A0A5K4F0X2_SCHMA Loading...

SH2 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F0X2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,119 aa.

						>A0A5K4F0X2_SCHMA|A0A5K4F0X2
MPSERRRKLWSLAARAAVKCPDDVEKEVTTQYESSLIKESGSLAKTQDSGVSVDFTYDNQPYSTACSPFISHSYCRISLDTESAENYDYGRLSRGVKRFYDPLQNVTLSADLGDATNIERGRSYVTKRKSVFSIPHIPSHISSASANMRRIRKASKQFDPSIKRGSADTSGLGSSLDWVSLETGQTPFYRKMSSQYVHNPRTIITVHKSLDERQTTRPLVVKKHLTSDDGDTERYLLQQFPLKIYTTTIAPGIPQESFLGRDFVKPSQHRQKLEKLQRPVYQPDYQLETTISTSESGSPYRPKSDIPPSHAIKDPHMITRSFDQAYYAHNIPYNHSNLPTTNIYRSDEGNVPVTYFDRHETINLPIFTETDDNLSRYASGLDDGTREKMLSDMHSRSVHWGPIYRKDQRYYTKDHFWINQQQRKRNEQQKLKTFYRRSRTLGDSAENINTDWKPTRSKTQVKTQLYTTPPPTDEKEAYYNGLLMEQKLKEPHMDFQTFCRLRRLGRFNDKYNFGLDTGIIDESQRLLQESQDSFHLKPTYSTRRRWTSAEIPEVKVSPVFAGSAEMQYDENEREDHKTIEHFSQVYPIDVHNYAKYSTGRKRPYHEQLSPYKQHRIAYEDEVIKRPWSQTHKTERYLTPHRGDSLRKALSLDKPSYMPTPLHIPSTLQQYHHSSHEQLKHPEESLESKFTRQQHFKYHIPYYSSSFDYPSLSSSKTRPLIHPGYIQTYNFFSPIEEKGDFESETKGHPLMSKFPEDNDDIFEKKQKIYPVQIKDDHGLSTHKQKSASHVTTDITDGISNHSSQKKINQSPLKKTISPSASTDDIIPYDRKSFTSYKEVRISESQSYEPNGIKKSVTLSNDINIEQSPQITTRHTTTVPSSGILKVSVHLGESEIQEFAEYWDHSIFSGARITAVCLAGVASVCLVCSVCASTWLYQGYANNITHSGFWKRCNYFNQTCEIMLPFITKHEGWQDGAFFILVLAILLGFLGLSLSVAGHLVYALPKRLYYFHSGGEAHVVAAFVTALSVLIYHITIKLHLRTEGPMNFGEAYGISWFACFLHILAAILLLLDEIINELVNLAGRVHSVRSCLKCIIHTYSRTIQKKRQLFTHYNIKFGNNK
					

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(Predicted Aligned Error values between residue pairs)

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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	50.5	Low	66.6	Low	125 Å²	125	104.5 Å²	104.5	62%	0.616	50%	0.5	S	S	*	.				0	165.1	0	-82.4	-172.5	178.8	0	0	110.3	R5 L9 N1078	M1-R5 HydrophobicContact SD-CG 4.41Å; M1-L9 HydrophobicContact CE-CD1 3.65Å; M1-L9 HydrophobicContact SD-CD1 3.53Å; M1-L9 VanDerWaalsContact SD-CD1 3.53Å; M1-N1078 PolarHBondContact N-OD1 3.45Å; M1-N1078 VanDerWaalsContact N-OD1 3.13Å
2	P	65.2	Low	67	Low	84 Å²	84	105 Å²	105	55%	0.545	51%	0.506	S	S	.	.			trans	-63.3	144.6	162.1	-18.1	32	0	0	0	111.4	E4 R5 R6	P2-E4 VanDerWaalsContact C-N 3.35Å; P2-E4 PolarHBondContact O-N 3.04Å; P2-R5 HydrophobicContact CB-CB 4.47Å; P2-R5 PolarHBondContact O-N 3.43Å; P2-R5 VanDerWaalsContact O-N 3.13Å; P2-R6 PolarHBondContact O-N 3.4Å
3	S	65.3	Low	67.3	Low	93 Å²	93	99.8 Å²	99.8	65%	0.65	49%	0.491	S	S	*	.	H	α-helix	trans	-59.8	-39.7	-177.9	49.3	0	0	0	0	113.1	R5 R6 R7	S3-R5 PolarHBondContact O-N 3.17Å; S3-R6 WeakPolarHBondContact O-CB 3.41Å; S3-R6 PolarHBondContact O-N 2.94Å; S3-R7 PolarHBondContact O-N 3.39Å
4	E	68.3	Low	67.5	Low	137 Å²	137	95.8 Å²	95.8	64%	0.64	48%	0.482	S	S	*	.	H	α-helix	trans	-60.6	-43.3	173.8	-65.7	-169	168	0	0	113	P2 R6 R7 K8	P2-E4 VanDerWaalsContact C-N 3.35Å; P2-E4 PolarHBondContact O-N 3.04Å; E4-R6 VanDerWaalsContact C-N 3.27Å; E4-R6 PolarHBondContact O-N 3.05Å; E4-R7 PolarHBondContact O-N 3.16Å; E4-K8 WeakPolarHBondContact O-CB 3.43Å; E4-K8 WeakPolarHBondContact O-CG 3.29Å; E4-K8 PolarHBondContact O-N 3.4Å
5	R	64.9	Low	67.6	Low	115 Å²	115	102.3 Å²	102.3	43%	0.434	50%	0.498	S	S	.	.	H	α-helix	trans	-67.9	-33	179.3	-163.8	172.6	-176.3	178.4	-0.5	110.4	M1 P2 S3 L9	M1-R5 HydrophobicContact SD-CG 4.41Å; P2-R5 HydrophobicContact CB-CB 4.47Å; P2-R5 PolarHBondContact O-N 3.43Å; P2-R5 VanDerWaalsContact O-N 3.13Å; S3-R5 PolarHBondContact O-N 3.17Å; R5-L9 WeakPolarHBondContact O-CB 3.34Å; R5-L9 PolarHBondContact O-N 2.79Å
6	R	60.1	Low	67.6	Low	53 Å²	53	98.8 Å²	98.8	20%	0.2	49%	0.491	C	S	.	.	H	α-helix	trans	-67.2	-48	171.1	-150	-162.2	-158.2	159.3	9.3	111.9	P2 S3 E4 K8 L9 W10 E1071 E1075	P2-R6 PolarHBondContact O-N 3.4Å; S3-R6 WeakPolarHBondContact O-CB 3.41Å; S3-R6 PolarHBondContact O-N 2.94Å; E4-R6 VanDerWaalsContact C-N 3.27Å; E4-R6 PolarHBondContact O-N 3.05Å; R6-K8 VanDerWaalsContact C-N 3.33Å; R6-K8 PolarHBondContact O-N 3.39Å; R6-L9 PolarHBondContact O-N 3.38Å; R6-W10 VanDerWaalsContact O-CD1 3.23Å; R6-W10 PolarHBondContact O-N 3.43Å; R6-E1071 IonicContact CZ-OE1 3.17Å; R6-E1071 IonicContact NE-OE1 3.62Å; R6-E1071 IonicContact NH1-OE1 3.95Å; R6-E1071 PolarHBondContact NH1-OE1 3.44Å; R6-E1071 IonicContact NH2-OE1 3.85Å; R6-E1075 IonicContact CZ-OE1 3.9Å; R6-E1075 IonicContact NH1-OE1 3.64Å; R6-E1075 PolarHBondContact NH1-OE1 2.79Å; R6-E1075 IonicContact NH2-OE1 3.19Å
