	79 Å²	79	136.6 Å²	136.6	37%	0.366	64%	0.638	S	S	.	*			trans	91.2	133.3	141.3	-88.4	-68.9	0	0	0	125.5	N1338	N1338-H1536 PolarHBondContact ND2-N 3.36Å; N1338-H1536 PolarHBondContact ND2-O 3.28Å; N1338-H1536 PolarHBondContact OD1-N 3.43Å
1537	H	26.4	Very low	28.6	Very low	159 Å²	159	136.8 Å²	136.8	74%	0.736	64%	0.635	S	S	*	*			trans	66.4	91.2	159.3	-70.7	-65.6	0	0	0	124.3
1538	H	33.7	Very low	28.7	Very low	163 Å²	163	133.6 Å²	133.6	76%	0.755	63%	0.626	S	S	*	*			trans	-40.9	160.8	135.7	-106.5	-27.6	0	0	0	114.1
1539	P	35.1	Very low	28.9	Very low	84 Å²	84	132.2 Å²	132.2	55%	0.545	62%	0.62	S	S	.	*				-159.8	169.1	60	44.3	-23.6	0	0	0	121.3
1540	H	29.6	Very low	29.2	Very low	148 Å²	148	133 Å²	133	69%	0.685	62%	0.62	S	S	*	*			trans	58.5	153.2	139.8	-70.7	-38.1	0	0	0	121.9
1541	H	30.6	Very low	29.4	Very low	128 Å²	128	133.3 Å²	133.3	59%	0.593	62%	0.622	S	S	*	*			cis	-167.5	162.1	-4.2	-123.2	-29.5	0	0	0	113.7
1542	Q	28.2	Very low	29.6	Very low	121 Å²	121	133.9 Å²	133.9	57%	0.565	62%	0.621	S	S	*	*			trans	69.8	163.9	143.3	-73.2	163.6	17.5	0	0	119.5
1543	H	30.9	Very low	29.9	Very low	113 Å²	113	131.8 Å²	131.8	52%	0.523	62%	0.618	S	S	.	*			cis	-141.7	179.9	4.6	-140.1	-77.3	0	0	0	113.8
1544	H	28.7	Very low	30	Very low	163 Å²	163	130.5 Å²	130.5	76%	0.755	62%	0.618	S	S	*	*			trans	-64.8	162.1	-174	-88	-84.6	0	0	0	119.9
1545	H	29.2	Very low	30.2	Very low	173 Å²	173	132.9 Å²	132.9	80%	0.801	63%	0.629	S	S	*	*			trans	-34.5	141.6	148.8	-86.5	-73	0	0	0	115.7
1546	H	30.2	Very low	30.3	Very low	166 Å²	166	135.4 Å²	135.4	77%	0.769	64%	0.641	S	S	*	*			trans	-178.1	160.2	135.8	-105	-45.7	0	0	0	108.9
1547	H	30.4	Very low	30.3	Very low	146 Å²	146	138.8 Å²	138.8	68%	0.676	66%	0.657	S	S	*	*			cis	-153.4	-142.5	-13.6	-158.8	-19.4	0	0	0	107.6
1548	D	30.7	Very low	30.4	Very low	114 Å²	114	138.2 Å²	138.2	61%	0.61	65%	0.654	S	S	*	*			trans	70.9	144.4	147	-63.4	-29.5	0	0	0	118.9
1549	Q	30.9	Very low	30.1	Very low	137 Å²	137	138 Å²	138	64%	0.64	65%	0.653	S	S	*	*			cis	-156.2	-166.2	-11.5	-122.9	164.8	48.1	0	0	106.3
1550	Q	33.9	Very low	29.6	Very low	131 Å²	131	140.4 Å²	140.4	61%	0.612	66%	0.661	S	S	*	*			cis	-166.9	155	22.7	-144.8	159.4	68.4	0	0	105.9
1551	Q	32.7	Very low	29.5	Very low	147 Å²	147	144.1 Å²	144.1	69%	0.687	67%	0.671	S	S	*	*				170	150.4	85.2	-76.6	-154.7	-12.8	0	0	106.7
1552	Q	32.2	Very low	29.2	Very low	119 Å²	119	143.7 Å²	143.7	56%	0.556	67%	0.669	S	S	*	*			cis	-162.3	144.2	-3.2	-114.3	177.8	13.8	0	0	109.7
1553	Q	30.8	Very low	29.5	Very low	140 Å²	140	143.9 Å²	143.9	65%	0.654	68%	0.68	S	S	*	*			trans	54.4	156.9	130.9	-64.8	174.9	22.8	0	0	120.7
1554	Q	29.3	Very low	29.2	Very low	140 Å²	140	147.8 Å²	147.8	65%	0.654	69%	0.691	S	S	*	*			cis	-160.6	176.4	4.4	-127.3	-177.8	88.5	0	0	107.6
1555	Q	28.5	Very low	29.1	Very low	134 Å²	134	144.9 Å²	144.9	63%	0.626	68%	0.684	S	S	*	*			cis	-149.9	-81	-2.5	-165.3	-161.8	97	0	0	112.3
1556	H	28.8	Very low	29	Very low	139 Å²	139	145.9 Å²	145.9	64%	0.644	68%	0.682	S	S	*	*			trans	-157.2	172.6	-158.3	-72.8	-18.1	0	0	0	109.7
1557	Q	25.3	Very low	28.9	Very low	150 Å²	150	145.3 Å²	145.3	70%	0.701	68%	0.68	S	S	*	*			cis	-162.8	172.3	6.3	-131.5	160.3	45.3	0	0	112.7
1558	H	28.5	Very low	28.8	Very low	146 Å²	146	145.2 Å²	145.2	68%	0.676	69%	0.685	S	S	*	*			trans	63.2	109.9	155.2	-81.1	-68.8	0	0	0	124.6
1559	H	27.1	Very low	28.7	Very low	159 Å²	159	142.7 Å²	142.7	74%	0.736	69%	0.686	S	S	*	*				49.7	143.6	129.8	-77.6	-1.6	0	0	0	126
1560	N	24.7	Very low	28.7	Very low	135 Å²	135	141.2 Å²	141.2	72%	0.722	69%	0.69	S	S	*	*			trans	64.7	112.4	159.7	-58.2	-16.3	0	0	0	117.1
1561	Y	27.1	Very low	28.5	Very low	226 Å²	226	141.6 Å²	141.6	89%	0.886	70%	0.696	S	S	*	*				-162.4	-177.4	74.6	-115.9	-91.6	0	0	0	114.6
1562	H	24.6	Very low	28.4	Very low	118 Å²	118	141.9 Å²	141.9	55%	0.546	70%	0.697	S	S	.	*			trans	-59.5	162.1	-178.9	-110.1	-51.4	0	0	0	116.1	R1564	H1562-R1564 VanDerWaalsContact CE1-CZ 3.42Å; H1562-R1564 PolarHBondContact CE1-NE 2.67Å; H1562-R1564 VanDerWaalsContact CE1-NE 3.29Å; H1562-R1564 VanDerWaalsContact NE2-CZ 3.27Å; H1562-R1564 PolarHBondContact NE2-NH1 3.18Å
1563	P	34.2	Very low	28.3	Very low	125 Å²	125	142.4 Å²	142.4	81%	0.812	70%	0.704	S	S	*	*				-135.1	168.5	101.1	38.2	-29	0	0	0	115.9
1564	R	25.4	Very low	28.2	Very low	196 Å²	196	140.4 Å²	140.4	74%	0.74	71%	0.706	S	S	*	*			trans	-152.2	151	176.7	-77.2	-178.6	174.4	145.2	0.6	107.1	H1562	H1562-R1564 VanDerWaalsContact CE1-CZ 3.42Å; H1562-R1564 PolarHBondContact CE1-NE 2.67Å; H1562-R1564 VanDerWaalsContact CE1-NE 3.29Å; H1562-R1564 VanDerWaalsContact NE2-CZ 3.27Å; H1562-R1564 PolarHBondContact NE2-NH1 3.18Å
1565	T	25.6	Very low	28.1	Very low	102 Å²	102	140.6 Å²	140.6	63%	0.626	71%	0.711	S	S	*	*			cis	-155.8	-157	-12.9	17.8	0	0	0	0	105.5
1566	Y	28.4	Very low	28.1	Very low	193 Å²	193	141.8 Å²	141.8	76%	0.757	72%	0.722	S	S	*	*			trans	73	103.9	167.4	-63	-81.5	0	0	0	114.3
1567	E	27.5	Very low	28.1	Very low	154 Å²	154	138.5 Å²	138.5	72%	0.72	73%	0.726	S	S	*	*				102.4	150.1	81.1	-96	-168.1	-148.5	0	0	110.3
1568	N	28.2	Very low	28.1	Very low	145 Å²	145	140.7 Å²	140.7	78%	0.775	74%	0.735	S	S	*	*			cis	-157.5	173.2	-2	-138.4	-35.3	0	0	0	110
1569	G	29.2	Very low	28.2	Very low	61 Å²	61	140.7 Å²	140.7	63%	0.629	74%	0.741	S	S	*	*			trans	110	63.9	149.3	0	0	0	0	0	123.6
1570	S	30.6	Very low	28.6	Very low	106 Å²	106	139.6 Å²	139.6	74%	0.741	74%	0.738	S	S	*	*			trans	32.1	134.7	130.3	65.4	0	0	0	0	125.9
1571	N	29.2	Very low	29.3	Very low	138 Å²	138	137.8 Å²	137.8	74%	0.738	73%	0.734	S	S	*	*				101.1	119.6	127	-74.6	1.3	0	0	0	126.3
1572	H	31.4	Very low	29.4	Very low	153 Å²	153	134.8 Å²	134.8	71%	0.708	73%	0.728	S	S	*	*			trans	78.9	121.4	132.2	-77.8	-55.5	0	0	0	126.5
1573	N	29.8	Very low	29.6	Very low	131 Å²	131	135 Å²	135	70%	0.701	73%	0.732	S	S	*	*				73.9	97	129.2	-67	10.9	0	0	0	123.9
1574	S	28.8	Very low	29.3	Very low	97 Å²	97	134.2 Å²	134.2	68%	0.678	73%	0.728	S	S	*	*				65	118.3	120.8	69	0	0	0	0	123.3
1575	N	27.9	Very low	29.4	Very low	144 Å²	144	130.9 Å²	130.9	77%	0.77	73%	0.73	S	S	*	*			trans	76.8	124.9	140	-67.7	-5	0	0	0	122.3
1576	N	28.2	Very low	29.6	Very low	160 Å²	160	131.2 Å²	131.2	86%	0.856	74%	0.736	S	S	*	*			trans	64.8	112.5	149.7	-60.2	-12.4	0	0	0	119.1
1577	G	27.4	Very low	29.7	Very low	70 Å²	70	129.9 Å²	129.9	72%	0.722	73%	0.734	S	S	*	*			trans	172.8	41	166.8	0	0	0	0	0	121.5
1578	H	27.2	Very low	29.8	Very low	195 Å²	195	129.9 Å²	129.9	90%	0.903	73%	0.734	S	S	*	*			trans	63.6	147.5	171.2	-70.8	64.3	0	0	0	118
1579	N	29.6	Very low	29.8	Very low	147 Å²	147	127 Å²	127	79%	0.786	73%	0.73	S	S	*	*			trans	-138.9	146.5	169.9	-97.4	-13.2	0	0	0	105.7
1580	I	34.7	Very low	29.7	Very low	135 Å²	135	133 Å²	133	69%	0.692	74%	0.742	S	S	*	*			cis	-162.4	166.3	3.6	-131.6	160.9	0	0	0	108.1
1581	P	39.3	Very low	29.4	Very low	98 Å²	98	132.6 Å²	132.6	64%	0.636	74%	0.738	S	S	*	*			cis	-105.2	-132.6	-16.4	29.7	-8.4	0	0	0	108.5
1582	H	29.8	Very low	29.4	Very low	162 Å²	162	133.2 Å²	133.2	75%	0.75	74%	0.739	S	S	*	*			cis	-162.4	174.5	-5.9	-126.3	-4.1	0	0	0	106.1
1583	I	28.2	Very low	29.1	Very low	123 Å²	123	133.6 Å²	133.6	63%	0.631	74%	0.741	S	S	*	*			cis	-144.4	143.6	-2.1	-136.5	155	0	0	0	105.1
1584	C	28.2	Very low	28.9	Very low	109 Å²	109	134.3 Å²	134.3	74%	0.736	75%	0.745	S	S	*	*			trans	40.9	144.8	160.6	-56.7	0	0	0	0	122.9
1585	T	29.2	Very low	28.7	Very low	126 Å²	126	139.8 Å²	139.8	77%	0.773	75%	0.752	S	S	*	*			cis	-171.6	152.6	-11	22.1	0	0	0	0	111
1586	S	28.9	Very low	28.6	Very low	108 Å²	108	140.2 Å²	140.2	76%	0.755	75%	0.749	S	S	*	*			trans	17.3	141.2	144	-138.8	0	0	0	0	120.8
1587	K	30.1	Very low	28.6	Very low	166 Å²	166	141.1 Å²	141.1	72%	0.722	75%	0.748	S	S	*	*			cis	-149.9	-141.2	7.1	-141.1	178.1	161.3	-160.1	0	108.6
1588	H	30.1	Very low	28.5	Very low	154 Å²	154	142 Å²	142	71%	0.713	74%	0.743	S	S	*	*			cis	-156.5	-176.9	1.6	-139.3	156.6	0	0	0	110.4
1589	A	28.1	Very low	28.7	Very low	84 Å²	84	140.1 Å²	140.1	69%	0.694	74%	0.738	S	S	*	*			trans	-160	159	-177.6	0	0	0	0	0	114.5
1590	H	27.7	Very low	28.5	Very low	188 Å²	188	139.5 Å²	139.5	87%	0.87	74%	0.735	S	S	*	*			trans	-163.1	175.4	144.7	-133.8	-93.2	0	0	0	114.1
1591	C	23.8	Very low	28.1	Very low	97 Å²	97	139.5 Å²	139.5	66%	0.655	74%	0.736	S	S	*	*			trans	-137.5	162	-175.7	-66.7	0	0	0	0	112.9
1592	I	29.9	Very low	27.5	Very low	150 Å²	150	140.2 Å²	140.2	77%	0.769	73%	0.734	S	S	*	*			trans	67.3	136.5	149.4	-72.1	162.5	0	0	0	116.5
1593	E	24.5	Very low	27.4	Very low	161 Å²	161	139 Å²	139	75%	0.752	73%	0.729	S	S	*	*			cis	-163.9	-174.8	-10	-120.1	-176.9	167.3	0	0	111
1594	L	25.9	Very low	27.4	Very low	147 Å²	147	139.7 Å²	139.7	77%	0.77	73%	0.729	S	S	*	*			trans	95.3	114.2	158	-56.3	-173.6	0	0	0	121
1595	Y	24.8	Very low	27.5	Very low	211 Å²	211	140.2 Å²	140.2	83%	0.827	72%	0.721	S	S	*	*			trans	83.1	158.5	143.6	-99.1	-99	0	0	0	122.1
1596	Q	25.8	Very low	27.4	Very low	154 Å²	154	143.7 Å²	143.7	72%	0.72	72%	0.72	S	S	*	*			trans	-118.3	179.2	-150.7	-57.4	176	-62.9	0	0	112.7