7	R	71	Confident	67.4	Low	204 Å²	204	94.4 Å²	94.4	77%	0.77	47%	0.474	S	S	*	.	H	α-helix	trans	-58.6	-42.6	174.8	-80.2	-173.4	171.8	-175.5	-3.7	111.9	S3 E4 W10 S11	S3-R7 PolarHBondContact O-N 3.39Å; E4-R7 PolarHBondContact O-N 3.16Å; R7-W10 PolarHBondContact O-N 2.88Å; R7-S11 WeakPolarHBondContact O-CB 3.45Å; R7-S11 PolarHBondContact O-N 3.23Å; R7-S11 PolarHBondContact O-OG 3.15Å
8	K	72	Confident	67.3	Low	139 Å²	139	96.4 Å²	96.4	60%	0.604	49%	0.492	S	S	*	.	H	α-helix	trans	-61	-48.3	173.5	-75.2	172.2	178.5	169.1	0	111.1	E4 R6 S11 L12	E4-K8 WeakPolarHBondContact O-CB 3.43Å; E4-K8 WeakPolarHBondContact O-CG 3.29Å; E4-K8 PolarHBondContact O-N 3.4Å; R6-K8 VanDerWaalsContact C-N 3.33Å; R6-K8 PolarHBondContact O-N 3.39Å; K8-S11 PolarHBondContact O-N 2.97Å; K8-S11 PolarHBondContact O-OG 2.9Å; K8-L12 VanDerWaalsContact O-CB 3.32Å; K8-L12 WeakPolarHBondContact O-CB 3.33Å; K8-L12 PolarHBondContact O-N 3.05Å
9	L	73.3	Confident	66.7	Low	67 Å²	67	100.9 Å²	100.9	35%	0.351	51%	0.507	S	S	.	.	H	α-helix	trans	-61.3	-45.1	175.6	-89	160.8	0	0	0	113.5	M1 R5 R6 S11 L12 A13	M1-L9 HydrophobicContact CE-CD1 3.65Å; M1-L9 HydrophobicContact SD-CD1 3.53Å; M1-L9 VanDerWaalsContact SD-CD1 3.53Å; R5-L9 WeakPolarHBondContact O-CB 3.34Å; R5-L9 PolarHBondContact O-N 2.79Å; R6-L9 PolarHBondContact O-N 3.38Å; L9-S11 PolarHBondContact O-N 2.73Å; L9-L12 PolarHBondContact O-N 3.05Å; L9-A13 WeakPolarHBondContact O-CB 3.37Å; L9-A13 PolarHBondContact O-N 3.14Å
10	W	71.6	Confident	65.7	Low	76 Å²	76	99.7 Å²	99.7	29%	0.288	51%	0.508	S	S	.	.	H	α-helix	trans	-60.6	-43.8	174	-77.8	123	0	0	0	111.6	R6 R7 L12 A13 A14 L1006	R6-W10 VanDerWaalsContact O-CD1 3.23Å; R6-W10 PolarHBondContact O-N 3.43Å; R7-W10 PolarHBondContact O-N 2.88Å; W10-L12 VanDerWaalsContact C-N 3.28Å; W10-L12 PolarHBondContact O-N 3.07Å; W10-A13 PolarHBondContact O-N 2.76Å; W10-A14 VanDerWaalsContact O-CB 3.3Å; W10-A14 WeakPolarHBondContact O-CB 3.37Å; W10-A14 PolarHBondContact O-N 3.05Å; W10-L1006 HydrophobicContact CH2-CD2 3.84Å; W10-L1006 HydrophobicContact CH2-CG 4.08Å
11	S	70.8	Confident	64.7	Low	57 Å²	57	99.2 Å²	99.2	40%	0.399	51%	0.511	S	S	.	.	H	α-helix	trans	-65.1	-31.7	175.9	75.8	0	0	0	0	113	R7 K8 L9 R15	R7-S11 WeakPolarHBondContact O-CB 3.45Å; R7-S11 PolarHBondContact O-N 3.23Å; R7-S11 PolarHBondContact O-OG 3.15Å; K8-S11 PolarHBondContact O-N 2.97Å; K8-S11 PolarHBondContact O-OG 2.9Å; L9-S11 PolarHBondContact O-N 2.73Å; S11-R15 VanDerWaalsContact O-CB 3.28Å; S11-R15 WeakPolarHBondContact O-CB 3.48Å; S11-R15 WeakPolarHBondContact O-CD 3.04Å; S11-R15 WeakPolarHBondContact O-CG 3.47Å; S11-R15 PolarHBondContact O-N 3.1Å
12	L	70.9	Confident	64.7	Low	110 Å²	110	97.8 Å²	97.8	58%	0.576	51%	0.506	S	S	*	.	H	α-helix	trans	-78.3	-39.4	178.5	-156.5	162.1	0	0	0	110.5	K8 L9 W10 R15 A16	K8-L12 VanDerWaalsContact O-CB 3.32Å; K8-L12 WeakPolarHBondContact O-CB 3.33Å; K8-L12 PolarHBondContact O-N 3.05Å; L9-L12 PolarHBondContact O-N 3.05Å; W10-L12 VanDerWaalsContact C-N 3.28Å; W10-L12 PolarHBondContact O-N 3.07Å; L12-R15 PolarHBondContact O-N 2.71Å; L12-A16 VanDerWaalsContact O-CB 3.28Å; L12-A16 WeakPolarHBondContact O-CB 3.49Å; L12-A16 PolarHBondContact O-N 3.35Å
13	A	71.4	Confident	63.8	Low	38 Å²	38	98.1 Å²	98.1	31%	0.314	50%	0.503	S	S	.	.	H	α-helix	trans	-65.4	-40.4	172	0	0	0	0	0	112	L9 W10 A16 A17	L9-A13 WeakPolarHBondContact O-CB 3.37Å; L9-A13 PolarHBondContact O-N 3.14Å; W10-A13 PolarHBondContact O-N 2.76Å; A13-A16 PolarHBondContact O-N 3.11Å; A13-A17 VanDerWaalsContact O-CB 3.28Å; A13-A17 WeakPolarHBondContact O-CB 3.47Å; A13-A17 PolarHBondContact O-N 2.91Å
14	A	70.4	Confident	63.1	Low	43 Å²	43	99.3 Å²	99.3	36%	0.355	51%	0.506	S	S	.	.	H	α-helix	trans	-65	-45.7	172.6	0	0	0	0	0	111.4	W10 A16 A17 V18	W10-A14 VanDerWaalsContact O-CB 3.3Å; W10-A14 WeakPolarHBondContact O-CB 3.37Å; W10-A14 PolarHBondContact O-N 3.05Å; A14-A16 VanDerWaalsContact C-N 3.29Å; A14-A16 PolarHBondContact O-N 3.29Å; A14-A17 PolarHBondContact O-N 2.8Å; A14-V18 WeakPolarHBondContact O-CG2 3.28Å; A14-V18 PolarHBondContact O-N 3.48Å
15	R	68.9	Low	62.2	Low	194 Å²	194	99.3 Å²	99.3	73%	0.732	51%	0.506	S	S	*	.	H	α-helix	trans	-62.7	-33.2	173.7	-76	171.6	179.3	-157	-2	112.8	S11 L12 K19	S11-R15 VanDerWaalsContact O-CB 3.28Å; S11-R15 WeakPolarHBondContact O-CB 3.48Å; S11-R15 WeakPolarHBondContact O-CD 3.04Å; S11-R15 WeakPolarHBondContact O-CG 3.47Å; S11-R15 PolarHBondContact O-N 3.1Å; L12-R15 PolarHBondContact O-N 2.71Å; R15-K19 WeakPolarHBondContact O-CB 3.19Å; R15-K19 PolarHBondContact O-N 3.36Å