1597	Q	27.7	Very low	27.4	Very low	178 Å²	178	145.1 Å²	145.1	83%	0.832	72%	0.715	S	S	*	*			trans	80.1	140.5	170.1	-54.4	-178.9	7.8	0	0	114.8
1598	S	25.4	Very low	27.3	Very low	89 Å²	89	143.1 Å²	143.1	62%	0.622	71%	0.708	S	S	*	*			cis	176.1	160.3	-31.5	44.8	0	0	0	0	106.5
1599	I	30.5	Very low	27.3	Very low	155 Å²	155	141.9 Å²	141.9	80%	0.795	70%	0.702	S	S	*	*			trans	68.4	93.9	177.9	-45.7	166.4	0	0	0	110.5
1600	N	25.9	Very low	27.3	Very low	134 Å²	134	145.6 Å²	145.6	72%	0.717	70%	0.703	S	S	*	*			cis	72.3	131.4	24.5	-157.7	17.7	0	0	0	115.1
1601	L	26.7	Very low	27.4	Very low	136 Å²	136	143.2 Å²	143.2	71%	0.712	69%	0.692	S	S	*	*			trans	69.3	150.3	-177.5	-58.3	116.9	0	0	0	114.5
1602	D	26.3	Very low	27.6	Very low	112 Å²	112	146.4 Å²	146.4	60%	0.599	70%	0.695	S	S	*	*			cis	-156.5	170.2	11.2	-143.5	-12.1	0	0	0	115.4
1603	Q	26.9	Very low	27.5	Very low	136 Å²	136	144.1 Å²	144.1	64%	0.636	69%	0.692	S	S	*	*			trans	68.4	154.2	148.4	-77.3	166.5	60.8	0	0	118.4
1604	Q	29.7	Very low	27.8	Very low	139 Å²	139	143.2 Å²	143.2	65%	0.65	69%	0.691	S	S	*	*			cis	-145	169.7	0.5	-119.1	170.5	52.5	0	0	106.7
1605	Q	30	Very low	28	Very low	120 Å²	120	144.4 Å²	144.4	56%	0.561	69%	0.692	S	S	*	*	S	Bend	cis	-158.6	148.7	18.1	-132.7	178.4	69	0	0	103.9
1606	R	26.9	Very low	28.6	Very low	198 Å²	198	139.2 Å²	139.2	75%	0.747	68%	0.684	S	S	*	*	S	Bend	cis	-153.3	170.7	22.1	-74.7	178.1	-174.3	-175.1	-0.2	108.8
1607	Q	28.3	Very low	29.1	Very low	139 Å²	139	137.4 Å²	137.4	65%	0.65	69%	0.686	S	S	*	*			cis	-172.7	154.3	-24	-98.3	-175.2	-70.8	0	0	106.5
1608	E	27.9	Very low	29.2	Very low	123 Å²	123	133.5 Å²	133.5	58%	0.575	68%	0.676	S	S	*	*			cis	-170.9	153.7	-24.3	-127.3	-168.7	-58.4	0	0	110.2
1609	Q	29.8	Very low	29.3	Very low	128 Å²	128	137.6 Å²	137.6	60%	0.598	69%	0.685	S	S	*	*			trans	65.7	151.1	155.6	-62.6	-175	31.8	0	0	118.2
1610	K	28.1	Very low	29.7	Very low	163 Å²	163	135.4 Å²	135.4	71%	0.709	68%	0.681	S	S	*	*			cis	-166	165.9	1.6	-117.6	170.8	-174.9	153.8	0	107.9
1611	H	29.5	Very low	30.3	Very low	137 Å²	137	134.7 Å²	134.7	63%	0.634	68%	0.684	S	S	*	*			cis	-151.8	-63	-5.8	-160.9	22.2	0	0	0	116
1612	K	29.1	Very low	30.1	Very low	164 Å²	164	136.1 Å²	136.1	71%	0.713	69%	0.686	S	S	*	*			trans	-156.2	172.8	-160.5	-67.6	175.2	176.1	152.5	0	110.2
1613	S	27.9	Very low	30	Very low	102 Å²	102	137.5 Å²	137.5	71%	0.713	69%	0.693	S	S	*	*			cis	-170.3	176.1	26.3	-149.5	0	0	0	0	114.9
1614	I	30.7	Very low	29.8	Very low	142 Å²	142	140 Å²	140	73%	0.728	70%	0.698	S	S	*	*			trans	82.6	112	154.9	-66.1	168.3	0	0	0	121.2
1615	H	30.8	Very low	29.5	Very low	172 Å²	172	139.9 Å²	139.9	80%	0.796	70%	0.697	S	S	*	*			trans	37.5	159.1	138	-67	-100.6	0	0	0	124
1616	P	36.1	Very low	29.9	Very low	103 Å²	103	137.3 Å²	137.3	67%	0.669	69%	0.691	S	S	*	*			cis	-135.1	168.8	-31.1	37.2	-19.9	0	0	0	115.1
1617	P	37.7	Very low	30.1	Very low	115 Å²	115	134.5 Å²	134.5	75%	0.747	69%	0.686	S	S	*	*			trans	-81.8	-172.1	169.4	39.9	-39.7	0	0	0	111.6
1618	P	29.2	Very low	30.1	Very low	97 Å²	97	132.2 Å²	132.2	63%	0.63	68%	0.677	S	S	*	*			cis	-156.1	-174.5	22.5	48.4	-26.9	0	0	0	121.7
1619	H	28.1	Very low	30	Very low	174 Å²	174	129.3 Å²	129.3	81%	0.806	67%	0.67	S	S	*	*			trans	82.1	128.4	145.8	-70.8	-50	0	0	0	124.8
1620	P	37.6	Very low	29.7	Very low	110 Å²	110	129.6 Å²	129.6	71%	0.714	68%	0.675	S	S	*	*			trans	-96.7	-151.8	158.5	43.4	-35.4	0	0	0	109.9
1621	P	38	Very low	29.8	Very low	119 Å²	119	130.8 Å²	130.8	77%	0.773	68%	0.681	S	S	*	*			cis	-140.2	-131.3	0.1	42.9	-19.3	0	0	0	115.5
1622	H	24.3	Very low	29.8	Very low	166 Å²	166	130.9 Å²	130.9	77%	0.769	68%	0.684	S	S	*	*			trans	-87.9	158.1	-167.1	-80.8	-121.2	0	0	0	116.2
1623	L	22.5	Very low	29.6	Very low	140 Å²	140	128.3 Å²	128.3	73%	0.733	68%	0.683	S	S	*	*			trans	48.8	120.2	147.5	-84.5	91	0	0	0	123.2
1624	Y	23.9	Very low	29.7	Very low	189 Å²	189	130 Å²	130	74%	0.741	69%	0.689	S	S	*	*			trans	79.4	119.8	131.9	-99.7	-107.7	0	0	0	124.2
1625	Q	23.6	Very low	29.4	Very low	137 Å²	137	129.5 Å²	129.5	64%	0.64	69%	0.688	S	S	*	*			trans	65	165.2	147	-83.9	-177.9	-6.1	0	0	120
1626	P	37.1	Very low	29.2	Very low	65 Å²	65	129.4 Å²	129.4	42%	0.422	69%	0.69	S	S	.	*			cis	-134.8	180	-33.9	33.9	-16.2	0	0	0	113.7	K1386	K1386-P1626 WeakPolarHBondContact O-CB 3.4Å; K1386-P1626 WeakPolarHBondContact O-CG 3.44Å
1627	H	31.6	Very low	28.6	Very low	140 Å²	140	130.5 Å²	130.5	65%	0.648	69%	0.694	S	S	*	*			trans	158	120.9	131.4	-94.1	-91.5	0	0	0	115.6
1628	I	29.3	Very low	28.2	Very low	90 Å²	90	131.5 Å²	131.5	46%	0.462	70%	0.699	S	S	.	*			trans	51.4	131.2	130	-50.4	-174.4	0	0	0	121.7	Y1387 T1388	Y1387-I1628 HydrophobicContact CD2-CD1 4.23Å; Y1387-I1628 HydrophobicContact CD2-CG1 3.9Å; T1388-I1628 PolarHBondContact OG1-N 2.81Å
1629	C	24.4	Very low	27.9	Very low	62 Å²	62	130.9 Å²	130.9	42%	0.419	70%	0.702	S	S	.	*			trans	-12.3	167.6	137.4	-78	0	0	0	0	121.1
1630	D	24.2	Very low	27.7	Very low	134 Å²	134	128.6 Å²	128.6	72%	0.717	70%	0.7	S	S	*	*			cis	-155.5	156.7	3.3	-105.4	-26.4	0	0	0	112
1631	K	31	Very low	27.1	Very low	188 Å²	188	128.6 Å²	128.6	82%	0.817	70%	0.698	S	S	*	*			trans	-174.4	112.3	141.3	-104.3	162	-177.7	178.9	0	108.9
1632	I	28.1	Very low	26.3	Very low	140 Å²	140	128.5 Å²	128.5	72%	0.718	70%	0.696	S	S	*	*				61.4	103.4	95.5	-63.1	173.2	0	0	0	110.7
1633	T	24.5	Very low	26.4	Very low	110 Å²	110	126.2 Å²	126.2	68%	0.675	69%	0.694	S	S	*	*			cis	88.2	97.4	40.5	-54.1	0	0	0	0	113.8
1634	T	30.2	Very low	26.4	Very low	138 Å²	138	126.2 Å²	126.2	85%	0.847	69%	0.694	S	S	*	*			trans	-158.8	146.9	149.6	45.2	0	0	0	0	107.4
1635	N	25.6	Very low	26.2	Very low	131 Å²	131	122.7 Å²	122.7	70%	0.701	69%	0.693	S	S	*	*			cis	169.5	150.4	-34.6	-112.7	4.7	0	0	0	104.7
1636	M	27	Very low	26.2	Very low	170 Å²	170	122 Å²	122	84%	0.837	70%	0.698	S	S	*	*			trans	69	135.5	176.5	-54.8	-175	177.2	0	0	116.3
1637	T	23.4	Very low	25.7	Very low	125 Å²	125	125.1 Å²	125.1	77%	0.767	72%	0.716	S	S	*	*			cis	84	79.3	22.1	78.5	0	0	0	0	117.7
1638	T	28.6	Very low	25.4	Very low	137 Å²	137	125.8 Å²	125.8	84%	0.84	72%	0.721	S	S	*	*			trans	-165.7	127.4	135.2	33.1	0	0	0	0	106.2
1639	A	23.8	Very low	25.5	Very low	84 Å²	84	126.2 Å²	126.2	69%	0.694	72%	0.724	S	S	*	*			cis	81.4	150.2	45.8	0	0	0	0	0	114.3
1640	T	23.8	Very low	25.9	Very low	125 Å²	125	130 Å²	130	77%	0.767	74%	0.736	S	S	*	*			trans	87.5	144.4	169.8	72	0	0	0	0	120.4
1641	T	23.9	Very low	26.3	Very low	110 Å²	110	132.2 Å²	132.2	68%	0.675	74%	0.739	S	S	*	*			trans	56.8	116.6	151.3	48.5	0	0	0	0	119.2
1642	T	21.7	Very low	26.2	Very low	117 Å²	117	127.1 Å²	127.1	72%	0.718	73%	0.728	S	S	*	*				64.8	165.1	69.4	69.5	0	0	0	0	114.9
1643	T	26.3	Very low	26.2	Very low	119 Å²	119	125.6 Å²	125.6	73%	0.73	73%	0.73	S	S	*	*			trans	69.9	112.8	-174.5	66.4	0	0	0	0	112.5
1644	N	21.6	Very low	26.4	Very low	139 Å²	139	125 Å²	125	74%	0.743	73%	0.73	S	S	*	*				89.7	126.9	62.3	-75.6	-9.4	0	0	0	111.9
1645	T	21.2	Very low	26.3	Very low	116 Å²	116	124 Å²	124	71%	0.712	72%	0.723	S	S	*	*			trans	54.6	135	140.3	60.1	0	0	0	0	120.8
1646	T	22	Very low	26.4	Very low	123 Å²	123	122 Å²	122	76%	0.755	71%	0.713	S	S	*	*			trans	51	108.1	141.3	57.8	0	0	0	0	118.7
1647	T	26.5	Very low	26.3	Very low	130 Å²	130	120.6 Å²	120.6	80%	0.798	70%	0.699	S	S	*	*				-159.2	126.5	116.4	23.5	0	0	0	0	110
1648	M	26.2	Very low	26.4	Very low	154 Å²	154	118 Å²	118	76%	0.759	69%	0.686	S	S	*	*			trans	61.9	142.2	147.7	-46.6	-58.7	-100.4	0	0	118.4
1649	N	32.3	Very low	26.3	Very low	98 Å²	98	114.1 Å²	114.1	52%	0.524	66%	0.66	S	S	.	*			cis	-158.2	154.9	-15.6	-124.9	13.6	0	0	0	110.6
1650	E	32	Very low	26.5	Very low	141 Å²	141	115.6 Å²	115.6	66%	0.659	66%	0.656	S	S	*	*			trans	63.7	151.2	148.3	-59.3	172.5	-159	0	0	118.3
1651	F	31.6	Very low	26.5	Very low	181 Å²	181	116 Å²	116	79%	0.794	65%	0.653	S	S	*	*			cis	-164	142.5	-24.3	-103.9	-35.3	0	0	0	104.5
1652	S	29.5	Very low	26.6	Very low	82 Å²	82	118.7 Å²	118.7	57%	0.573	66%	0.659	S	S	*	*			cis	-156.3	163.9	3.4	-70.8	0	0	0	0	110.3
1653	S	29	Very low	26.8	Very low	108 Å²	108	120.1 Å²	120.1	76%	0.755	66%	0.657	S	S	*	*			trans	51.9	137	138.8	61.2	0	0	0	0	121.9
1654	S	27.9	Very low	26.7	Very low	98 Å²	98	121.2 Å²	121.2	69%	0.685	65%	0.652	S	S	*	*			cis	178.4	153.6	-2.3	48.3	0	0	0	0	112.1
1655	V	28.8	Very low	26.8	Very low	115 Å²	115	119.7 Å²	119.7	70%	0.697	65%	0.648	S	S	*	*			trans	67.8	139.2	141	160	0	0	0	0	117.7
1656	N	27.9	Very low	27	Very low	90 Å²	90	123.2 Å²	123.2	48%	0.481	65%	0.653	S	S	.	*			cis	-163.9	173.4	-12.7	-96	-2.2	0	0	0	105.7	S26	S26-N1656 VanDerWaalsContact OG-CA 3.25Å; S26-N1656 WeakPolarHBondContact OG-CA 3.35Å
1657	Y	24.4	Very low	27.1	Very low	140 Å²	140	124.9 Å²	124.9	55%	0.549	65%	0.654	S	S	.	*			cis	-159.4	-179.7	-10.5	-112.4	-166.6	0	0	0	107.7	P23 P24	P23-Y1657 HydrophobicContact CB-CD1 3.57Å; P23-Y1657 HydrophobicContact CB-CE1 3.67Å; P23-Y1657 HydrophobicContact CB-CG 4.31Å; P23-Y1657 HydrophobicContact CG-CD1 4.16Å; P23-Y1657 HydrophobicContact CG-CE1 3.71Å; P24-Y1657 HydrophobicContact CB-CD1 4.09Å; P24-Y1657 HydrophobicContact CB-CD2 3.35Å; P24-Y1657 HydrophobicContact CB-CE1 4.04Å; P24-Y1657 HydrophobicContact CB-CE2 3.29Å; P24-Y1657 HydrophobicContact CB-CG 3.77Å; P24-Y1657 HydrophobicContact CG-CE2 4.33Å