16	A	66.3	Low	61.1	Low	46 Å²	46	100.1 Å²	100.1	38%	0.38	51%	0.513	S	S	.	.	H	α-helix	trans	-71.3	-44.5	173.3	0	0	0	0	0	111.3	L12 A13 A14 V18 K19 C20	L12-A16 VanDerWaalsContact O-CB 3.28Å; L12-A16 WeakPolarHBondContact O-CB 3.49Å; L12-A16 PolarHBondContact O-N 3.35Å; A13-A16 PolarHBondContact O-N 3.11Å; A14-A16 VanDerWaalsContact C-N 3.29Å; A14-A16 PolarHBondContact O-N 3.29Å; A16-V18 VanDerWaalsContact C-N 3.26Å; A16-V18 PolarHBondContact O-N 3.08Å; A16-K19 CarbonylContact O-C 3.55Å; A16-K19 WeakPolarHBondContact O-CA 3.28Å; A16-K19 PolarHBondContact O-N 3.46Å; A16-C20 PolarHBondContact O-N 3.5Å; A16-C20 PolarHBondContact O-SG 3.5Å; A16-C20 VanDerWaalsContact O-SG 3.41Å
17	A	64.7	Low	60.2	Low	24 Å²	24	104.3 Å²	104.3	20%	0.198	54%	0.535	C	S	.	.	H	α-helix	trans	-60.1	-33.4	176.5	0	0	0	0	0	113.5	A13 A14 K19 K1004	A13-A17 VanDerWaalsContact O-CB 3.28Å; A13-A17 WeakPolarHBondContact O-CB 3.47Å; A13-A17 PolarHBondContact O-N 2.91Å; A14-A17 PolarHBondContact O-N 2.8Å; A17-K19 VanDerWaalsContact C-N 3.33Å; A17-K1004 HydrophobicContact CB-CD 4.48Å; A17-K1004 HydrophobicContact CB-CG 3.71Å; A17-K1004 WeakPolarHBondContact O-CE 3.16Å
18	V	65.5	Low	59	Low	131 Å²	131	99.5 Å²	99.5	79%	0.794	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-13.6	173.2	172	0	0	0	0	112.6	A14 A16	A14-V18 WeakPolarHBondContact O-CG2 3.28Å; A14-V18 PolarHBondContact O-N 3.48Å; A16-V18 VanDerWaalsContact C-N 3.26Å; A16-V18 PolarHBondContact O-N 3.08Å
19	K	56.5	Low	57.7	Low	182 Å²	182	96.9 Å²	96.9	79%	0.791	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.1	-2	-175.6	-156.5	176.4	-177.1	-174.7	0	114.5	R15 A16 A17 P21	R15-K19 WeakPolarHBondContact O-CB 3.19Å; R15-K19 PolarHBondContact O-N 3.36Å; A16-K19 CarbonylContact O-C 3.55Å; A16-K19 WeakPolarHBondContact O-CA 3.28Å; A16-K19 PolarHBondContact O-N 3.46Å; A17-K19 VanDerWaalsContact C-N 3.33Å; K19-P21 WeakPolarHBondContact O-CD 3.18Å
20	C	45.7	Very low	56.3	Low	76 Å²	76	97.5 Å²	97.5	51%	0.514	53%	0.53	S	S	.	.	S	Bend	trans	-74.9	116	159.4	-63.4	0	0	0	0	107.9	A16	A16-C20 PolarHBondContact O-N 3.5Å; A16-C20 PolarHBondContact O-SG 3.5Å; A16-C20 VanDerWaalsContact O-SG 3.41Å
21	P	45.6	Very low	54.7	Low	89 Å²	89	101.1 Å²	101.1	58%	0.578	55%	0.55	S	S	*	*			trans	-68.7	142.1	170.2	31.8	-34.8	0	0	0	109.4	K19 D23	K19-P21 WeakPolarHBondContact O-CD 3.18Å; P21-D23 WeakPolarHBondContact CB-OD2 3.35Å; P21-D23 VanDerWaalsContact CG-OD2 3.29Å; P21-D23 WeakPolarHBondContact CG-OD2 3.35Å; P21-D23 PolarHBondContact O-N 2.95Å
22	D	50.3	Low	53.3	Low	95 Å²	95	107.7 Å²	107.7	51%	0.508	57%	0.568	S	S	.	*			trans	-81.8	38.1	-175.3	-51.7	-68.3	0	0	0	112.3	V24 E25 K1004	D22-V24 PolarHBondContact O-N 3.22Å; D22-E25 PolarHBondContact O-N 3.19Å; D22-K1004 IonicContact OD1-NZ 3.08Å; D22-K1004 PolarHBondContact OD1-NZ 3.38Å; D22-K1004 VanDerWaalsContact OD1-NZ 3.08Å
23	D	46.7	Very low	51.8	Low	91 Å²	91	110.3 Å²	110.3	49%	0.487	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-67.1	-18.9	-172.7	-67.1	-38.1	0	0	0	113.5	P21	P21-D23 WeakPolarHBondContact CB-OD2 3.35Å; P21-D23 VanDerWaalsContact CG-OD2 3.29Å; P21-D23 WeakPolarHBondContact CG-OD2 3.35Å; P21-D23 PolarHBondContact O-N 2.95Å
24	V	50.9	Low	50	Low	118 Å²	118	113.3 Å²	113.3	72%	0.715	60%	0.596	S	S	*	*	H	α-helix	trans	-72	-27.1	177	-174.9	0	0	0	0	112.4	D22 K26	D22-V24 PolarHBondContact O-N 3.22Å; V24-K26 VanDerWaalsContact C-N 3.34Å
25	E	47.7	Very low	48.4	Very low	137 Å²	137	115.8 Å²	115.8	64%	0.64	61%	0.611	S	S	*	*	H	α-helix	trans	-82.1	-13.4	-179	-64	-171.8	175.4	0	0	112.8	D22 T29	D22-E25 PolarHBondContact O-N 3.19Å; E25-T29 PolarHBondContact O-OG1 2.88Å
26	K	43.8	Very low	46.8	Very low	133 Å²	133	113.9 Å²	113.9	58%	0.578	61%	0.614	S	S	*	*	H	α-helix	trans	-81.5	-36.1	176.8	-74.3	176.1	-178.3	164.8	0	114.1	V24 T29 T30	V24-K26 VanDerWaalsContact C-N 3.34Å; K26-T29 WeakPolarHBondContact CA-OG1 3.28Å; K26-T29 PolarHBondContact O-OG1 2.83Å; K26-T29 VanDerWaalsContact O-OG1 3.14Å; K26-T30 WeakPolarHBondContact O-CB 3.45Å; K26-T30 WeakPolarHBondContact O-CG2 3.49Å; K26-T30 PolarHBondContact O-N 3.47Å; K26-T30 PolarHBondContact O-OG1 3.19Å
27	E	40.4	Very low	45.3	Very low	140 Å²	140	119.5 Å²	119.5	65%	0.654	64%	0.636	S	S	*	*	H	α-helix	trans	-66.7	-39.4	177.9	-70.9	-164.7	130.9	0	0	111.6	T29 T30 Q31	E27-T29 PolarHBondContact O-N 3.27Å; E27-T30 PolarHBondContact O-OG1 3.03Å; E27-Q31 WeakPolarHBondContact O-CG 3.49Å; E27-Q31 PolarHBondContact O-N 2.79Å; E27-Q31 VanDerWaalsContact O-N 3.11Å