1658	S	24.6	Very low	27.1	Very low	71 Å²	71	126.9 Å²	126.9	50%	0.497	65%	0.652	S	S	.	*			trans	-170.2	-156.7	-176.6	-160.6	0	0	0	0	112.6	P23 P24 S25	P23-S1658 CarbonylContact C-O 3.11Å; P23-S1658 VanDerWaalsContact CA-O 3.28Å; P23-S1658 WeakPolarHBondContact CA-O 3.38Å; P24-S1658 VanDerWaalsContact CA-O 3.24Å; P24-S1658 WeakPolarHBondContact CA-O 3.03Å; S25-S1658 WeakPolarHBondContact OG-CB 3.19Å
1659	N	27.4	Very low	27.2	Very low	56 Å²	56	126.1 Å²	126.1	30%	0.299	65%	0.65	S	S	.	*			trans	112.2	129.7	164	-90.4	0.1	0	0	0	120.2	P23 P24	P23-N1659 WeakPolarHBondContact O-CB 3.49Å; P23-N1659 PolarHBondContact O-ND2 2.77Å; P24-N1659 WeakPolarHBondContact CD-ND2 3.2Å; P24-N1659 PolarHBondContact O-ND2 3.43Å; P24-N1659 PolarHBondContact O-OD1 3Å
1660	N	27	Very low	27	Very low	114 Å²	114	124.6 Å²	124.6	61%	0.61	65%	0.647	S	S	*	*			trans	73	135.1	133.5	-64.3	-0.7	0	0	0	123.7
1661	N	25.3	Very low	26.9	Very low	133 Å²	133	121.4 Å²	121.4	71%	0.711	63%	0.634	S	S	*	*			trans	74.1	125.4	144.3	-64.1	18.3	0	0	0	122.3
1662	E	25.1	Very low	26.7	Very low	168 Å²	168	120.1 Å²	120.1	79%	0.785	63%	0.628	S	S	*	*			trans	45.5	111.9	130.5	-60.1	-172.7	121.1	0	0	121.7
1663	E	26.2	Very low	26.6	Very low	147 Å²	147	123.3 Å²	123.3	69%	0.687	63%	0.632	S	S	*	*				55.5	151.6	122.6	-96.7	-144.2	114	0	0	125
1664	K	23.2	Very low	26.6	Very low	141 Å²	141	125.3 Å²	125.3	61%	0.613	63%	0.634	S	S	*	*			trans	67.1	114.5	154.3	-75.6	175.4	174.9	68.8	0	120.3
1665	T	24.5	Very low	26.5	Very low	108 Å²	108	127 Å²	127	66%	0.663	64%	0.64	S	S	*	*			trans	71.8	162	143.9	69.2	0	0	0	0	116.1
1666	K	25	Very low	26.9	Very low	189 Å²	189	129 Å²	129	82%	0.822	65%	0.646	S	S	*	*			cis	-111.2	-128.9	11.6	-72.1	76.3	-172	154	0	112.2
1667	M	24.3	Very low	27	Very low	158 Å²	158	130.8 Å²	130.8	78%	0.778	66%	0.662	S	S	*	*			trans	-161	163	-158.1	-146.1	-167	-70.9	0	0	116.2
1668	K	26.7	Very low	27.1	Very low	173 Å²	173	131.3 Å²	131.3	75%	0.752	67%	0.674	S	S	*	*			trans	75.7	157.1	162.2	-68.8	160.7	-177.6	165.9	0	116.8
1669	L	28	Very low	27.3	Very low	138 Å²	138	135 Å²	135	72%	0.723	68%	0.681	S	S	*	*			cis	-139.7	171.8	2	-127.2	155.4	0	0	0	111.3
1670	S	28.5	Very low	27.5	Very low	66 Å²	66	143.7 Å²	143.7	46%	0.462	71%	0.71	S	S	.	*			trans	-140.9	-178.9	-138.2	57.1	0	0	0	0	118.8	K45	K45-S1670 CarbonylContact C-O 3.57Å; K45-S1670 WeakPolarHBondContact CA-O 3.27Å; K45-S1670 PolarHBondContact N-O 2.77Å
1671	L	29.3	Very low	27.3	Very low	73 Å²	73	142.7 Å²	142.7	38%	0.382	71%	0.712	S	S	.	*			trans	83.5	178.1	-164.7	-98.4	74.6	0	0	0	114.1	Q43 N44 K46 M47	Q43-L1671 CarbonylContact C-O 3.56Å; N44-L1671 VanDerWaalsContact C-C 3.45Å; N44-L1671 CarbonylContact C-O 3.16Å; N44-L1671 VanDerWaalsContact C-O 3.23Å; N44-L1671 WeakPolarHBondContact CA-O 3.16Å; N44-L1671 PolarHBondContact N-O 2.96Å; K46-L1671 VanDerWaalsContact N-CB 3.27Å; M47-L1671 WeakPolarHBondContact O-CD1 3.47Å; M47-L1671 WeakPolarHBondContact O-CD2 3.05Å
1672	K	28.2	Very low	27.4	Very low	155 Å²	155	143.9 Å²	143.9	67%	0.674	71%	0.711	S	S	*	*				-112.2	-131.3	60.5	-152.5	-155.9	175.3	-174.3	0	118.1	N44 K45	N44-K1672 WeakPolarHBondContact O-CB 3.45Å; N44-K1672 WeakPolarHBondContact O-CG 3.42Å; K45-K1672 WeakPolarHBondContact O-CA 3.32Å
1673	F	27.6	Very low	27.6	Very low	148 Å²	148	145.6 Å²	145.6	65%	0.649	71%	0.71	S	S	*	*			trans	-133.5	171	-155.4	-98.8	-49.6	0	0	0	116
1674	L	28.1	Very low	27.8	Very low	151 Å²	151	144.7 Å²	144.7	79%	0.791	71%	0.71	S	S	*	*			trans	-48.3	161.3	171.1	-61.2	137.5	0	0	0	113.6
1675	T	26.4	Very low	27.8	Very low	133 Å²	133	145.9 Å²	145.9	82%	0.816	71%	0.71	S	S	*	*			cis	-153.3	175.1	46.2	49.2	0	0	0	0	115.4
1676	L	36.5	Very low	27.9	Very low	157 Å²	157	144.4 Å²	144.4	82%	0.822	70%	0.695	S	S	*	*			trans	-72.8	166	165.2	-66.4	165.3	0	0	0	112.2
1677	P	29.9	Very low	27.9	Very low	127 Å²	127	141.6 Å²	141.6	83%	0.825	68%	0.682	S	S	*	*				-141.9	-178.7	96.3	39.7	-26.1	0	0	0	115.4
1678	L	27.2	Very low	28.3	Very low	151 Å²	151	138 Å²	138	79%	0.791	69%	0.685	S	S	*	*			trans	-102	169.1	177	-81.4	169.4	0	0	0	112.8
1679	F	28	Very low	28.5	Very low	148 Å²	148	139.4 Å²	139.4	65%	0.649	69%	0.691	S	S	*	*			trans	64.5	109.1	163.1	-76.2	-72	0	0	0	119.6
1680	R	31.8	Very low	28.5	Very low	239 Å²	239	142.6 Å²	142.6	90%	0.902	70%	0.699	S	S	*	*				-143.4	102.9	118.6	-139.6	174.1	-167.8	172.5	4.5	111.3	F1682	R1680-F1682 PolarHBondContact O-N 3.19Å
1681	S	23.8	Very low	28.5	Very low	93 Å²	93	148.2 Å²	148.2	65%	0.65	72%	0.718	S	S	*	*			trans	-77.5	108.7	172.1	-59.8	0	0	0	0	109.6
1682	F	28.1	Very low	28.4	Very low	159 Å²	159	153.1 Å²	153.1	70%	0.697	75%	0.745	S	S	*	*			trans	-145.9	117.1	167.4	-119.2	-88.6	0	0	0	114.9	R1680	R1680-F1682 PolarHBondContact O-N 3.19Å
1683	R	28.6	Very low	28.5	Very low	204 Å²	204	155 Å²	155	77%	0.77	75%	0.753	S	S	*	*			trans	62.3	127	149.7	-83.6	-175.8	178.6	156.8	0.3	122.3
1684	L	29.4	Very low	28.6	Very low	128 Å²	128	153.4 Å²	153.4	67%	0.67	76%	0.755	S	S	*	*			trans	86.2	101.1	130.4	-67.1	169.5	0	0	0	121.6
1685	R	24.3	Very low	28.5	Very low	165 Å²	165	153 Å²	153	62%	0.623	75%	0.753	S	S	*	*				54	111.7	112.6	-76.7	-173.1	175	169.5	-1.3	119.9	Y741	Y741-R1685 HydrophobicContact CE1-CG 4.27Å
1686	K	26.6	Very low	28.6	Very low	78 Å²	78	151.4 Å²	151.4	34%	0.339	75%	0.746	S	S	.	*				92.3	135.4	121.7	-70.4	173.2	178	-178	0	121	G743 N744	G743-K1686 VanDerWaalsContact C-CE 3.46Å; G743-K1686 WeakPolarHBondContact O-CE 3.19Å; G743-K1686 PolarHBondContact O-NZ 3.39Å; N744-K1686 PolarHBondContact O-NZ 3.43Å
1687	K	25.6	Very low	28.3	Very low	130 Å²	130	152.1 Å²	152.1	57%	0.565	74%	0.742	S	S	*	*			trans	54.5	102.2	133.6	-65.7	178.5	167.8	176.7	0	118.2	G743	G743-K1687 PolarHBondContact O-NZ 2.77Å
1688	G	31.5	Very low	28.3	Very low	81 Å²	81	152.2 Å²	152.2	84%	0.835	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-97.7	126.4	131.5	0	0	0	0	0	109.5
1689	K	31	Very low	28.3	Very low	203 Å²	203	151.4 Å²	151.4	88%	0.883	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-77.8	148.6	157.1	-83.8	-173.6	171.2	-170.9	0	107.4
1690	K	29	Very low	28.3	Very low	205 Å²	205	149.5 Å²	149.5	89%	0.891	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-84.9	117.6	147.2	-79.6	-170	175	-175.2	0	107.5
1691	E	27.5	Very low	28.2	Very low	184 Å²	184	145.6 Å²	145.6	86%	0.86	72%	0.718	S	S	*	*				-168.5	124.2	118.4	-106.4	167.5	-155.6	0	0	108.9
1692	N	26.9	Very low	28.5	Very low	177 Å²	177	148.5 Å²	148.5	95%	0.947	73%	0.725	S	S	*	*			trans	-154.2	123.3	157	-103.9	-3.8	0	0	0	103.9
1693	K	29.9	Very low	28.4	Very low	193 Å²	193	146.6 Å²	146.6	84%	0.839	73%	0.731	S	S	*	*			trans	-111.5	134.5	-179.9	-163.7	-163.9	179.6	-172	0	107.7
1694	V	30.2	Very low	28.4	Very low	115 Å²	115	145.4 Å²	145.4	70%	0.697	74%	0.738	S	S	*	*			trans	68.6	135.7	158.1	151.5	0	0	0	0	115
1695	I	26.5	Very low	28.4	Very low	143 Å²	143	149.5 Å²	149.5	73%	0.733	74%	0.744	S	S	*	*			cis	-150.8	141.1	-10.8	-105.2	168	0	0	0	103.9
1696	C	29.2	Very low	28.6	Very low	99 Å²	99	148 Å²	148	67%	0.669	75%	0.748	S	S	*	*				-149.6	143	62.1	-116.6	0	0	0	0	109.6
1697	K	29.4	Very low	28.7	Very low	172 Å²	172	149.4 Å²	149.4	75%	0.748	76%	0.764	S	S	*	*				56	117.7	94	-67.6	-167.9	176.6	-176.3	0	115.7
1698	N	29.8	Very low	28.8	Very low	130 Å²	130	149.9 Å²	149.9	70%	0.695	77%	0.773	S	S	*	*			trans	58.1	142.3	141.9	-55.6	56.7	0	0	0	119.5
1699	E	27	Very low	28.7	Very low	133 Å²	133	151.8 Å²	151.8	62%	0.621	77%	0.768	S	S	*	*			cis	-161	161.8	-24	-121.7	173.3	135.2	0	0	109.4
1700	Q	28.7	Very low	28.6	Very low	108 Å²	108	147.6 Å²	147.6	51%	0.505	76%	0.76	S	S	.	*			trans	32.1	104.6	152	-59.5	169	58	0	0	120.5	L31	L31-Q1700 VanDerWaalsContact CD1-NE2 3.31Å; L31-Q1700 HydrophobicContact CD2-CG 4.12Å
1701	N	29.1	Very low	28.5	Very low	158 Å²	158	144.2 Å²	144.2	85%	0.845	75%	0.752	S	S	*	*			trans	48.2	135.8	133.5	-69.1	-21	0	0	0	123.2
1702	L	30.4	Very low	28.5	Very low	153 Å²	153	141.8 Å²	141.8	80%	0.801	74%	0.744	S	S	*	*			trans	76.5	94.1	159.8	-91.8	74.9	0	0	0	119
1703	C	25.8	Very low	28.5	Very low	120 Å²	120	139.2 Å²	139.2	81%	0.811	74%	0.735	S	S	*	*				54	89.6	120.5	-60.5	0	0	0	0	119.4
1704	I	28.8	Very low	28.4	Very low	178 Å²	178	135.3 Å²	135.3	91%	0.913	73%	0.728	S	S	*	*			trans	-111.9	156.1	134.2	-65	-177.6	0	0	0	108.4
1705	R	28.4	Very low	28.4	Very low	214 Å²	214	136 Å²	136	81%	0.808	73%	0.727	S	S	*	*			trans	-103	158.1	-168.5	-146.1	-169	-173.9	149.3	-2.6	110.6
1706	N	29.8	Very low	28.5	Very low	133 Å²	133	135.4 Å²	135.4	71%	0.711	73%	0.726	S	S	*	*			trans	68.7	151.4	164	-62	1.2	0	0	0	116.7
1707	T	28.6	Very low	28.4	Very low	108 Å²	108	138.3 Å²	138.3	66%	0.663	74%	0.735	S	S	*	*			cis	-161.4	144.9	-24.7	21.5	0	0	0	0	109.9
1708	N	27.1	Very low	28.3	Very low	141 Å²	141	133.6 Å²	133.6	75%	0.754	74%	0.735	S	S	*	*			trans	70.2	149.9	150	-60.7	-5.8	0	0	0	122.4
1709	T	29.9	Very low	28.1	Very low	121 Å²	121	135.2 Å²	135.2	74%	0.742	74%	0.74	S	S	*	*			trans	71.7	102.1	145.5	38.4	0	0	0	0	123.3