28	V	45.1	Very low	43.9	Very low	103 Å²	103	127.6 Å²	127.6	62%	0.624	67%	0.667	S	S	*	*	H	α-helix	trans	-68.7	-34.4	-179	-176.6	0	0	0	0	112.4
29	T	45.4	Very low	42.5	Very low	84 Å²	84	129.9 Å²	129.9	52%	0.515	67%	0.669	S	S	.	*	H	α-helix	trans	-75.1	-46.9	175.4	38.5	0	0	0	0	111.8	E25 K26 E27 Q31 Y32 E33	E25-T29 PolarHBondContact O-OG1 2.88Å; K26-T29 WeakPolarHBondContact CA-OG1 3.28Å; K26-T29 PolarHBondContact O-OG1 2.83Å; K26-T29 VanDerWaalsContact O-OG1 3.14Å; E27-T29 PolarHBondContact O-N 3.27Å; T29-Q31 VanDerWaalsContact C-N 3.35Å; T29-Q31 PolarHBondContact O-N 2.87Å; T29-Y32 PolarHBondContact O-N 3.31Å; T29-E33 PolarHBondContact O-N 3.34Å
30	T	43	Very low	41.6	Very low	80 Å²	80	127.2 Å²	127.2	49%	0.491	67%	0.673	S	S	.	*	H	α-helix	trans	-66.9	-28.5	-178.3	51.8	0	0	0	0	114.6	K26 E27 Y32 S34	K26-T30 WeakPolarHBondContact O-CB 3.45Å; K26-T30 WeakPolarHBondContact O-CG2 3.49Å; K26-T30 PolarHBondContact O-N 3.47Å; K26-T30 PolarHBondContact O-OG1 3.19Å; E27-T30 PolarHBondContact O-OG1 3.03Å; T30-Y32 VanDerWaalsContact C-N 3.34Å; T30-Y32 PolarHBondContact O-N 3.28Å; T30-S34 PolarHBondContact O-OG 2.99Å
31	Q	39	Very low	41.1	Very low	152 Å²	152	126.9 Å²	126.9	71%	0.71	68%	0.683	S	S	*	*	H	α-helix	trans	-70.9	-24.7	174.5	-77.6	-167.4	-7.5	0	0	114	E27 T29	E27-Q31 WeakPolarHBondContact O-CG 3.49Å; E27-Q31 PolarHBondContact O-N 2.79Å; E27-Q31 VanDerWaalsContact O-N 3.11Å; T29-Q31 VanDerWaalsContact C-N 3.35Å; T29-Q31 PolarHBondContact O-N 2.87Å
32	Y	40.1	Very low	40.5	Very low	196 Å²	196	128 Å²	128	77%	0.769	69%	0.693	S	S	*	*	H	α-helix	trans	-88.9	-24.8	-179.3	-110.1	-84.8	0	0	0	114.3	T29 T30	T29-Y32 PolarHBondContact O-N 3.31Å; T30-Y32 VanDerWaalsContact C-N 3.34Å; T30-Y32 PolarHBondContact O-N 3.28Å
33	E	39.4	Very low	39.7	Very low	164 Å²	164	131.5 Å²	131.5	77%	0.766	71%	0.71	S	S	*	*	H	α-helix	trans	-82.1	-18.3	175.8	-67.1	-170.3	126.7	0	0	113.6	T29 S35	T29-E33 PolarHBondContact O-N 3.34Å; E33-S35 PolarHBondContact O-N 2.84Å; E33-S35 VanDerWaalsContact O-N 3.08Å
34	S	35.3	Very low	39.1	Very low	101 Å²	101	131.1 Å²	131.1	71%	0.706	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	16.7	-175.3	-60.4	0	0	0	0	115.4	T30	T30-S34 PolarHBondContact O-OG 2.99Å
35	S	35.5	Very low	38.4	Very low	96 Å²	96	134.5 Å²	134.5	67%	0.671	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.2	22.1	-174.5	61.9	0	0	0	0	115.9	E33	E33-S35 PolarHBondContact O-N 2.84Å; E33-S35 VanDerWaalsContact O-N 3.08Å
36	L	34.8	Very low	38	Very low	154 Å²	154	132.9 Å²	132.9	81%	0.806	73%	0.725	S	S	*	*			trans	-127.6	35.8	177.9	-118.5	168.9	0	0	0	114.5	K38	L36-K38 PolarHBondContact O-N 2.9Å
37	I	35.8	Very low	37.7	Very low	164 Å²	164	134.1 Å²	134.1	84%	0.841	73%	0.733	S	S	*	*			trans	-80	111.6	162.9	-59.4	174.7	0	0	0	108.3
38	K	35.6	Very low	37.4	Very low	193 Å²	193	133.4 Å²	133.4	84%	0.839	73%	0.733	S	S	*	*			trans	-145.6	134.9	159.4	-150.6	174.1	-172.1	-178.6	0	111.2	L36	L36-K38 PolarHBondContact O-N 2.9Å
39	E	35.7	Very low	37.3	Very low	180 Å²	180	134.3 Å²	134.3	84%	0.841	74%	0.744	S	S	*	*			trans	-79.4	140.6	-165.6	-56.5	135	120.6	0	0	113.2
40	S	38.3	Very low	36.7	Very low	125 Å²	125	133.9 Å²	133.9	87%	0.874	76%	0.757	S	S	*	*			trans	-156.6	134.4	139.6	46	0	0	0	0	107.3
41	G	35	Very low	36.4	Very low	70 Å²	70	137 Å²	137	72%	0.722	78%	0.775	S	S	*	*			trans	-135.9	-172.1	-174.3	0	0	0	0	0	112.1
42	S	33	Very low	36	Very low	113 Å²	113	134.4 Å²	134.4	79%	0.79	77%	0.774	S	S	*	*			trans	69.2	124.5	-175.9	-149.6	0	0	0	0	112.7
43	L	32.7	Very low	36	Very low	167 Å²	167	131.6 Å²	131.6	87%	0.874	78%	0.776	S	S	*	*			cis	-142	169.5	37.9	-109.4	111.9	0	0	0	113.2
44	A	35.3	Very low	35.6	Very low	84 Å²	84	129.5 Å²	129.5	69%	0.694	77%	0.771	S	S	*	*			trans	-103.8	158.9	179.3	0	0	0	0	0	113.2
45	K	36.3	Very low	35.7	Very low	188 Å²	188	134.1 Å²	134.1	82%	0.817	78%	0.778	S	S	*	*				-176.1	150.5	121.2	-106.1	177.5	179.1	-177.9	0	115.2
46	T	38.2	Very low	35.9	Very low	103 Å²	103	134.5 Å²	134.5	63%	0.632	78%	0.777	S	S	*	*			trans	62.1	112.3	149.9	50.8	0	0	0	0	119.2
47	Q	38.8	Very low	35.9	Very low	160 Å²	160	136.3 Å²	136.3	75%	0.748	77%	0.774	S	S	*	*				76.3	146.9	84.1	-72.7	-167	-79.6	0	0	113.3
48	D	33.3	Very low	36	Very low	125 Å²	125	135.1 Å²	135.1	67%	0.668	77%	0.77	S	S	*	*			cis	-163.9	-179	-17.8	-108.4	-22.6	0	0	0	109
49	S	42.9	Very low	36	Very low	122 Å²	122	131.4 Å²	131.4	85%	0.853	76%	0.759	S	S	*	*			trans	77.6	131.7	177.7	77.8	0	0	0	0	116.2