1710	T	27.9	Very low	28.1	Very low	114 Å²	114	135.1 Å²	135.1	70%	0.699	74%	0.744	S	S	*	*				70.6	124.5	123.5	54.3	0	0	0	0	124.7
1711	N	28.6	Very low	28	Very low	135 Å²	135	139 Å²	139	72%	0.722	76%	0.759	S	S	*	*			trans	81.7	114.7	130.1	-61.5	0.7	0	0	0	123.6
1712	N	27.2	Very low	27.9	Very low	133 Å²	133	138.3 Å²	138.3	71%	0.711	75%	0.754	S	S	*	*				72.1	129.2	124.4	-66.9	0.1	0	0	0	124.5
1713	T	27.4	Very low	27.6	Very low	122 Å²	122	138.4 Å²	138.4	75%	0.748	75%	0.751	S	S	*	*			trans	70.1	150.1	136.7	56.9	0	0	0	0	119.3
1714	T	27.8	Very low	27.9	Very low	112 Å²	112	138.1 Å²	138.1	69%	0.687	75%	0.747	S	S	*	*			cis	-164.3	167.7	-0.8	8.2	0	0	0	0	113.5
1715	N	29.4	Very low	27.7	Very low	128 Å²	128	135.6 Å²	135.6	68%	0.684	73%	0.734	S	S	*	*			trans	73.4	103.1	145.4	-66.3	-8.2	0	0	0	124.3
1716	N	27.9	Very low	27.4	Very low	132 Å²	132	134.5 Å²	134.5	71%	0.706	74%	0.735	S	S	*	*				57.8	128.6	100.2	-65.8	2.3	0	0	0	125.2
1717	N	26.9	Very low	27.2	Very low	159 Å²	159	135.5 Å²	135.5	85%	0.85	74%	0.74	S	S	*	*			trans	87.1	143.2	133.4	-64.5	-4.3	0	0	0	123.4
1718	G	28.5	Very low	27	Very low	73 Å²	73	137.1 Å²	137.1	75%	0.753	74%	0.744	S	S	*	*			trans	116.2	98.7	168.3	0	0	0	0	0	113.5
1719	M	25.4	Very low	27	Very low	164 Å²	164	135.4 Å²	135.4	81%	0.808	74%	0.743	S	S	*	*				81.8	101.7	58.2	-72.2	-80	-88	0	0	116.2
1720	N	26.3	Very low	26.7	Very low	132 Å²	132	140 Å²	140	71%	0.706	75%	0.753	S	S	*	*			trans	44.8	126.3	144.5	-54.9	-15.4	0	0	0	121.9
1721	K	26.2	Very low	26.8	Very low	188 Å²	188	141.9 Å²	141.9	82%	0.817	76%	0.759	S	S	*	*				175.4	147	114	-99	171.5	176.7	-177.2	0	116.2
1722	I	28.2	Very low	26.7	Very low	144 Å²	144	146.6 Å²	146.6	74%	0.738	77%	0.768	S	S	*	*			trans	73.9	124.8	140.8	-65.6	165.9	0	0	0	121.9
1723	E	22.7	Very low	26.6	Very low	156 Å²	156	144.4 Å²	144.4	73%	0.729	76%	0.764	S	S	*	*			trans	-9.9	163.7	144.4	-77.3	-177.3	145.4	0	0	121.4
1724	P	32.5	Very low	26.6	Very low	113 Å²	113	146.1 Å²	146.1	73%	0.734	77%	0.768	S	S	*	*			cis	-151.1	152.1	42.5	42.2	-20.2	0	0	0	122.9
1725	I	24.9	Very low	26.5	Very low	126 Å²	126	146 Å²	146	65%	0.646	77%	0.771	S	S	*	*				46.3	117.6	127.7	-51.9	179.3	0	0	0	121.9
1726	K	22.9	Very low	26.3	Very low	191 Å²	191	146.9 Å²	146.9	83%	0.83	77%	0.77	S	S	*	*			trans	47.8	119.6	150.8	-63.7	172.4	-179.9	177	0	121.2
1727	L	24.9	Very low	26.2	Very low	153 Å²	153	148.7 Å²	148.7	80%	0.801	77%	0.772	S	S	*	*				-175.2	136.1	113.5	-101.3	161.8	0	0	0	114.1
1728	N	24.4	Very low	26.2	Very low	143 Å²	143	146 Å²	146	77%	0.765	77%	0.766	S	S	*	*			trans	57.3	155.9	153.2	-69.3	-7.1	0	0	0	124.3
1729	S	26.7	Very low	26.1	Very low	104 Å²	104	150.2 Å²	150.2	73%	0.727	77%	0.771	S	S	*	*			trans	77.1	86	167.9	66.7	0	0	0	0	119.9	N1731	S1729-N1731 PolarHBondContact O-N 2.96Å
1730	F	23.7	Very low	26.1	Very low	218 Å²	218	150.6 Å²	150.6	96%	0.956	77%	0.771	S	S	*	*			trans	27.8	80.7	147.7	-72	-83.1	0	0	0	118.9
1731	N	30.7	Very low	26.1	Very low	153 Å²	153	151.8 Å²	151.8	82%	0.818	78%	0.776	S	S	*	*			trans	-143.8	124.9	156.3	-103.3	-69.5	0	0	0	109.2	S1729	S1729-N1731 PolarHBondContact O-N 2.96Å
1732	Y	25.5	Very low	26.1	Very low	235 Å²	235	147.5 Å²	147.5	92%	0.922	77%	0.77	S	S	*	*			trans	-155	148.9	152	-127.2	-84.7	0	0	0	111.3
1733	S	26.6	Very low	26.1	Very low	87 Å²	87	145.4 Å²	145.4	61%	0.608	77%	0.768	S	S	*	*			trans	-106.5	156.5	-167.1	60.4	0	0	0	0	113.9
1734	N	27.4	Very low	26.3	Very low	157 Å²	157	143.5 Å²	143.5	84%	0.84	77%	0.768	S	S	*	*			trans	-156.1	144.7	141.2	-96.3	-34.1	0	0	0	109.8
1735	C	25.3	Very low	26.1	Very low	110 Å²	110	144.2 Å²	144.2	74%	0.743	76%	0.764	S	S	*	*			cis	-146	178.4	2.9	-159.4	0	0	0	0	112.4
1736	Q	25.1	Very low	26.2	Very low	146 Å²	146	141.4 Å²	141.4	68%	0.682	76%	0.755	S	S	*	*			trans	-117.5	-133.9	176.2	-65.5	171.1	-6.2	0	0	108.4
1737	K	25.8	Very low	26.4	Very low	170 Å²	170	136.3 Å²	136.3	74%	0.739	74%	0.736	S	S	*	*			cis	-169.3	144	-3.3	-145.2	162.2	-176.3	129.8	0	107.1
1738	S	26.4	Very low	26.6	Very low	103 Å²	103	135 Å²	135	72%	0.72	73%	0.726	S	S	*	*			cis	-162.1	149.7	-30.4	49.5	0	0	0	0	108.4
1739	N	27.1	Very low	26.7	Very low	162 Å²	162	135.6 Å²	135.6	87%	0.866	72%	0.719	S	S	*	*			trans	-63.5	134.9	173	-79.6	-39.5	0	0	0	111.8
1740	Q	25.6	Very low	26.8	Very low	171 Å²	171	137.6 Å²	137.6	80%	0.799	72%	0.716	S	S	*	*				-179.7	149.6	112.8	-101.2	-177.4	35.4	0	0	115.7
1741	L	25.8	Very low	27.1	Very low	157 Å²	157	134.1 Å²	134.1	82%	0.822	70%	0.703	S	S	*	*			trans	65	174.8	151.9	-68.1	166.7	0	0	0	118.9
1742	S	26	Very low	27	Very low	98 Å²	98	133.7 Å²	133.7	69%	0.685	70%	0.696	S	S	*	*			trans	-146.5	145.2	-149.5	57.6	0	0	0	0	115.3
1743	S	27.9	Very low	27.4	Very low	100 Å²	100	129.4 Å²	129.4	70%	0.699	68%	0.683	S	S	*	*			trans	68.7	116.7	153.2	57	0	0	0	0	120.9
1744	T	27.9	Very low	27.5	Very low	117 Å²	117	131.9 Å²	131.9	72%	0.718	69%	0.689	S	S	*	*			trans	81.3	115.1	134.2	49.5	0	0	0	0	122
1745	I	27.7	Very low	27.6	Very low	127 Å²	127	132 Å²	132	65%	0.651	68%	0.684	S	S	*	*				73.6	124.4	129.9	-64.9	168.8	0	0	0	115.8
1746	C	27.2	Very low	27.8	Very low	67 Å²	67	134.6 Å²	134.6	45%	0.453	69%	0.685	S	S	.	*			cis	-178.7	176.5	2.4	-98.9	0	0	0	0	107.3	T1925	C1746-T1925 HydrophobicContact CB-CG2 4.1Å
1747	D	26.8	Very low	28.1	Very low	84 Å²	84	132.6 Å²	132.6	45%	0.449	69%	0.685	S	S	.	*			cis	-171.4	-161.3	-13.2	-102.7	8.8	0	0	0	110.8	H1924 T1925	D1747-H1924 HydrophobicContact CB-CB 4.23Å; D1747-H1924 VanDerWaalsContact CB-ND1 3.32Å; D1747-H1924 WeakPolarHBondContact CB-ND1 3.42Å; D1747-H1924 VanDerWaalsContact OD2-CA 3.28Å; D1747-H1924 WeakPolarHBondContact OD2-CA 3.36Å; D1747-H1924 IonicContact OD2-CE1 2.8Å; D1747-H1924 IonicContact OD2-CG 2.8Å; D1747-H1924 IonicContact OD2-ND1 3.33Å; D1747-H1924 PolarHBondContact OD2-ND1 3.49Å; D1747-T1925 HydrophobicContact CB-CG2 3.96Å; D1747-T1925 PolarHBondContact OD2-N 2.73Å
1748	H	28.2	Very low	28	Very low	126 Å²	126	132.8 Å²	132.8	58%	0.583	69%	0.693	S	S	*	*			trans	90.5	127.7	170.1	-94.4	88	0	0	0	120	H1924 T1925	H1748-H1924 WeakPolarHBondContact CA-NE2 3.47Å; H1748-H1924 AromaticContact CD2-CD2 3.83Å; H1748-H1924 AromaticContact CE1-CD2 3.7Å; H1748-H1924 AromaticContact CE1-CG 3.94Å; H1748-H1924 AromaticContact CG-CD2 3.74Å; H1748-H1924 PolarHBondContact N-CE1 2.7Å; H1748-H1924 AromaticContact ND1-CD2 3.66Å; H1748-H1924 AromaticContact ND1-CG 3.8Å; H1748-H1924 AromaticContact NE2-CD2 3.79Å; H1748-T1925 PolarHBondContact ND1-OG1 2.8Å
1749	Y	27.2	Very low	28.6	Very low	155 Å²	155	133 Å²	133	61%	0.608	69%	0.692	S	S	*	*			trans	-17	148.8	168.3	-70.9	-99.4	0	0	0	118.4	H1924	Y1749-H1924 AromaticContact CD2-CD2 3.66Å; Y1749-H1924 AromaticContact CD2-NE2 3.47Å; Y1749-H1924 WeakPolarHBondContact CD2-NE2 3.44Å; Y1749-H1924 AromaticContact CE2-CD2 3.58Å; Y1749-H1924 AromaticContact CE2-NE2 3.61Å
1750	H	28.5	Very low	28.9	Very low	146 Å²	146	130.4 Å²	130.4	68%	0.676	68%	0.684	S	S	*	*			cis	-165.3	159	38.1	-130.3	-59.1	0	0	0	113.6
1751	H	29.5	Very low	29	Very low	145 Å²	145	127.2 Å²	127.2	67%	0.671	68%	0.681	S	S	*	*			trans	68.1	131.9	150.1	-86.4	-58.9	0	0	0	124.7
1752	H	29.9	Very low	29.4	Very low	145 Å²	145	124.8 Å²	124.8	67%	0.671	67%	0.674	S	S	*	*			trans	84.6	130.4	142.7	-90.1	-79.3	0	0	0	124.2
1753	H	33.8	Very low	29.6	Very low	144 Å²	144	126.1 Å²	126.1	67%	0.667	67%	0.673	S	S	*	*			trans	76.1	106.1	155.1	-72.6	-64.3	0	0	0	123.4
1754	L	28.8	Very low	30.1	Very low	140 Å²	140	126.4 Å²	126.4	73%	0.733	67%	0.672	S	S	*	*				81.6	123.7	127.8	-67.2	165.7	0	0	0	121.3
1755	H	30.3	Very low	30.5	Very low	158 Å²	158	126.1 Å²	126.1	73%	0.731	67%	0.673	S	S	*	*			trans	62	99.6	157.1	-76.1	-99.6	0	0	0	120.5
1756	H	28.8	Very low	30.8	Very low	166 Å²	166	125.7 Å²	125.7	77%	0.769	68%	0.678	S	S	*	*				51.9	151.9	129.4	-74.9	-83.5	0	0	0	122
1757	P	31.3	Very low	31.2	Very low	104 Å²	104	131 Å²	131	68%	0.675	70%	0.696	S	S	*	*			cis	-132.3	149.9	-22.9	37.5	-22.2	0	0	0	113.6
1758	L	24.6	Very low	31.8	Very low	174 Å²	174	132 Å²	132	91%	0.911	71%	0.707	S	S	*	*			trans	-142	157.1	158.6	-85.6	179.5	0	0	0	112.2
1759	P	38.8	Very low	32.3	Very low	108 Å²	108	131.9 Å²	131.9	70%	0.701	72%	0.717	S	S	*	*			trans	-111	-153.7	-165.5	38	-17.1	0	0	0	109.1
1760	P	32.7	Very low	32.5	Very low	106 Å²	106	133.2 Å²	133.2	69%	0.688	73%	0.729	S	S	*	*			cis	-147.7	-168.3	10.1	44.1	-22.4	0	0	0	118.4
1761	S	26.6	Very low	32.6	Very low	105 Å²	105	131.3 Å²	131.3	73%	0.734	73%	0.732	S	S	*	*			trans	81.1	158.6	145.2	-75	0	0	0	0	119.1
1762	P	34.7	Very low	32.8	Very low	106 Å²	106	129.5 Å²	129.5	69%	0.688	73%	0.733	S	S	*	*			cis	-142	-172.5	-31.3	39.2	-21.8	0	0	0	114.6
1763	L	30.1	Very low	33	Very low	125 Å²	125	128.5 Å²	128.5	65%	0.654	74%	0.74	S	S	*	*			trans	82.8	157.4	160.2	-67.4	168.7	0	0	0	117.9
1764	P	37.9	Very low	32.8	Very low	106 Å²	106	127.2 Å²	127.2	69%	0.688	74%	0.744	S	S	*	*			trans	-130.5	-165	-142.9	48.7	-33.9	0	0	0	113
1765	P	36.7	Very low	33	Very low	112 Å²	112	125.7 Å²	125.7	73%	0.727	74%	0.742	S	S	*	*			cis	-129.4	-179.8	-4.6	42.6	-27.5	0	0	0	115