50	G	32.3	Very low	36.1	Very low	75 Å²	75	131.4 Å²	131.4	77%	0.773	76%	0.759	S	S	*	*			cis	120.2	91.9	-13.3	0	0	0	0	0	114.6
51	V	36.2	Very low	35.9	Very low	145 Å²	145	130.4 Å²	130.4	88%	0.879	75%	0.75	S	S	*	*			trans	-138.5	122.1	159.5	178.4	0	0	0	0	107.2
52	S	31.6	Very low	35.8	Very low	97 Å²	97	138.2 Å²	138.2	68%	0.678	76%	0.759	S	S	*	*			trans	-124.6	156	174	54	0	0	0	0	109.9
53	V	40.5	Very low	35.5	Very low	137 Å²	137	138.7 Å²	138.7	83%	0.83	76%	0.763	S	S	*	*			trans	-132.5	111.6	168.2	180	0	0	0	0	107.3
54	D	31.3	Very low	35.6	Very low	121 Å²	121	137 Å²	137	65%	0.647	76%	0.759	S	S	*	*			trans	-83.5	146.6	-177.3	-65.7	-74.6	0	0	0	112.6
55	F	37.4	Very low	35.2	Very low	197 Å²	197	137.8 Å²	137.8	86%	0.864	77%	0.766	S	S	*	*			trans	-142	87.3	143.3	-90.9	-68.9	0	0	0	110.3
56	T	38.4	Very low	34.9	Very low	105 Å²	105	134.9 Å²	134.9	64%	0.644	77%	0.768	S	S	*	*			trans	0.5	145.4	131.3	47.4	0	0	0	0	117.7
57	Y	35	Very low	34.4	Very low	191 Å²	191	134.5 Å²	134.5	75%	0.749	77%	0.769	S	S	*	*			cis	-168.3	141.4	-10.9	-145	-113.6	0	0	0	106.2
58	D	37.5	Very low	34.1	Very low	139 Å²	139	132.1 Å²	132.1	74%	0.743	77%	0.768	S	S	*	*				172.2	102.6	127.8	-99.8	-33.8	0	0	0	114.1
59	N	37	Very low	33.9	Very low	115 Å²	115	135.7 Å²	135.7	62%	0.615	78%	0.778	S	S	*	*				59.7	108.2	127.5	-78.2	-59.7	0	0	0	122.8
60	Q	36.3	Very low	33.4	Very low	180 Å²	180	136.6 Å²	136.6	84%	0.841	77%	0.771	S	S	*	*			trans	102.6	143.2	137.1	-66.4	-165.1	4.5	0	0	120
61	P	34.6	Very low	33.2	Very low	105 Å²	105	138.6 Å²	138.6	68%	0.682	77%	0.773	S	S	*	*			trans	-132.7	141.5	-137.9	37.7	-19.5	0	0	0	115.8
62	Y	32.8	Very low	32.9	Very low	233 Å²	233	138.4 Å²	138.4	91%	0.914	76%	0.763	S	S	*	*			trans	-145.5	146.3	154.8	-91.3	-73.2	0	0	0	111	T64	Y62-T64 PolarHBondContact O-N 3.15Å
63	S	27.3	Very low	32.9	Very low	124 Å²	124	139.3 Å²	139.3	87%	0.867	77%	0.769	S	S	*	*			trans	-61.7	130.3	-179.5	-54.5	0	0	0	0	111.8
64	T	34.1	Very low	32.5	Very low	130 Å²	130	142.3 Å²	142.3	80%	0.798	77%	0.767	S	S	*	*			trans	-148.4	125.4	164.1	-44.2	0	0	0	0	109.7	Y62	Y62-T64 PolarHBondContact O-N 3.15Å
65	A	27.1	Very low	32.3	Very low	101 Å²	101	141.8 Å²	141.8	84%	0.835	77%	0.771	S	S	*	*			trans	-89	124.6	167.2	0	0	0	0	0	108.8
66	C	30.3	Very low	31.9	Very low	127 Å²	127	143.8 Å²	143.8	86%	0.858	77%	0.773	S	S	*	*			trans	-158.8	162.3	160	-137.4	0	0	0	0	112.3
67	S	27.1	Very low	31.4	Very low	96 Å²	96	145.9 Å²	145.9	67%	0.671	78%	0.779	S	S	*	*			trans	-92.8	159.5	-170.9	51.9	0	0	0	0	114
68	P	32.3	Very low	31	Very low	109 Å²	109	140.5 Å²	140.5	71%	0.708	77%	0.77	S	S	*	*	S	Bend	trans	-83.5	117.1	161.7	-6.9	25.4	0	0	0	111.7
69	F	30.3	Very low	30.6	Very low	201 Å²	201	141.2 Å²	141.2	88%	0.882	77%	0.773	S	S	*	*			trans	55	86.1	147	-52.9	-69.2	0	0	0	120.5
70	I	31.6	Very low	30.2	Very low	141 Å²	141	142.1 Å²	142.1	72%	0.723	78%	0.777	S	S	*	*			trans	-98.4	128.6	142.3	-66.9	174.5	0	0	0	108.3	H72	I70-H72 PolarHBondContact O-N 3.26Å; I70-H72 VanDerWaalsContact O-N 3.07Å
71	S	28.2	Very low	29.9	Very low	116 Å²	116	138.5 Å²	138.5	81%	0.811	77%	0.768	S	S	*	*			trans	-79.7	84.8	-178.7	48.4	0	0	0	0	112.7	S73	S71-S73 PolarHBondContact O-N 3.35Å
72	H	31.3	Very low	29.6	Very low	141 Å²	141	142.6 Å²	142.6	65%	0.653	78%	0.778	S	S	*	*			trans	-68.6	99.3	175	-84.9	-98	0	0	0	113	I70 Y74	I70-H72 PolarHBondContact O-N 3.26Å; I70-H72 VanDerWaalsContact O-N 3.07Å; H72-Y74 HydrophobicContact CB-CD2 4.17Å; H72-Y74 HydrophobicContact CB-CE2 4.11Å; H72-Y74 PolarHBondContact O-N 2.79Å
73	S	31.4	Very low	29.3	Very low	117 Å²	117	137.1 Å²	137.1	82%	0.818	77%	0.774	S	S	*	*			trans	-80.3	92.4	164	48.1	0	0	0	0	110.8	S71 C75	S71-S73 PolarHBondContact O-N 3.35Å; S73-C75 PolarHBondContact O-N 3.39Å
74	Y	31.4	Very low	29.5	Very low	199 Å²	199	135.4 Å²	135.4	78%	0.78	77%	0.767	S	S	*	*			trans	-66.3	90	175.2	-88.4	-92.1	0	0	0	112.2	H72 R76	H72-Y74 HydrophobicContact CB-CD2 4.17Å; H72-Y74 HydrophobicContact CB-CE2 4.11Å; H72-Y74 PolarHBondContact O-N 2.79Å; Y74-R76 PolarHBondContact O-N 2.9Å
75	C	28.1	Very low	29.2	Very low	110 Å²	110	137.4 Å²	137.4	74%	0.743	77%	0.767	S	S	*	*			trans	-89.4	91.6	162.1	-165.8	0	0	0	0	109.6	S73 I77	S73-C75 PolarHBondContact O-N 3.39Å; C75-I77 PolarHBondContact O-N 2.98Å; C75-I77 VanDerWaalsContact O-N 3.15Å
76	R	27.5	Very low	29.3	Very low	239 Å²	239	139.2 Å²	139.2	90%	0.902	76%	0.763	S	S	*	*			trans	-62	113.3	168.6	-85.2	179.9	167.9	156.1	-5	109.3	Y74	Y74-R76 PolarHBondContact O-N 2.9Å
77	I	27.8	Very low	29.4	Very low	149 Å²	149	144.8 Å²	144.8	76%	0.764	77%	0.767	S	S	*	*			trans	-108.4	124.5	152.6	-63.5	177.3	0	0	0	104.9	C75 L79	C75-I77 PolarHBondContact O-N 2.98Å; C75-I77 VanDerWaalsContact O-N 3.15Å; I77-L79 PolarHBondContact O-N 3.41Å
78	S	28	Very low	29.5	Very low	79 Å²	79	146.5 Å²	146.5	55%	0.552	77%	0.769	S	S	*	*			trans	-63.7	128.4	175.6	43.1	0	0	0	0	110	D80	S78-D80 VanDerWaalsContact C-N 3.32Å; S78-D80 WeakPolarHBondContact CB-OD1 3.4Å; S78-D80 WeakPolarHBondContact CB-OD2 3.49Å; S78-D80 PolarHBondContact O-N 3.3Å; S78-D80 PolarHBondContact OG-OD2 2.91Å
79	L	28	Very low	29.3	Very low	154 Å²	154	150.5 Å²	150.5	81%	0.806	77%	0.771	S	S	*	*			trans	-80.5	93.1	147.5	-95.8	140.6	0	0	0	105.4	I77 T81	I77-L79 PolarHBondContact O-N 3.41Å; L79-T81 HydrophobicContact CD2-CG2 4.29Å; L79-T81 PolarHBondContact O-N 3.08Å
80	D	28.4	Very low	29.3	Very low	133 Å²	133	144.8 Å²	144.8	71%	0.711	77%	0.769	S	S	*	*			trans	-74.3	74.3	167.8	-63.6	-48.7	0	0	0	108.1	S78 E82	S78-D80 VanDerWaalsContact C-N 3.32Å; S78-D80 WeakPolarHBondContact CB-OD1 3.4Å; S78-D80 WeakPolarHBondContact CB-OD2 3.49Å; S78-D80 PolarHBondContact O-N 3.3Å; S78-D80 PolarHBondContact OG-OD2 2.91Å; D80-E82 VanDerWaalsContact C-N 3.3Å; D80-E82 PolarHBondContact O-N 3.48Å; D80-E82 VanDerWaalsContact O-N 3.16Å
81	T	30.1	Very low	29.2	Very low	105 Å²	105	148 Å²	148	64%	0.644	77%	0.772	S	S	*	*			trans	-77.6	84.4	165.1	45.7	0	0	0	0	108.1	L79 S83	L79-T81 HydrophobicContact CD2-CG2 4.29Å; L79-T81 PolarHBondContact O-N 3.08Å; T81-S83 PolarHBondContact O-N 3.08Å; T81-S83 PolarHBondContact O-OG 3.28Å
82	E	29	Very low	29.4	Very low	191 Å²	191	150.7 Å²	150.7	89%	0.893	78%	0.776	S	S	*	*			trans	-57.5	113.4	169.4	-80.5	-167.8	129.3	0	0	109.5	D80	D80-E82 VanDerWaalsContact C-N 3.3Å; D80-E82 PolarHBondContact O-N 3.48Å; D80-E82 VanDerWaalsContact O-N 3.16Å
83	S	26.7	Very low	29.4	Very low	118 Å²	118	148.5 Å²	148.5	83%	0.825	78%	0.777	S	S	*	*			trans	-103.5	93.8	177.8	18.4	0	0	0	0	108.1	T81	T81-S83 PolarHBondContact O-N 3.08Å; T81-S83 PolarHBondContact O-OG 3.28Å
84	A	31.4	Very low	29.4	Very low	88 Å²	88	154.9 Å²	154.9	73%	0.727	78%	0.783	S	S	*	*			trans	-150.1	110.2	162.8	0	0	0	0	0	105.1
85	E	28.3	Very low	29.3	Very low	172 Å²	172	149 Å²	149	80%	0.804	78%	0.784	S	S	*	*				52.2	126.8	61.4	-60.7	-158.3	160.1	0	0	113.5
86	N	29.1	Very low	29.5	Very low	138 Å²	138	150.3 Å²	150.3	74%	0.738	79%	0.788	S	S	*	*			trans	65.2	94.8	176.3	-50.1	-65.7	0	0	0	116.2
87	Y	30.6	Very low	29.6	Very low	244 Å²	244	147.2 Å²	147.2	96%	0.957	78%	0.781	S	S	*	*				-152.4	134.6	109.5	-96.5	-67.4	0	0	0	109.5
88	D	30.6	Very low	29.5	Very low	132 Å²	132	150 Å²	150	71%	0.706	78%	0.781	S	S	*	*			trans	-135.5	158.5	-165.8	-164.8	9.5	0	0	0	111.9
89	Y	27.9	Very low	29.6	Very low	194 Å²	194	154 Å²	154	76%	0.761	79%	0.79	S	S	*	*			trans	58.8	126.6	177.4	-75.8	-81.9	0	0	0	119.8
90	G	30.5	Very low	29.7	Very low	81 Å²	81	156.7 Å²	156.7	84%	0.835	79%	0.79	S	S	*	*			trans	-160.3	28.9	173.9	0	0	0	0	0	115	L92	G90-L92 PolarHBondContact O-N 3.41Å
91	R	29.3	Very low	29.8	Very low	208 Å²	208	157.3 Å²	157.3	79%	0.785	79%	0.794	S	S	*	*			trans	-55.7	127	-171.3	174.9	-159.8	-79.5	174.4	-5.9	113.8
92	L	32.5	Very low	30.1	Very low	172 Å²	172	157.4 Å²	157.4	90%	0.901	80%	0.796	S	S	*	*			trans	-132.5	126.8	146.5	-99.4	171.7	0	0	0	111.3	G90	G90-L92 PolarHBondContact O-N 3.41Å
93	S	30.8	Very low	30.1	Very low	96 Å²	96	156.5 Å²	156.5	67%	0.671	80%	0.797	S	S	*	*			trans	-148.5	126.3	-177.6	-44.8	0	0	0	0	111.2
94	R	32.4	Very low	30.2	Very low	251 Å²	251	158.3 Å²	158.3	95%	0.947	79%	0.792	S	S	*	*			trans	-146.1	120.8	160.7	-76.6	179.3	176.7	172.9	-1.6	104.8
95	G	29.3	Very low	29.9	Very low	76 Å²	76	160.9 Å²	160.9	78%	0.784	79%	0.793	S	S	*	*				85.3	125.9	80	0	0	0	0	0	108.2
96	V	32.1	Very low	30	Very low	137 Å²	137	158.9 Å²	158.9	83%	0.83	79%	0.793	S	S	*	*			cis	-149.4	126.4	34.4	169.1	0	0	0	0	107
97	K	29.1	Very low	29.8	Very low	173 Å²	173	158.9 Å²	158.9	75%	0.752	80%	0.798	S	S	*	*				64.4	79.2	75.2	-154.5	-175	-172.7	-177.6	0	116.5
98	R	26.5	Very low	29.8	Very low	207 Å²	207	154.9 Å²	154.9	78%	0.781	79%	0.792	S	S	*	*			trans	72.3	141.5	162.9	-55.8	175.8	177.1	-176.9	-3.4	117
99	F	28.5	Very low	29.5	Very low	165 Å²	165	153.2 Å²	153.2	72%	0.724	79%	0.791	S	S	*	*				164.6	118.4	107.9	-97.3	-92.8	0	0	0	111.1