1766	P	33.8	Very low	33.2	Very low	117 Å²	117	124.2 Å²	124.2	76%	0.76	75%	0.747	S	S	*	*			trans	-130.8	140	133.7	36.1	-27.9	0	0	0	115.1
1767	H	35.8	Very low	33.3	Very low	180 Å²	180	121.6 Å²	121.6	83%	0.833	75%	0.745	S	S	*	*			trans	20.7	135.3	157.6	-62.8	-84.8	0	0	0	123.5
1768	P	39.5	Very low	33.2	Very low	103 Å²	103	124.6 Å²	124.6	67%	0.669	75%	0.754	S	S	*	*			trans	-87.6	156.2	164.2	37.3	-33.8	0	0	0	112.8
1769	P	38.2	Very low	33.3	Very low	124 Å²	124	124 Å²	124	81%	0.805	75%	0.746	S	S	*	*			trans	-89.2	136.1	168.3	34.2	-31.4	0	0	0	112.1
1770	H	33.4	Very low	32.6	Very low	183 Å²	183	124.3 Å²	124.3	85%	0.847	75%	0.746	S	S	*	*			trans	-139.1	146.7	167.4	-92.5	-95	0	0	0	110.7
1771	S	29.6	Very low	32.4	Very low	107 Å²	107	125.8 Å²	125.8	75%	0.748	75%	0.747	S	S	*	*			trans	-95.4	179.3	168.2	55.2	0	0	0	0	110.3
1772	P	33.5	Very low	32.6	Very low	107 Å²	107	127.9 Å²	127.9	70%	0.695	75%	0.75	S	S	*	*			cis	-126.2	176.2	-9.8	40.7	-26.1	0	0	0	113.9
1773	P	33.5	Very low	32.4	Very low	124 Å²	124	128.4 Å²	128.4	81%	0.805	75%	0.746	S	S	*	*			trans	-81.9	137.2	165.3	33.5	-33.5	0	0	0	111.8
1774	P	30.1	Very low	32.6	Very low	116 Å²	116	127.5 Å²	127.5	75%	0.753	75%	0.748	S	S	*	*				-153.8	-172.3	103.9	41.2	-23.9	0	0	0	113.8
1775	P	32.3	Very low	32.2	Very low	109 Å²	109	127.5 Å²	127.5	71%	0.708	75%	0.746	S	S	*	*				-123.6	164.6	-55.3	38.3	-25.7	0	0	0	112.2
1776	P	36.1	Very low	32	Very low	127 Å²	127	128.4 Å²	128.4	83%	0.825	75%	0.745	S	S	*	*			trans	-93.1	133.5	171.8	34.5	-30.7	0	0	0	113
1777	P	29.9	Very low	31.8	Very low	111 Å²	111	128.8 Å²	128.8	72%	0.721	74%	0.74	S	S	*	*			trans	-103.5	148.6	166.4	36.6	-30.3	0	0	0	112.7
1778	L	29	Very low	31.5	Very low	167 Å²	167	128.4 Å²	128.4	87%	0.874	74%	0.736	S	S	*	*				167.9	172.2	130	-89.3	163.3	0	0	0	112.5
1779	H	27.9	Very low	31.3	Very low	160 Å²	160	128.3 Å²	128.3	74%	0.741	73%	0.734	S	S	*	*			trans	-67.2	145.1	-168.5	-78.9	-91.8	0	0	0	114.7
1780	T	24.5	Very low	31.1	Very low	115 Å²	115	129 Å²	129	71%	0.706	73%	0.73	S	S	*	*				59.2	134.6	81.6	-19.1	0	0	0	0	111.4
1781	I	27.7	Very low	31.2	Very low	138 Å²	138	126.3 Å²	126.3	71%	0.708	72%	0.722	S	S	*	*				-161.7	139.8	51.4	-66.5	162.3	0	0	0	111.6
1782	N	30.1	Very low	31.5	Very low	149 Å²	149	126.2 Å²	126.2	80%	0.797	71%	0.714	S	S	*	*				174.1	138.4	124.2	-99.4	-44.9	0	0	0	114.8
1783	L	30.9	Very low	32	Very low	116 Å²	116	127 Å²	127	61%	0.607	71%	0.711	S	S	*	*			trans	-104.5	-165.4	157.1	-80.4	78.1	0	0	0	108.3
1784	P	33.5	Very low	31.8	Very low	106 Å²	106	127.1 Å²	127.1	69%	0.688	71%	0.705	S	S	*	*				-151.8	150.4	93.5	40.2	-22.6	0	0	0	118.2
1785	T	31.2	Very low	32.3	Very low	106 Å²	106	127.2 Å²	127.2	65%	0.65	71%	0.706	S	S	*	*			trans	65	154.8	135.2	58.8	0	0	0	0	121.8
1786	N	31.5	Very low	32.1	Very low	131 Å²	131	126.4 Å²	126.4	70%	0.701	70%	0.703	S	S	*	*			cis	-164.5	-164.7	-1.7	-106.2	3.9	0	0	0	108.3
1787	L	29.4	Very low	31.8	Very low	125 Å²	125	126.6 Å²	126.6	65%	0.654	70%	0.702	S	S	*	*				-171.8	173.2	-56.3	-86.7	179.1	0	0	0	106.5
1788	F	30.1	Very low	31.6	Very low	172 Å²	172	126.8 Å²	126.8	75%	0.754	70%	0.702	S	S	*	*			cis	179.1	-154.8	-36.8	-176.9	-129.2	0	0	0	108.8
1789	V	34.3	Very low	31.5	Very low	102 Å²	102	128 Å²	128	62%	0.618	71%	0.705	S	S	*	*			trans	83.1	123.1	153.5	-96	0	0	0	0	125.8
1790	N	34.4	Very low	31.7	Very low	138 Å²	138	125 Å²	125	74%	0.738	70%	0.698	S	S	*	*			trans	75.5	158.8	133.3	-80.4	8.1	0	0	0	121.8
1791	N	35.6	Very low	32.1	Very low	126 Å²	126	125.6 Å²	125.6	67%	0.674	70%	0.702	S	S	*	*			cis	-139.4	-179.8	20.8	-144.4	21.8	0	0	0	111.3
1792	N	36.6	Very low	32.2	Very low	106 Å²	106	126.7 Å²	126.7	57%	0.567	70%	0.701	S	S	*	*			cis	-160.9	175.4	15.9	-168.4	18.5	0	0	0	112.1
1793	N	43.2	Very low	32.3	Very low	122 Å²	122	126.4 Å²	126.4	65%	0.652	70%	0.699	S	S	*	*			trans	77.2	143.6	164	-71.9	-20.3	0	0	0	118.1
1794	N	28.9	Very low	32.2	Very low	127 Å²	127	125.6 Å²	125.6	68%	0.679	70%	0.704	S	S	*	*			cis	79.8	156.3	20.5	-52.2	-45.7	0	0	0	115.4
1795	P	41.3	Very low	32.1	Very low	119 Å²	119	126.4 Å²	126.4	77%	0.773	70%	0.701	S	S	*	*			cis	-89.4	-138.9	-8.5	4.5	19.5	0	0	0	111
1796	S	28.1	Very low	32	Very low	91 Å²	91	128.3 Å²	128.3	64%	0.636	71%	0.707	S	S	*	*			cis	-157.6	165.1	15.3	-59.2	0	0	0	0	113.4
1797	T	30.5	Very low	31.7	Very low	132 Å²	132	130 Å²	130	81%	0.81	71%	0.711	S	S	*	*			trans	-71.3	139.9	174.5	44.5	0	0	0	0	113.1
1798	T	25.9	Very low	31.6	Very low	115 Å²	115	128.7 Å²	128.7	71%	0.706	71%	0.711	S	S	*	*	S	Bend	cis	-151.2	165.9	1.7	-20.1	0	0	0	0	110.2
1799	M	25.3	Very low	31.5	Very low	191 Å²	191	127.1 Å²	127.1	94%	0.941	71%	0.71	S	S	*	*	S	Bend	trans	63.1	48.6	-175.9	-55.3	-62.8	-94.9	0	0	113.4
1800	V	33	Very low	31.4	Very low	98 Å²	98	131.4 Å²	131.4	59%	0.594	72%	0.724	S	S	*	*			trans	-140.2	147.4	179.6	-171.5	0	0	0	0	104.6	K1802	V1800-K1802 HydrophobicContact CG1-CB 4.47Å
1801	T	33.5	Very low	30.9	Very low	128 Å²	128	133.6 Å²	133.6	79%	0.785	73%	0.727	S	S	*	*			cis	-118.5	143.4	15.8	47.6	0	0	0	0	111.2
1802	K	29.8	Very low	30.4	Very low	160 Å²	160	131.5 Å²	131.5	70%	0.696	72%	0.722	S	S	*	*			cis	70.3	97.8	17.8	-150.1	-169.9	-177.5	-176.8	0	116.2	V1800	V1800-K1802 HydrophobicContact CG1-CB 4.47Å
1803	N	31.7	Very low	29.8	Very low	143 Å²	143	137 Å²	137	77%	0.765	74%	0.736	S	S	*	*				175.6	135.7	122.3	-82.1	-12.5	0	0	0	107.9
1804	S	28.2	Very low	29	Very low	99 Å²	99	138.3 Å²	138.3	69%	0.692	74%	0.742	S	S	*	*			cis	-160.9	143.1	-4.6	37.3	0	0	0	0	106.4
1805	I	31.6	Very low	29	Very low	124 Å²	124	138.9 Å²	138.9	64%	0.636	74%	0.739	S	S	*	*			cis	50.4	72.4	14.1	-52.9	-173	0	0	0	112.5	Q1807	I1805-Q1807 HydrophobicContact CG2-CB 4.21Å
1806	D	28.7	Very low	28.1	Very low	145 Å²	145	139.7 Å²	139.7	78%	0.775	74%	0.737	S	S	*	*				-82.5	97.8	100.4	-67.6	-49.5	0	0	0	106.9
1807	Q	25.5	Very low	28.5	Very low	167 Å²	167	142.6 Å²	142.6	78%	0.78	74%	0.741	S	S	*	*				-81.6	95.5	92.5	-61.5	174.9	-10.7	0	0	114.9	I1805	I1805-Q1807 HydrophobicContact CG2-CB 4.21Å
1808	C	28.3	Very low	28.2	Very low	97 Å²	97	145 Å²	145	66%	0.655	74%	0.74	S	S	*	*			trans	-163.3	116.8	146.3	-103.3	0	0	0	0	106.9
1809	N	27.5	Very low	28.6	Very low	139 Å²	139	146.1 Å²	146.1	74%	0.743	74%	0.742	S	S	*	*			cis	-130.5	115.2	6	-69.7	-33.9	0	0	0	111.3
1810	Q	32.5	Very low	28.6	Very low	193 Å²	193	141.7 Å²	141.7	90%	0.902	72%	0.722	S	S	*	*	S	Bend	trans	-102.4	136.4	137.9	-87.4	-162	-0.8	0	0	106.9
1811	K	24	Very low	28.2	Very low	183 Å²	183	142.8 Å²	142.8	80%	0.796	72%	0.721	S	S	*	*	S	Bend	trans	67.8	150	-159.4	-54.9	-179.1	-179.5	179.7	0	113.3
1812	S	24.9	Very low	27.7	Very low	83 Å²	83	146.9 Å²	146.9	58%	0.58	72%	0.723	S	S	*	*			cis	-163.6	111.3	-24.2	46.1	0	0	0	0	110.5
1813	Y	24	Very low	27.5	Very low	221 Å²	221	142.5 Å²	142.5	87%	0.867	71%	0.713	S	S	*	*			trans	-152.5	75.5	154.7	-71.7	-67.1	0	0	0	105.7
1814	L	25.4	Very low	27.3	Very low	149 Å²	149	141.7 Å²	141.7	78%	0.78	71%	0.707	S	S	*	*	S	Bend		-21.2	96.2	62.1	-77.8	177.9	0	0	0	116.4
1815	F	28.5	Very low	27.3	Very low	139 Å²	139	142.3 Å²	142.3	61%	0.61	70%	0.703	S	S	*	*			trans	60.4	136.9	156.1	-73.9	-103.2	0	0	0	115.6	Q1817	F1815-Q1817 HydrophobicContact CE1-CG 4.46Å
1816	D	22.4	Very low	27.2	Very low	137 Å²	137	141.6 Å²	141.6	73%	0.733	70%	0.7	S	S	*	*			cis	-132.7	159.5	48.1	-90.9	-48.1	0	0	0	116.1
1817	Q	38.3	Very low	27.2	Very low	151 Å²	151	140.7 Å²	140.7	71%	0.706	70%	0.696	S	S	*	*			trans	-77.6	138.1	164.2	-52.3	167.4	-74.1	0	0	108.6	F1815	F1815-Q1817 HydrophobicContact CE1-CG 4.46Å
1818	F	24.2	Very low	27.3	Very low	182 Å²	182	139 Å²	139	80%	0.798	69%	0.691	S	S	*	*			trans	-156.5	92.3	147.5	-102.5	-63.2	0	0	0	112.2
1819	N	32.4	Very low	27.4	Very low	140 Å²	140	140.7 Å²	140.7	75%	0.749	69%	0.692	S	S	*	*				171.2	103.4	129.1	-88.3	-40.8	0	0	0	106.8
1820	N	27	Very low	27.3	Very low	98 Å²	98	138.4 Å²	138.4	52%	0.524	69%	0.687	S	S	.	*				81.2	99.5	84.3	-77.8	-17.2	0	0	0	110.4
1821	Q	23.3	Very low	27.1	Very low	121 Å²	121	138.3 Å²	138.3	57%	0.565	68%	0.684	S	S	*	*				82.7	104.2	81.3	-81.3	179.1	2.1	0	0	110.9
1822	Y	23.5	Very low	27.1	Very low	213 Å²	213	134.2 Å²	134.2	84%	0.835	68%	0.678	S	S	*	*	S	Bend		-99.9	112.6	80.6	-71.5	-98.5	0	0	0	106.4
1823	S	24.9	Very low	27.1	Very low	69 Å²	69	137.8 Å²	137.8	48%	0.483	69%	0.691	S	S	.	*				102.9	135	62.4	-80.5	0	0	0	0	109
1824	I	28.3	Very low	27.1	Very low	126 Å²	126	135.1 Å²	135.1	65%	0.646	69%	0.686	S	S	*	*			cis	-158.2	143.6	6.9	-128.2	163.9	0	0	0	110.5
1825	N	27.8	Very low	27.1	Very low	111 Å²	111	135.3 Å²	135.3	59%	0.594	68%	0.683	S	S	*	*			trans	56.9	155.1	150.4	-61.8	-1.8	0	0	0	120.9
1826	N	29.7	Very low	26.9	Very low	110 Å²	110	135.8 Å²	135.8	59%	0.588	69%	0.687	S	S	*	*			cis	-164.3	147.7	-11.5	-110.1	-10.3	0	0	0	111.1
1827	N	28.9	Very low	27	Very low	126 Å²	126	135.6 Å²	135.6	67%	0.674	68%	0.682	S	S	*	*			trans	62.1	157.3	138.8	-61.3	-13.6	0	0	0	121.5
1828	L	28.4	Very low	26.4	Very low	130 Å²	130	135 Å²	135	68%	0.681	68%	0.679	S	S	*	*			cis	-167.1	163	-19.6	-102.7	168.4	0	0	0	108.6
1829	I	28.8	Very low	26.6	Very low	134 Å²	134	132 Å²	132	69%	0.687	67%	0.668	S	S	*	*			trans	51.5	118.9	146.3	-67.8	163.6	0	0	0	118.1