100	Y	29.8	Very low	29.8	Very low	209 Å²	209	148.6 Å²	148.6	82%	0.82	79%	0.793	S	S	*	*			trans	52.9	115.5	152.2	-73	-109.9	0	0	0	122.7
101	D	30.6	Very low	29.7	Very low	147 Å²	147	150.8 Å²	150.8	79%	0.786	79%	0.785	S	S	*	*			trans	-74.4	175.1	134.7	-108.3	-31	0	0	0	110.2
102	P	37	Very low	29.9	Very low	106 Å²	106	149.4 Å²	149.4	69%	0.688	79%	0.792	S	S	*	*			cis	-132.7	-179.5	-31.6	39.3	-24.8	0	0	0	111.5
103	L	30	Very low	29.6	Very low	173 Å²	173	144 Å²	144	91%	0.906	78%	0.779	S	S	*	*			trans	-162.7	169.4	151.2	-114.9	159.9	0	0	0	114.3
104	Q	28.2	Very low	29.5	Very low	156 Å²	156	147.2 Å²	147.2	73%	0.729	79%	0.789	S	S	*	*			trans	-107.8	162.5	-162.1	-67.7	177.2	-43.5	0	0	114.3
105	N	24.8	Very low	29.6	Very low	142 Å²	142	139.9 Å²	139.9	76%	0.759	78%	0.781	S	S	*	*			trans	46.9	99.9	145.7	-59.1	-10.2	0	0	0	118.8
106	V	30	Very low	29.7	Very low	130 Å²	130	141.6 Å²	141.6	79%	0.788	78%	0.777	S	S	*	*			trans	-125.9	114.4	144.6	178.4	0	0	0	0	108.8	L108	V106-L108 HydrophobicContact CG1-CD1 4.49Å; V106-L108 HydrophobicContact CG1-CG 4.38Å
107	T	24.7	Very low	29.6	Very low	137 Å²	137	141.5 Å²	141.5	84%	0.84	77%	0.771	S	S	*	*			trans	-81.4	128.9	164.8	45.3	0	0	0	0	109.5
108	L	31.5	Very low	29.7	Very low	161 Å²	161	140 Å²	140	84%	0.843	77%	0.77	S	S	*	*			trans	-124.4	109.8	164	-91.4	164.4	0	0	0	109.1	V106	V106-L108 HydrophobicContact CG1-CD1 4.49Å; V106-L108 HydrophobicContact CG1-CG 4.38Å
109	S	24.6	Very low	30.2	Very low	97 Å²	97	138.8 Å²	138.8	68%	0.678	77%	0.774	S	S	*	*			trans	-78.8	146.1	163.2	-165.4	0	0	0	0	109	D111	S109-D111 PolarHBondContact OG-OD1 2.96Å; S109-D111 VanDerWaalsContact OG-OD1 3.07Å
110	A	33.7	Very low	30.2	Very low	97 Å²	97	142.7 Å²	142.7	80%	0.802	78%	0.783	S	S	*	*			trans	-156.9	70.6	167.8	0	0	0	0	0	109.6
111	D	27.5	Very low	30.3	Very low	127 Å²	127	136.6 Å²	136.6	68%	0.679	78%	0.784	S	S	*	*			trans	1.7	133.9	138.5	-30.4	-31.9	0	0	0	116.9	S109	S109-D111 PolarHBondContact OG-OD1 2.96Å; S109-D111 VanDerWaalsContact OG-OD1 3.07Å
112	L	33.4	Very low	30.2	Very low	178 Å²	178	141.4 Å²	141.4	93%	0.932	79%	0.791	S	S	*	*				-162.1	160.1	102.6	-131.6	65.8	0	0	0	111.1
113	G	27.4	Very low	29.8	Very low	60 Å²	60	141.6 Å²	141.6	62%	0.619	80%	0.795	S	S	*	*			trans	-114.2	-163	-174.3	0	0	0	0	0	115.1
114	D	28.2	Very low	29.7	Very low	163 Å²	163	143.1 Å²	143.1	87%	0.872	79%	0.791	S	S	*	*			trans	57	109.5	157.2	-56.6	-29.2	0	0	0	121
115	A	34.5	Very low	29.9	Very low	96 Å²	96	142.7 Å²	142.7	79%	0.793	80%	0.798	S	S	*	*			trans	-159.4	71.7	140.1	0	0	0	0	0	112.1
116	T	31.1	Very low	30.1	Very low	113 Å²	113	141.1 Å²	141.1	69%	0.693	79%	0.794	S	S	*	*			trans	12.7	133.4	141.4	54.1	0	0	0	0	121.8
117	N	30.8	Very low	30	Very low	134 Å²	134	143.9 Å²	143.9	72%	0.717	80%	0.795	S	S	*	*				80.1	134.6	128	-69.7	-16.6	0	0	0	123.4
118	I	31.6	Very low	30.3	Very low	142 Å²	142	149.5 Å²	149.5	73%	0.728	80%	0.801	S	S	*	*			trans	71.8	134.8	144.7	-65.6	163.8	0	0	0	114.9
119	E	36.4	Very low	30.1	Very low	182 Å²	182	151.7 Å²	151.7	85%	0.85	80%	0.804	S	S	*	*			cis	-139.6	175	26.4	-156.5	139	-121.3	0	0	115.1
120	R	29.2	Very low	30.5	Very low	246 Å²	246	152.4 Å²	152.4	93%	0.928	81%	0.809	S	S	*	*			trans	-98.9	141.3	179.9	-66.4	168.7	168.8	151.2	-6.1	111.9
121	G	31.7	Very low	30.2	Very low	81 Å²	81	153.8 Å²	153.8	84%	0.835	81%	0.807	S	S	*	*			trans	-152.3	111.8	168	0	0	0	0	0	113.6
122	R	28.5	Very low	30.1	Very low	248 Å²	248	156.6 Å²	156.6	94%	0.936	81%	0.814	S	S	*	*			trans	-85.5	144.7	173.5	-63	171.8	170.1	167.3	-5.9	109
123	S	28.5	Very low	30	Very low	111 Å²	111	153.7 Å²	153.7	78%	0.776	81%	0.808	S	S	*	*				169.7	174.7	75.9	51.6	0	0	0	0	112.4
124	Y	27.9	Very low	30	Very low	205 Å²	205	157.9 Å²	157.9	80%	0.804	82%	0.815	S	S	*	*			trans	-67.1	154.1	179.5	-50	-96.9	0	0	0	114.6
125	V	31.9	Very low	30.3	Very low	147 Å²	147	155.7 Å²	155.7	89%	0.891	81%	0.809	S	S	*	*				-165.5	162.6	128.6	132.5	0	0	0	0	111.9
126	T	29	Very low	30.2	Very low	109 Å²	109	159.7 Å²	159.7	67%	0.669	81%	0.811	S	S	*	*			trans	-93.8	157.6	-161.5	64.1	0	0	0	0	116.6
127	K	28.2	Very low	30.2	Very low	187 Å²	187	161.5 Å²	161.5	81%	0.813	82%	0.815	S	S	*	*			trans	54.2	119.8	145.8	-68.2	165.5	-179.1	173.5	0	119
128	R	30.9	Very low	30.3	Very low	256 Å²	256	161.1 Å²	161.1	97%	0.966	82%	0.82	S	S	*	*				-170.5	175.8	117.9	-104.7	162.5	-171.2	-158.1	2.2	112.7
129	K	27.5	Very low	30.1	Very low	206 Å²	206	158.6 Å²	158.6	90%	0.896	82%	0.815	S	S	*	*			trans	-104.2	131.1	-179	-60.4	174.9	178.3	179.4	0	110.8