1830	S	26.8	Very low	26.6	Very low	91 Å²	91	133.9 Å²	133.9	64%	0.636	67%	0.669	S	S	*	*			cis	91.3	146.1	37.4	91	0	0	0	0	116.9
1831	K	26.8	Very low	26.7	Very low	190 Å²	190	133.6 Å²	133.6	83%	0.826	68%	0.675	S	S	*	*			trans	86.4	108.7	157.9	-73.2	-177.8	178.2	178.1	0	122.5
1832	S	23.9	Very low	26.9	Very low	98 Å²	98	134.3 Å²	134.3	69%	0.685	68%	0.681	S	S	*	*				54.5	125.5	120.2	72.4	0	0	0	0	124.4
1833	N	25.3	Very low	27.1	Very low	157 Å²	157	132 Å²	132	84%	0.84	68%	0.678	S	S	*	*			trans	61.5	149.8	131.7	-81.7	-8	0	0	0	123.4
1834	Q	23.7	Very low	27.5	Very low	165 Å²	165	135.7 Å²	135.7	77%	0.771	69%	0.692	S	S	*	*			trans	77.8	145.4	170.1	-62	-165.9	-1.2	0	0	117.7
1835	Q	25	Very low	27.5	Very low	153 Å²	153	138.6 Å²	138.6	72%	0.715	70%	0.703	S	S	*	*			trans	54.6	102.9	154.7	-69.8	175.4	29.7	0	0	116.5
1836	Q	24.6	Very low	27.5	Very low	149 Å²	149	143.9 Å²	143.9	70%	0.696	72%	0.717	S	S	*	*				99.3	138.8	74.4	-96.9	-168.3	33.6	0	0	111.1
1837	Q	25.9	Very low	27.4	Very low	134 Å²	134	145 Å²	145	63%	0.626	72%	0.722	S	S	*	*			trans	64.8	114.8	153.2	-66.1	-174.7	58.6	0	0	119.9
1838	Q	26	Very low	27.6	Very low	138 Å²	138	147.4 Å²	147.4	65%	0.645	73%	0.729	S	S	*	*			trans	73.5	147.7	131.8	-59.1	-172.2	71.5	0	0	117.3
1839	Q	27.8	Very low	27.6	Very low	120 Å²	120	149.1 Å²	149.1	56%	0.561	74%	0.739	S	S	*	*			cis	-158.2	154.7	5	-135.8	-179.6	61.4	0	0	110.2
1840	K	31.7	Very low	27.6	Very low	178 Å²	178	150.1 Å²	150.1	77%	0.774	74%	0.741	S	S	*	*			trans	66.5	148	163.9	-62.1	151	171.9	148.5	0	117
1841	S	29.1	Very low	27.5	Very low	92 Å²	92	155.1 Å²	155.1	64%	0.643	75%	0.747	S	S	*	*			cis	-172.1	140.6	-22.8	48.8	0	0	0	0	110.2
1842	I	27.7	Very low	27.5	Very low	137 Å²	137	154.5 Å²	154.5	70%	0.703	75%	0.745	S	S	*	*			trans	49.7	118.3	135.9	-57.6	169.1	0	0	0	116.3
1843	Q	28.5	Very low	27.5	Very low	163 Å²	163	156.8 Å²	156.8	76%	0.762	75%	0.748	S	S	*	*			cis	-163.6	168.4	37.6	-143.3	157.6	-29.1	0	0	112.9
1844	N	33.1	Very low	27.4	Very low	147 Å²	147	154.4 Å²	154.4	79%	0.786	74%	0.743	S	S	*	*			trans	62.7	116.4	164.3	-63.9	-14	0	0	0	119.2
1845	Q	28.2	Very low	27.5	Very low	187 Å²	187	156.3 Å²	156.3	87%	0.874	74%	0.744	S	S	*	*			trans	-139.3	137.5	172.4	-70.4	-177.5	-50.8	0	0	111.7
1846	Y	28.2	Very low	27.7	Very low	223 Å²	223	155 Å²	155	88%	0.875	74%	0.741	S	S	*	*			trans	169.9	148.3	155.9	-94.2	-52.5	0	0	0	106.7
1847	N	27.7	Very low	27.8	Very low	132 Å²	132	155.5 Å²	155.5	71%	0.706	74%	0.743	S	S	*	*			cis	-154.5	127.1	-1.5	-153.3	-12.3	0	0	0	110
1848	H	31.7	Very low	28	Very low	178 Å²	178	154.8 Å²	154.8	82%	0.824	74%	0.743	S	S	*	*			trans	-161.5	137.2	173.2	-120.9	53.2	0	0	0	112.4
1849	N	27.9	Very low	28.1	Very low	166 Å²	166	154.5 Å²	154.5	89%	0.888	75%	0.747	S	S	*	*			trans	-166.5	157.4	159.8	-109.5	-32	0	0	0	112
1850	Q	28.9	Very low	28.2	Very low	154 Å²	154	156 Å²	156	72%	0.72	75%	0.754	S	S	*	*			trans	-117.7	171.3	175.6	-72.2	-170.4	-14.8	0	0	111.9
1851	Y	26.2	Very low	28.1	Very low	196 Å²	196	153.1 Å²	153.1	77%	0.769	75%	0.746	S	S	*	*			trans	80.3	126.8	161.4	-72.6	-75.2	0	0	0	121.7
1852	K	25.4	Very low	28	Very low	178 Å²	178	156.1 Å²	156.1	77%	0.774	76%	0.755	S	S	*	*			trans	29.8	128.6	141.4	-77.6	-175.4	174.8	177.9	0	122.3
1853	L	24	Very low	28.1	Very low	146 Å²	146	156.4 Å²	156.4	76%	0.764	75%	0.753	S	S	*	*			trans	69.5	106	146.1	-83.2	90.2	0	0	0	120.5
1854	C	24.9	Very low	28.2	Very low	107 Å²	107	157.3 Å²	157.3	72%	0.723	75%	0.751	S	S	*	*				70.8	111.4	126.9	-64.2	0	0	0	0	122.2
1855	Y	25.4	Very low	28.1	Very low	205 Å²	205	159 Å²	159	80%	0.804	75%	0.751	S	S	*	*			trans	90.6	103.9	138.5	-89.3	-110.1	0	0	0	121.8
1856	I	27.9	Very low	28.3	Very low	126 Å²	126	155.3 Å²	155.3	65%	0.646	74%	0.738	S	S	*	*			trans	81.5	112.9	135.6	-69.4	-174.1	0	0	0	120.7
1857	E	26.9	Very low	28.5	Very low	159 Å²	159	151.1 Å²	151.1	74%	0.743	73%	0.73	S	S	*	*			trans	56.4	150.5	140.5	-59.8	-173.5	144.4	0	0	121.6
1858	N	30.2	Very low	28.8	Very low	118 Å²	118	149.8 Å²	149.8	63%	0.631	72%	0.723	S	S	*	*			cis	-166.6	146.9	-17.5	-98	-19.3	0	0	0	109.6
1859	N	29.2	Very low	28.7	Very low	133 Å²	133	148.2 Å²	148.2	71%	0.711	72%	0.716	S	S	*	*			trans	57.2	168.7	159	-67	28.2	0	0	0	117
1860	E	29.9	Very low	28.7	Very low	151 Å²	151	147 Å²	147	71%	0.706	70%	0.704	S	S	*	*			cis	-160.4	179.3	-8.9	-125	171.9	-87.7	0	0	107.2
1861	L	29.6	Very low	28.6	Very low	118 Å²	118	145.8 Å²	145.8	62%	0.618	70%	0.703	S	S	*	*			cis	-157	-179.2	-2.2	177	53.1	0	0	0	106.6	Q1863	L1861-Q1863 HydrophobicContact CD2-CG 4.48Å; L1861-Q1863 HydrophobicContact CG-CG 4.4Å
1862	N	27.4	Very low	28.6	Very low	154 Å²	154	142.3 Å²	142.3	82%	0.824	70%	0.697	S	S	*	*			trans	-141.8	147.7	166.5	-133.2	-24.8	0	0	0	113.9
1863	Q	28.8	Very low	28.7	Very low	144 Å²	144	140 Å²	140	67%	0.673	69%	0.693	S	S	*	*			trans	-152.8	-179.4	-166.3	-46	-177.6	-5.2	0	0	110.5	L1861	L1861-Q1863 HydrophobicContact CD2-CG 4.48Å; L1861-Q1863 HydrophobicContact CG-CG 4.4Å
1864	Y	30.4	Very low	28.9	Very low	181 Å²	181	139.7 Å²	139.7	71%	0.71	69%	0.691	S	S	*	*			cis	-159.5	178.2	1.7	-165.7	-112.9	0	0	0	108.5	N1866	Y1864-N1866 WeakPolarHBondContact CD1-OD1 3.32Å; Y1864-N1866 VanDerWaalsContact CE1-OD1 3.32Å; Y1864-N1866 WeakPolarHBondContact CE1-OD1 3.28Å
1865	K	32	Very low	29	Very low	182 Å²	182	140.3 Å²	140.3	79%	0.791	69%	0.687	S	S	*	*			trans	144.8	153.3	147	-83.3	171.6	-177.8	-175	0	114.7
1866	N	31.3	Very low	29	Very low	111 Å²	111	138.2 Å²	138.2	59%	0.594	68%	0.684	S	S	*	*			cis	-170.5	142.7	-34.4	-134.7	51.7	0	0	0	109.6	Y1864	Y1864-N1866 WeakPolarHBondContact CD1-OD1 3.32Å; Y1864-N1866 VanDerWaalsContact CE1-OD1 3.32Å; Y1864-N1866 WeakPolarHBondContact CE1-OD1 3.28Å
1867	D	32.8	Very low	28.8	Very low	134 Å²	134	137.2 Å²	137.2	72%	0.717	69%	0.688	S	S	*	*			trans	-179.7	121.5	145.5	-98.4	-0.6	0	0	0	107.3
1868	N	33.2	Very low	28.9	Very low	105 Å²	105	134.3 Å²	134.3	56%	0.561	69%	0.686	S	S	*	*				73.2	133.3	98.2	-57.9	-15.9	0	0	0	113
1869	H	30.6	Very low	28.6	Very low	145 Å²	145	133.5 Å²	133.5	67%	0.671	69%	0.69	S	S	*	*			cis	-173.5	164.5	-5.5	-116.3	-42.7	0	0	0	106
1870	H	28.5	Very low	28.6	Very low	139 Å²	139	135.4 Å²	135.4	64%	0.644	70%	0.698	S	S	*	*			cis	-167.8	162.3	1.5	-152.6	-37.4	0	0	0	108.9
1871	L	26.5	Very low	28.5	Very low	130 Å²	130	131 Å²	131	68%	0.681	69%	0.693	S	S	*	*			trans	73.2	151.1	160.5	-51.3	173.3	0	0	0	115
1872	N	25.6	Very low	28.4	Very low	123 Å²	123	134.7 Å²	134.7	66%	0.658	70%	0.704	S	S	*	*			cis	-166.4	164.3	-6.6	-110.4	1	0	0	0	108.5
1873	L	27.7	Very low	28.6	Very low	130 Å²	130	134.1 Å²	134.1	68%	0.681	70%	0.701	S	S	*	*			cis	-170.8	174.9	-27.5	-133.3	-175.4	0	0	0	107.8
1874	L	28.8	Very low	28.8	Very low	139 Å²	139	130.4 Å²	130.4	73%	0.728	70%	0.701	S	S	*	*			trans	65.9	173.1	164.3	-62.1	166.7	0	0	0	117.3
1875	N	26.7	Very low	28.8	Very low	120 Å²	120	129.1 Å²	129.1	64%	0.642	71%	0.705	S	S	*	*				-179	158.6	-62.1	-107.2	-0.5	0	0	0	109.1
1876	H	25.8	Very low	28.6	Very low	160 Å²	160	126.4 Å²	126.4	74%	0.741	71%	0.709	S	S	*	*			trans	61	125.6	160.5	-64.4	-63.1	0	0	0	121.6
1877	S	23.5	Very low	28.5	Very low	105 Å²	105	124 Å²	124	73%	0.734	71%	0.71	S	S	*	*			trans	65.8	161.2	137.8	60.6	0	0	0	0	122.1
1878	S	27.6	Very low	28.5	Very low	98 Å²	98	127.1 Å²	127.1	69%	0.685	72%	0.718	S	S	*	*			trans	52.3	105.5	155.2	52.7	0	0	0	0	120.1
1879	S	25.3	Very low	28.3	Very low	102 Å²	102	130 Å²	130	71%	0.713	73%	0.732	S	S	*	*			trans	16	132.2	132.7	58.8	0	0	0	0	121.1
1880	I	28.4	Very low	28.2	Very low	173 Å²	173	128 Å²	128	89%	0.887	74%	0.735	S	S	*	*			trans	156.5	150	131.6	-81.1	154.8	0	0	0	110.3
1881	G	29	Very low	28.3	Very low	58 Å²	58	125.9 Å²	125.9	60%	0.598	74%	0.735	S	S	*	*			trans	89.1	127.4	178.8	0	0	0	0	0	113.7
1882	F	26.7	Very low	28.4	Very low	195 Å²	195	125 Å²	125	86%	0.855	74%	0.74	S	S	*	*			cis	58.4	124.3	18	-67.3	-99.5	0	0	0	113.6
1883	N	31.4	Very low	28.5	Very low	142 Å²	142	125 Å²	125	76%	0.759	74%	0.744	S	S	*	*			cis	-139.9	158.4	5	-91.7	-57.4	0	0	0	110.4
1884	G	32.4	Very low	28.3	Very low	66 Å²	66	124.2 Å²	124.2	68%	0.68	75%	0.748	S	S	*	*	S	Bend	cis	177.3	169.7	-1.8	0	0	0	0	0	109.9
1885	I	31.2	Very low	28.2	Very low	155 Å²	155	128.7 Å²	128.7	80%	0.795	76%	0.756	S	S	*	*			cis	-145.7	125.2	5.8	-61.6	177.4	0	0	0	110.1
1886	S	28.4	Very low	28.2	Very low	124 Å²	124	128.1 Å²	128.1	87%	0.867	76%	0.761	S	S	*	*			trans	48.4	146.7	151.1	-148.4	0	0	0	0	122.7
1887	G	29.2	Very low	28.6	Very low	60 Å²	60	126 Å²	126	62%	0.619	76%	0.764	S	S	*	*			cis	155	118.1	-10.5	0	0	0	0	0	116.9
1888	K	31.7	Very low	28.9	Very low	200 Å²	200	131.3 Å²	131.3	87%	0.87	77%	0.768	S	S	*	*			trans	54.8	112.7	145.4	-63.5	-176.4	-179.6	-178.3	0	123.4
1889	L	30.4	Very low	28.9	Very low	167 Å²	167	137.2 Å²	137.2	87%	0.874	78%	0.775	S	S	*	*				40.3	127.4	112.5	-69.6	167.2	0	0	0	123.2
1890	S	28.4	Very low	29	Very low	103 Å²	103	136 Å²	136	72%	0.72	78%	0.779	S	S	*	*			trans	79.5	126.3	133.2	-155.8	0	0	0	0	123.5
1891	S	30.7	Very low	29.2	Very low	94 Å²	94	131.6 Å²	131.6	66%	0.657	78%	0.776	S	S	*	*			trans	61.4	95.1	141.5	58.1	0	0	0	0	122.4
1892	S	28.7	Very low	29.3	Very low	111 Å²	111	132.5 Å²	132.5	78%	0.776	79%	0.786	S	S	*	*				84.3	158.3	128	81.4	0	0	0	0	121.8
1893	V	26.2	Very low	29.4	Very low	123 Å²	123	126.7 Å²	126.7	75%	0.745	78%	0.78	S	S	*	*			trans	70.1	96.6	164.5	-174.7	0	0	0	0	118.5
1894	C	23.9	Very low	29.5	Very low	114 Å²	114	125.9 Å²	125.9	77%	0.77	79%	0.785	S	S	*	*			trans	62.9	154.8	137.5	-62.8	0	0	0	0	123.1
1895	R	26.4	Very low	29.5	Very low	233 Å²	233	127.1 Å²	127.1	88%	0.879	79%	0.788	S	S	*	*			trans	65.2	102	168.1	-69	173.8	174.4	157.9	-1.3	115.1
1896	S	26.1	Very low	29.6	Very low	108 Å²	108	127.8 Å²	127.8	76%	0.755	79%	0.793	S	S	*	*				67.7	106.6	63.4	-50.6	0	0	0	0	114.4
1897	S	35.1	Very low	29.9	Very low	115 Å²	115	125.9 Å²	125.9	80%	0.804	79%	0.793	S	S	*	*			trans	61.1	87.8	133.9	-48.5	0	0	0	0	119.2
1898	R	29.8	Very low	30.1	Very low	217 Å²	217	126.9 Å²	126.9	82%	0.819	80%	0.803	S	S	*	*			trans	-138.3	152.5	138.7	-72.5	-170.7	176.6	-166.7	1.1	108.8
1899	R	28.5	Very low	30.3	Very low	221 Å²	221	120.9 Å²	120.9	83%	0.834	80%	0.798	S	S	*	*			cis	-170.1	151.6	-23.6	-105.5	174.3	-175.9	-169.6	-2.1	102.7
1900	G	27.4	Very low	30.7	Very low	76 Å²	76	118.9 Å²	118.9	78%	0.784	80%	0.798	S	S	*	*			cis	139.4	136.4	9.4	0	0	0	0	0	109.1
1901	G	32.3	Very low	31	Very low	81 Å²	81	117.5 Å²	117.5	84%	0.835	80%	0.8	S	S	*	*			trans	109.2	137.6	-178.8	0	0	0	0	0	113.3
1902	G	30.5	Very low	31.1	Very low	78 Å²	78	117.2 Å²	117.2	80%	0.804	81%	0.812	S	S	*	*			cis	-82.2	-175.4	-14	0	0	0	0	0	113.1
1903	G	29.5	Very low	31.3	Very low	72 Å²	72	116.2 Å²	116.2	74%	0.742	82%	0.819	S	S	*	*			cis	82.2	125.1	10	0	0	0	0	0	111.9
1904	C	32.2	Very low	31.4	Very low	125 Å²	125	113.9 Å²	113.9	85%	0.845	82%	0.82	S	S	*	*			cis	-144.4	145.1	7.5	-67.1	0	0	0	0	109.5
1905	A	33	Very low	32.2	Very low	92 Å²	92	114 Å²	114	76%	0.76	82%	0.819	S	S	*	*				68.4	149.7	99.3	0	0	0	0	0	115
1906	L	34.2	Very low	32.4	Very low	169 Å²	169	108.1 Å²	108.1	89%	0.885	81%	0.814	S	S	*	*			cis	-134.8	158.6	10.5	-63.5	156.9	0	0	0	108.1
1907	G	33	Very low	32.8	Very low	84 Å²	84	107.7 Å²	107.7	87%	0.866	81%	0.811	S	S	*	*				95.2	137.1	63.6	0	0	0	0	0	111.7
1908	G	34.9	Very low	32.6	Very low	81 Å²	81	107.9 Å²	107.9	84%	0.835	81%	0.813	S	S	*	*			cis	167.8	150.7	-10.2	0	0	0	0	0	114.3
1909	G	35.2	Very low	32.6	Very low	75 Å²	75	100.9 Å²	100.9	77%	0.773	81%	0.808	S	S	*	*			trans	80.4	167.8	166.5	0	0	0	0	0	118.4
1910	S	38	Very low	32.8	Very low	124 Å²	124	100.7 Å²	100.7	87%	0.867	81%	0.809	S	S	*	*			cis	-172.7	141.8	-17.5	-97.9	0	0	0	0	113
1911	G	34.6	Very low	33	Very low	74 Å²	74	104.6 Å²	104.6	76%	0.763	81%	0.806	S	S	*	*			trans	77.4	158.9	164.2	0	0	0	0	0	117.6
1912	G	32.9	Very low	33	Very low	88 Å²	88	103.8 Å²	103.8	91%	0.907	79%	0.788	S	S	*	*			cis	168.2	152.6	-9.9	0	0	0	0	0	113
1913	G	32.6	Very low	33	Very low	90 Å²	90	107.2 Å²	107.2	93%	0.928	79%	0.785	S	S	*	*			trans	124.1	150.7	165.6	0	0	0	0	0	118.8
1914	G	30.1	Very low	33.2	Very low	75 Å²	75	106.3 Å²	106.3	77%	0.773	76%	0.761	S	S	*	*			trans	-139.9	-147.4	162	0	0	0	0	0	107.8
1915	P	40.8	Very low	33.3	Very low	115 Å²	115	104.3 Å²	104.3	75%	0.747	75%	0.745	S	S	*	*			cis	-135.2	-174.9	-19.2	37.9	-18.9	0	0	0	113.7
1916	S	29.9	Very low	33.2	Very low	111 Å²	111	102.4 Å²	102.4	78%	0.776	73%	0.734	S	S	*	*			trans	62.8	166.1	160.5	28.6	0	0	0	0	118.7
1917	S	33.8	Very low	33.1	Very low	99 Å²	99	98.5 Å²	98.5	69%	0.692	73%	0.727	S	S	*	*			cis	-168.5	143.9	-21.6	49.7	0	0	0	0	112.9
1918	S	32	Very low	33	Very low	119 Å²	119	100 Å²	100	83%	0.832	72%	0.724	S	S	*	*			trans	49.2	135.5	146.4	62.2	0	0	0	0	124.7
1919	G	29.1	Very low	32.6	Very low	69 Å²	69	104.1 Å²	104.1	71%	0.711	72%	0.721	S	S	*	*			trans	127.5	144.8	163.4	0	0	0	0	0	113.2
1920	Y	33.1	Very low	32.4	Very low	218 Å²	218	108 Å²	108	86%	0.855	72%	0.724	S	S	*	*			cis	-151.2	-178.5	0.3	-121.3	-93.1	0	0	0	111.5
1921	E	31	Very low	31.9	Very low	157 Å²	157	107.5 Å²	107.5	73%	0.734	72%	0.72	S	S	*	*			trans	-47.3	173.5	171.5	-67.6	179.7	120.6	0	0	117.9
1922	S	32.9	Very low	31.8	Very low	64 Å²	64	112.2 Å²	112.2	45%	0.448	73%	0.727	S	S	.	*			cis	-172.9	143.9	-18	-95.1	0	0	0	0	112.2
1923	M	29.5	Very low	31.6	Very low	150 Å²	150	112.9 Å²	112.9	74%	0.739	72%	0.717	S	S	*	*			trans	62.8	-170.1	156.4	-51.7	168.2	-154.2	0	0	116.7
1924	H	34.6	Very low	31.4	Very low	53 Å²	53	116.5 Å²	116.5	25%	0.245	71%	0.71	C	S	.	*			cis	-154.6	151.7	7.7	-106.2	-32.6	0	0	0	112.4	D1747 H1748 Y1749	D1747-H1924 HydrophobicContact CB-CB 4.23Å; D1747-H1924 VanDerWaalsContact CB-ND1 3.32Å; D1747-H1924 WeakPolarHBondContact CB-ND1 3.42Å; D1747-H1924 VanDerWaalsContact OD2-CA 3.28Å; D1747-H1924 WeakPolarHBondContact OD2-CA 3.36Å; D1747-H1924 IonicContact OD2-CE1 2.8Å; D1747-H1924 IonicContact OD2-CG 2.8Å; D1747-H1924 IonicContact OD2-ND1 3.33Å; D1747-H1924 PolarHBondContact OD2-ND1 3.49Å; H1748-H1924 WeakPolarHBondContact CA-NE2 3.47Å; H1748-H1924 AromaticContact CD2-CD2 3.83Å; H1748-H1924 AromaticContact CE1-CD2 3.7Å; H1748-H1924 AromaticContact CE1-CG 3.94Å; H1748-H1924 AromaticContact CG-CD2 3.74Å; H1748-H1924 PolarHBondContact N-CE1 2.7Å; H1748-H1924 AromaticContact ND1-CD2 3.66Å; H1748-H1924 AromaticContact ND1-CG 3.8Å; H1748-H1924 AromaticContact NE2-CD2 3.79Å; Y1749-H1924 AromaticContact CD2-CD2 3.66Å; Y1749-H1924 AromaticContact CD2-NE2 3.47Å; Y1749-H1924 WeakPolarHBondContact CD2-NE2 3.44Å; Y1749-H1924 AromaticContact CE2-CD2 3.58Å; Y1749-H1924 AromaticContact CE2-NE2 3.61Å
1925	T	33.9	Very low	31.9	Very low	83 Å²	83	118.2 Å²	118.2	51%	0.509	71%	0.707	S	S	.	*			trans	65	165.1	169.1	11.5	0	0	0	0	117.3	C1746 D1747 H1748	C1746-T1925 HydrophobicContact CB-CG2 4.1Å; D1747-T1925 HydrophobicContact CB-CG2 3.96Å; D1747-T1925 PolarHBondContact OD2-N 2.73Å; H1748-T1925 PolarHBondContact ND1-OG1 2.8Å
1926	G	31.6	Very low	31.4	Very low	52 Å²	52	119.1 Å²	119.1	54%	0.536	71%	0.706	S	S	.	*			cis	172.4	160.1	1.5	0	0	0	0	0	109.4
1927	A	30.9	Very low	31.5	Very low	88 Å²	88	119.6 Å²	119.6	73%	0.727	71%	0.709	S	S	*	*			trans	-99.8	167.2	-170.9	0	0	0	0	0	115.3
1928	S	31.1	Very low	31.2	Very low	114 Å²	114	119.2 Å²	119.2	80%	0.797	71%	0.712	S	S	*	*			trans	78.8	150.1	173.6	-37.2	0	0	0	0	114.4
1929	E	27.3	Very low	31.4	Very low	169 Å²	169	118.3 Å²	118.3	79%	0.79	71%	0.706	S	S	*	*			cis	-160.7	-177.4	-13.7	-133.6	179.8	-164.9	0	0	111
1930	L	31	Very low	31.5	Very low	157 Å²	157	122.1 Å²	122.1	82%	0.822	71%	0.71	S	S	*	*			trans	70.4	132.8	157.6	-71.3	162.7	0	0	0	120.7
1931	S	27	Very low	31.4	Very low	112 Å²	112	116.9 Å²	116.9	78%	0.783	70%	0.704	S	S	*	*			trans	-81.1	152.6	178.3	-34.6	0	0	0	0	113.4
1932	L	31.9	Very low	31.5	Very low	174 Å²	174	115.6 Å²	115.6	91%	0.911	71%	0.712	S	S	*	*			trans	-153.1	177.2	140.1	-110.5	169.7	0	0	0	110.6
1933	S	30.2	Very low	31.6	Very low	101 Å²	101	115.6 Å²	115.6	71%	0.706	72%	0.723	S	S	*	*			trans	-98.4	170.4	-160.1	54.2	0	0	0	0	116.3
1934	H	28.5	Very low	31.8	Very low	167 Å²	167	117.8 Å²	117.8	77%	0.773	73%	0.73	S	S	*	*			trans	-24.9	151.9	153.2	-82.8	-83.7	0	0	0	115.4
1935	P	40.6	Very low	31.7	Very low	110 Å²	110	121.6 Å²	121.6	71%	0.714	76%	0.757	S	S	*	*			cis	-142.5	166.4	39.9	41.2	-22.6	0	0	0	119.7
1936	D	29.2	Very low	31.6	Very low	134 Å²	134	125.1 Å²	125.1	72%	0.717	77%	0.765	S	S	*	*			trans	45.6	126.6	141.7	-53.6	-13.6	0	0	0	124.7
1937	S	31.8	Very low	31.5	Very low	121 Å²	121	128.9 Å²	128.9	85%	0.846	77%	0.769	S	S	*	*			trans	92.6	141.5	137.4	75.7	0	0	0	0	121.6
1938	A	27.8	Very low	31.5	Very low	92 Å²	92	130.4 Å²	130.4	76%	0.76	77%	0.769	S	S	*	*			trans	76.6	148.1	169.3	0	0	0	0	0	120.8
1939	S	36.6	Very low	31.3	Very low	100 Å²	100	132 Å²	132	70%	0.699	77%	0.768	S	S	*	*			trans	55.8	114.8	156.4	51.8	0	0	0	0	122.4
1940	D	31.6	Very low	31.2	Very low	148 Å²	148	129.7 Å²	129.7	79%	0.791	77%	0.765	S	S	*	*				76.6	132.4	120.7	-63.3	-44.8	0	0	0	126.1
1941	C	31.3	Very low	30.9	Very low	109 Å²	109	131.8 Å²	131.8	74%	0.736	76%	0.762	S	S	*	*			trans	71.7	117.9	136.4	-72.5	0	0	0	0	124.2
1942	S	33.2	Very low	30.7	Very low	130 Å²	130	138 Å²	138	91%	0.909	77%	0.769	S	S	*	*			trans	68.7	159	146.8	75	0	0	0	0	118.7
1943	G	34.5	Very low	31	Very low	64 Å²	64	134.7 Å²	134.7	66%	0.66	76%	0.758	S	S	*	*			cis	-177.9	126.5	-10.2	0	0	0	0	0	108.4
1944	H	33.7	Very low	30.7	Very low	195 Å²	195	135.2 Å²	135.2	90%	0.903	76%	0.761	S	S	*	*				70.4	161.2	87.3	-98.6	61.5	0	0	0	116.3
1945	V	32.2	Very low	30.5	Very low	133 Å²	133	134.2 Å²	134.2	81%	0.806	76%	0.761	S	S	*	*			trans	70.1	147.8	178.6	165.8	0	0	0	0	113.6
1946	K	31.5	Very low	30	Very low	157 Å²	157	134 Å²	134	68%	0.683	75%	0.753	S	S	*	*			cis	-165.9	172.8	-20	-106.3	-175.2	175.9	-117.8	0	106
1947	E	30.3	Very low	30.1	Very low	131 Å²	131	135.2 Å²	135.2	61%	0.612	75%	0.753	S	S	*	*			cis	-157.3	159.1	-23.8	-130.5	148.7	-142.7	0	0	104.6
1948	V	29.2	Very low	29.8	Very low	121 Å²	121	138.9 Å²	138.9	73%	0.733	75%	0.749	S	S	*	*			cis	72.9	113.5	31.7	166.3	0	0	0	0	113.4
1949	L	26.9	Very low	29.7	Very low	148 Å²	148	143.4 Å²	143.4	78%	0.775	75%	0.747	S	S	*	*			cis	-166.3	148.9	-8.5	-133.9	177.2	0	0	0	111.1
1950	T	25.6	Very low	29.4	Very low	119 Å²	119	149.7 Å²	149.7	73%	0.73	76%	0.755	S	S	*	*			trans	-159	133.1	156.5	2.5	0	0	0	0	115.7
1951	R	25.1	Very low	29.2	Very low	202 Å²	202	152.7 Å²	152.7	76%	0.762	76%	0.755	S	S	*	*			trans	21.7	108.3	156.3	-62.2	-178.5	176.7	-154.9	-2.4	121.2
1952	R	23	Very low	29.1	Very low	242 Å²	242	152 Å²	152	91%	0.913	75%	0.75	S	S	*	*			trans	66.6	168.6	148.8	-72.6	-176.6	175.7	-179.7	0.8	117.3
1953	P	38.2	Very low	29	Very low	105 Å²	105	152.8 Å²	152.8	68%	0.682	74%	0.744	S	S	*	*			cis	-126.7	175.2	-28.2	36.8	-22.1	0	0	0	113.4
1954	S	23.7	Very low	29.2	Very low	112 Å²	112	154.2 Å²	154.2	78%	0.783	75%	0.745	S	S	*	*			trans	63.6	174.3	168.4	78.7	0	0	0	0	114.5
1955	L	25.1	Very low	29.2	Very low	145 Å²	145	151.9 Å²	151.9	76%	0.759	73%	0.734	S	S	*	*			cis	-142.2	-178.6	-7.3	-161.3	75.9	0	0	0	107.1
1956	D	30.2	Very low	29.6	Very low	105 Å²	105	152.9 Å²	152.9	56%	0.561	73%	0.73	S	S	*	*			trans	73.7	126.7	153.8	-95.5	6.7	0	0	0	121.9
1957	K	31.2	Very low	29.5	Very low	161 Å²	161	151.5 Å²	151.5	70%	0.7	73%	0.725	S	S	*	*				51.4	112.4	127.8	-60.2	178.5	-175.8	80.6	0	118.2
1958	Y	24.9	Very low	29.4	Very low	197 Å²	197	152.7 Å²	152.7	77%	0.773	72%	0.724	S	S	*	*				60.9	101.1	61.4	-151.8	-84	0	0	0	113.6
1959	R	26.2	Very low	29.6	Very low	187 Å²	187	154.5 Å²	154.5	71%	0.706	72%	0.718	S	S	*	*			trans	64.9	114.7	178.5	-61.1	170.6	171.2	172.5	-2.6	116.4
1960	R	30.7	Very low	29.9	Very low	232 Å²	232	153.8 Å²	153.8	88%	0.875	71%	0.71	S	S	*	*				-130.8	147.8	81.1	-64.7	175.9	-159.7	-172.6	4.7	107.1
1961	R	27.3	Very low	30.3	Very low	211 Å²	211	153.6 Å²	153.6	80%	0.796	70%	0.701	S	S	*	*			cis	66.2	58.1	13	-152.3	-168.9	-168.4	-175.9	4.8	115.5
1962	C	28.8	Very low	30.8	Very low	94 Å²	94	150.4 Å²	150.4	64%	0.635	69%	0.694	S	S	*	*			trans	-105	133.9	140.4	-68.5	0	0	0	0	106
1963	N	31.4	Very low	31.5	Very low	147 Å²	147	145 Å²	145	79%	0.786	68%	0.679	S	S	*	*				73.3	137.9	88.5	-53.1	-7.3	0	0	0	111.4
1964	S	38.2	Very low	31.3	Very low	95 Å²	95	147 Å²	147	66%	0.664	68%	0.679	S	S	*	*			cis	-126.3	145.8	3.6	77.1	0	0	0	0	109.6
1965	Q	34.2	Very low	31.8	Very low	145 Å²	145	146.8 Å²	146.8	68%	0.678	67%	0.665	S	S	*	*				68.5	168.7	86.3	-58.1	175.7	-86.8	0	0	115.8
1966	H	39.6	Very low	32.2	Very low	155 Å²	155	147.7 Å²	147.7	72%	0.718	67%	0.666	S	S	*	*			trans	31.9	89.5	157.6	-61.9	-56	0	0	0	116.9
1967	H	29	Very low	32.2	Very low	128 Å²	128	148.1 Å²	148.1	59%	0.593	67%	0.668	S	S	*	*			cis	57.1	117.6	27.8	179.8	67.6	0	0	0	113.3
1968	R	30.1	Very low	32.1	Very low	155 Å²	155	145.2 Å²	145.2	59%	0.585	67%	0.668	S	S	*	*			trans	76.6	160.2	172.6	-74.1	166	171.6	155.6	1.7	115.8
1969	R	31.7	Very low	32.4	Very low	160 Å²	160	144.7 Å²	144.7	60%	0.604	67%	0.67	S	S	*	*			cis	-139.4	143.1	8	-126.7	143.4	177.4	155	0.6	110.1	H1971	R1969-H1971 WeakPolarHBondContact CD-NE2 3.37Å; R1969-H1971 WeakPolarHBondContact CG-NE2 3.15Å; R1969-H1971 PolarHBondContact NE-NE2 2.8Å; R1969-H1971 VanDerWaalsContact NE-NE2 3.19Å
1970	H	32.9	Very low	32.6	Very low	132 Å²	132	142.4 Å²	142.4	61%	0.611	67%	0.671	S	S	*	*				38.5	151	94	-38.9	-50.7	0	0	0	115.6
1971	H	35.2	Very low	32.4	Very low	116 Å²	116	137.7 Å²	137.7	54%	0.537	66%	0.663	S	S	.	*				169.9	172.4	84.7	-94.8	-46.3	0	0	0	110	R1969	R1969-H1971 WeakPolarHBondContact CD-NE2 3.37Å; R1969-H1971 WeakPolarHBondContact CG-NE2 3.15Å; R1969-H1971 PolarHBondContact NE-NE2 2.8Å; R1969-H1971 VanDerWaalsContact NE-NE2 3.19Å
1972	H	36.1	Very low	32.4	Very low	135 Å²	135	137 Å²	137	63%	0.625	66%	0.661	S	S	*	*			cis	-175.2	164.6	-27.3	-111.4	7.4	0	0	0	109.3
1973	H	36.5	Very low	32.5	Very low	128 Å²	128	139.1 Å²	139.1	59%	0.593	66%	0.662	S	S	*	*			cis	-160.6	-48.5	-19	-173	-18	0	0	0	114.8
1974	H	35.3	Very low	32.2	Very low	147 Å²	147	138.3 Å²	138.3	68%	0.681	65%	0.653	S	S	*	*				-116.5	156.6	-114.9	-97.5	-37.4	0	0	0	113.3
1975	H	33.6	Very low	31.7	Very low	107 Å²	107	139.6 Å²	139.6	50%	0.495	65%	0.649	S	S	.	*			cis	-147.4	-61.1	-8.2	176.7	0.3	0	0	0	113.9	N1977	H1975-N1977 PolarHBondContact CE1-OD1 3.32Å
1976	H	32.8	Very low	31.5	Very low	165 Å²	165	142.2 Å²	142.2	76%	0.764	65%	0.654	S	S	*	*				-111.9	152.4	-80	-128.4	-64.8	0	0	0	113.1
1977	N	30	Very low	30.9	Very low	113 Å²	113	141.4 Å²	141.4	60%	0.604	65%	0.651	S	S	*	*			trans	-60.4	165.6	173.7	-61.6	-24.8	0	0	0	113.1	H1975	H1975-N1977 PolarHBondContact CE1-OD1 3.32Å
1978	S	29.5	Very low	30.9	Very low	100 Å²	100	140.6 Å²	140.6	70%	0.699	65%	0.651	S	S	*	*			cis	176.7	153	-7.6	47.1	0	0	0	0	110.2
1979	K	31.5	Very low	30.7	Very low	187 Å²	187	140.5 Å²	140.5	81%	0.813	66%	0.657	S	S	*	*			trans	168.4	158.3	137.9	-99.8	171.6	-178.4	-179	0	113.5
1980	N	31.3	Very low	30.7	Very low	138 Å²	138	139.7 Å²	139.7	74%	0.738	66%	0.66	S	S	*	*			trans	64.1	135.8	161.3	-61.9	-1.3	0	0	0	117.1
1981	L	25.4	Very low	30.6	Very low	133 Å²	133	140.2 Å²	140.2	70%	0.696	66%	0.662	S	S	*	*				81.3	129.8	55.3	-109.3	95	0	0	0	113.3
1982	Y	28.3	Very low	30.3	Very low	196 Å²	196	141 Å²	141	77%	0.769	67%	0.67	S	S	*	*			trans	60.6	165.8	178.9	-60.1	-59.7	0	0	0	113.8
1983	Q	29.5	Very low	29.9	Very low	139 Å²	139	141.1 Å²	141.1	65%	0.65	67%	0.67	S	S	*	*			cis	-147.9	167	-16.8	-127.5	159.7	-63	0	0	111.1
1984	Q	26.5	Very low	29.5	Very low	130 Å²	130	142 Å²	142	61%	0.607	67%	0.674	S	S	*	*			trans	-3.6	157.9	146.8	-67.2	169.5	-68.9	0	0	122.6
1985	Q	26.5	Very low	29.4	Very low	122 Å²	122	142 Å²	142	57%	0.57	68%	0.679	S	S	*	*			trans	67	145.2	154.6	-66.4	151.8	-60.1	0	0	114.5
1986	Y	31.3	Very low	29.3	Very low	200 Å²	200	142 Å²	142	78%	0.784	69%	0.686	S	S	*	*			cis	-151.4	148.5	37.7	-105	-72.9	0	0	0	106.7
1987	Q	26.1	Very low	29.1	Very low	139 Å²	139	139.7 Å²	139.7	65%	0.65	68%	0.684	S	S	*	*			cis	53.7	145.9	33.3	-67.9	-168.7	-89.1	0	0	113.5
1988	D	28.5	Very low	29.1	Very low	110 Å²	110	140 Å²	140	59%	0.588	69%	0.69	S	S	*	*			cis	-154.1	150.7	-26.8	-94.7	-25.1	0	0	0	106.2
1989	E	27.2	Very low	29.2	Very low	153 Å²	153	140.7 Å²	140.7	72%	0.715	70%	0.695	S	S	*	*			trans	59.2	-178	154.8	-62	174.6	143.1	0	0	116
1990	H	32.1	Very low	29.2	Very low	143 Å²	143	142.7 Å²	142.7	66%	0.662	70%	0.697	S	S	*	*			cis	-129.6	149.5	-0.3	-110.7	-84	0	0	0	108.3
1991	H	29.9	Very low	29.2	Very low	143 Å²	143	142.8 Å²	142.8	66%	0.662	70%	0.697	S	S	*	*				49	156.9	99.4	-69.6	-99.5	0	0	0	116.5
1992	L	29.1	Very low	29.4	Very low	134 Å²	134	143.9 Å²	143.9	70%	0.702	70%	0.702	S	S	*	*			cis	-160.3	172	19.9	-146.2	46.6	0	0	0	106.7
1993	Q	27.7	Very low	29.4	Very low	136 Å²	136	142.5 Å²	142.5	64%	0.636	70%	0.703	S	S	*	*			cis	-155.1	-41	4.8	-157.7	166.5	-55.9	0	0	115.8
1994	H	28.2	Very low	29.3	Very low	146 Å²	146	139.7 Å²	139.7	68%	0.676	70%	0.699	S	S	*	*			trans	-150.7	171.1	-157	-78.8	-59.6	0	0	0	111.8
1995	L	33.2	Very low	29.6	Very low	149 Å²	149	139.6 Å²	139.6	78%	0.78	70%	0.702	S	S	*	*			cis	-141.3	150.6	24.3	-96.9	95.9	0	0	0	115.2
1996	T	30.1	Very low	29.8	Very low	106 Å²	106	139.6 Å²	139.6	65%	0.65	71%	0.706	S	S	*	*			trans	15.2	158.6	144.4	65.1	0	0	0	0	126.4
1997	T	30.2	Very low	29.8	Very low	116 Å²	116	136.5 Å²	136.5	71%	0.712	70%	0.702	S	S	*	*			trans	87.4	96.2	139.5	32	0	0	0	0	123.7
1998	T	29.1	Very low	30.1	Very low	120 Å²	120	138.2 Å²	138.2	74%	0.736	71%	0.707	S	S	*	*				53.6	112.5	123.9	55.5	0	0	0	0	123.8
1999	S	32.1	Very low	30.1	Very low	114 Å²	114	139.9 Å²	139.9	80%	0.797	72%	0.716	S	S	*	*				-168.2	117	118.8	-78.8	0	0	0	0	108.3
2000	R	31.7	Very low	30.5	Very low	229 Å²	229	144.4 Å²	144.4	86%	0.864	74%	0.737	S	S	*	*				62.7	138.6	77.2	-71.8	-161.1	179.5	-179.7	2.1	114.5
2001	I	30.3	Very low	30.4	Very low	141 Å²	141	144.5 Å²	144.5	72%	0.723	74%	0.741	S	S	*	*			cis	-171.7	169.9	-30.2	-120.3	168.7	0	0	0	107.3
2002	L	30.1	Very low	30.4	Very low	156 Å²	156	144.5 Å²	144.5	82%	0.817	75%	0.745	S	S	*	*			trans	75.8	159.8	-171.8	-49.3	-179	0	0	0	113.2
2003	Q	29	Very low	30.5	Very low	166 Å²	166	145.1 Å²	145.1	78%	0.776	75%	0.747	S	S	*	*			cis	-142.3	174.2	-5.4	-146.6	-163.3	-75.3	0	0	110.7
2004	S	27.4	Very low	30.6	Very low	81 Å²	81	145.6 Å²	145.6	57%	0.566	75%	0.754	S	S	*	*			trans	-127.9	149.5	159.2	59.7	0	0	0	0	110.3
2005	N	31.1	Very low	30.8	Very low	128 Å²	128	145.6 Å²	145.6	68%	0.684	76%	0.759	S	S	*	*				169	160.7	126.8	-91.8	20.6	0	0	0	113.4
2006	D	31.5	Very low	30.6	Very low	122 Å²	122	145.4 Å²	145.4	65%	0.652	76%	0.757	S	S	*	*			trans	70.2	103.7	148.2	-60.7	-23.2	0	0	0	124.1
2007	I	30.9	Very low	30.7	Very low	134 Å²	134	148.2 Å²	148.2	69%	0.687	77%	0.765	S	S	*	*				73	138.3	112.1	-67.6	165.4	0	0	0	121
2008	K	32.3	Very low	30.7	Very low	176 Å²	176	150.7 Å²	150.7	77%	0.765	77%	0.769	S	S	*	*			trans	79.7	141.7	163.5	-81	159.1	-169.5	172.6	0	119.5
2009	N	29.9	Very low	30.8	Very low	145 Å²	145	153.3 Å²	153.3	78%	0.775	77%	0.772	S	S	*	*			trans	34.1	142	140.5	-49.3	6.7	0	0	0	119.7
2010	E	34	Very low	30.7	Very low	247 Å²	247	156.8 Å²	156.8	100%	1.154	77%	0.77	S	S	*	*			cis	-116.9	0	15.5	-62	179.7	111.9	0	0	114.7

Retrieved 2,010 of 2,010 residues in 1513.5 ms (Link to these results)

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