130	S	32.7	Very low	30.2	Very low	113 Å²	113	158.8 Å²	158.8	79%	0.79	82%	0.816	S	S	*	*			trans	-157.6	131.4	154.2	37.6	0	0	0	0	106.6
131	V	27.4	Very low	30.5	Very low	125 Å²	125	155.3 Å²	155.3	76%	0.758	81%	0.814	S	S	*	*			cis	82.4	103.3	43.9	178.9	0	0	0	0	111.6
132	F	25	Very low	30.4	Very low	187 Å²	187	157 Å²	157	82%	0.82	81%	0.813	S	S	*	*			trans	62.7	124.4	162.4	-82.5	-112.8	0	0	0	120.9
133	S	31.8	Very low	30.6	Very low	117 Å²	117	150.8 Å²	150.8	82%	0.818	81%	0.807	S	S	*	*				-165.5	148.1	112.4	23.8	0	0	0	0	110.8
134	I	27.5	Very low	30.8	Very low	147 Å²	147	150.8 Å²	150.8	75%	0.754	81%	0.814	S	S	*	*			trans	-122.7	130	173.7	-63.2	172	0	0	0	107.5
135	P	33.7	Very low	30.9	Very low	117 Å²	117	146.5 Å²	146.5	76%	0.76	81%	0.814	S	S	*	*			trans	-107.9	104.3	168.5	33.6	-23.8	0	0	0	112.7
136	H	32.9	Very low	30.9	Very low	180 Å²	180	143.8 Å²	143.8	83%	0.833	81%	0.807	S	S	*	*			trans	41.3	141.2	143.5	-67.3	-85.6	0	0	0	124.2
137	I	30.4	Very low	31.1	Very low	152 Å²	152	145.8 Å²	145.8	78%	0.779	81%	0.813	S	S	*	*			trans	-90.5	146	171.6	-65.4	157.9	0	0	0	110.4
138	P	33.6	Very low	31.3	Very low	125 Å²	125	145.1 Å²	145.1	81%	0.812	82%	0.815	S	S	*	*			trans	-104.5	122.9	145.4	-5.2	25	0	0	0	110.9
139	S	28.6	Very low	31.4	Very low	90 Å²	90	143.9 Å²	143.9	63%	0.629	81%	0.811	S	S	*	*			trans	-84.7	144	173.5	55.6	0	0	0	0	111.4
140	H	37.1	Very low	31.7	Very low	186 Å²	186	145.4 Å²	145.4	86%	0.861	81%	0.81	S	S	*	*			trans	-163.4	169.7	145.3	-83.8	-44.8	0	0	0	110.7
141	I	36.4	Very low	31.8	Very low	173 Å²	173	147.5 Å²	147.5	89%	0.887	81%	0.811	S	S	*	*			trans	67.9	89.8	-176.7	-47	-179	0	0	0	114.2
142	S	29.2	Very low	32.3	Very low	117 Å²	117	152.7 Å²	152.7	82%	0.818	82%	0.817	S	S	*	*			trans	-127.9	126.5	162.4	175	0	0	0	0	108.7
143	S	33.3	Very low	32.7	Very low	117 Å²	117	153.2 Å²	153.2	82%	0.818	82%	0.819	S	S	*	*			trans	167.8	95.8	154.9	37.6	0	0	0	0	112.8
144	A	31.3	Very low	32.8	Very low	110 Å²	110	153 Å²	153	91%	0.909	82%	0.824	S	S	*	*			trans	-163	67.2	163.5	0	0	0	0	0	110.4
145	S	31.3	Very low	33	Very low	116 Å²	116	150.9 Å²	150.9	81%	0.811	82%	0.823	S	S	*	*			trans	-116.4	156.4	-171.5	67.2	0	0	0	0	113.9
146	A	30.3	Very low	33	Very low	89 Å²	89	154.7 Å²	154.7	74%	0.736	83%	0.827	S	S	*	*			trans	64.1	88.1	159	0	0	0	0	0	119.7
147	N	34.2	Very low	33	Very low	151 Å²	151	153.4 Å²	153.4	81%	0.807	82%	0.822	S	S	*	*			trans	-163.7	143.2	135	-96.9	-44.6	0	0	0	108.6
148	M	31.5	Very low	33.1	Very low	173 Å²	173	155.8 Å²	155.8	85%	0.852	83%	0.827	S	S	*	*			cis	-149.2	161	-1.9	-150.9	176.3	-138	0	0	110.1
149	R	34.5	Very low	33.1	Very low	231 Å²	231	155.3 Å²	155.3	87%	0.872	82%	0.818	S	S	*	*			trans	-88.5	167.5	178	-77.9	173.8	164.6	165.4	-6.7	112.8
150	R	32.2	Very low	33.5	Very low	237 Å²	237	157 Å²	157	89%	0.894	83%	0.826	S	S	*	*			trans	89.4	147.7	177.3	-50.5	165.6	-179	-176.4	1.1	112.2
151	I	36.6	Very low	33.3	Very low	158 Å²	158	153.2 Å²	153.2	81%	0.81	82%	0.821	S	S	*	*			cis	-120.3	150.5	12.1	-81.2	84.4	0	0	0	113.4
152	R	36	Very low	33.3	Very low	234 Å²	234	152.2 Å²	152.2	88%	0.883	82%	0.815	S	S	*	*			trans	-43.6	152.6	173.5	-62.7	159.9	170.3	159	-5.7	119.9
153	K	35.2	Very low	33.8	Very low	198 Å²	198	155.5 Å²	155.5	86%	0.861	82%	0.815	S	S	*	*			trans	-11.2	138	150.2	-58.2	178.4	176.7	-175.4	0	118.1
154	A	32.8	Very low	33.9	Very low	112 Å²	112	162.1 Å²	162.1	93%	0.926	82%	0.822	S	S	*	*			trans	-140	87.8	150.8	0	0	0	0	0	110.5
155	S	31	Very low	34	Very low	103 Å²	103	160.4 Å²	160.4	72%	0.72	82%	0.816	S	S	*	*			trans	-111.3	110.9	173.1	55.2	0	0	0	0	109.3
156	K	35.1	Very low	34.1	Very low	196 Å²	196	160.6 Å²	160.6	85%	0.852	82%	0.817	S	S	*	*			trans	-139.4	95.9	171.3	-86.5	-164.9	170.8	-170.9	0	111.6
157	Q	31.7	Very low	34.2	Very low	153 Å²	153	160.2 Å²	160.2	72%	0.715	81%	0.813	S	S	*	*				0.7	131	121.9	-178.3	178.5	0.7	0	0	115.7	D159	Q157-D159 PolarHBondContact NE2-OD1 2.83Å
158	F	33.2	Very low	34.2	Very low	202 Å²	202	160.7 Å²	160.7	89%	0.886	82%	0.816	S	S	*	*			trans	-132.5	135.3	155.4	-116.5	-82.3	0	0	0	108.4
159	D	34.3	Very low	34.3	Very low	116 Å²	116	159 Å²	159	62%	0.62	82%	0.816	S	S	*	*			trans	-88.7	156	-169.2	-63.7	-64.4	0	0	0	113.2	Q157	Q157-D159 PolarHBondContact NE2-OD1 2.83Å
160	P	35.5	Very low	34.3	Very low	125 Å²	125	154.1 Å²	154.1	81%	0.812	82%	0.817	S	S	*	*			trans	-86.2	126.5	178.9	33	-33.4	0	0	0	112.9
161	S	33.5	Very low	34.2	Very low	106 Å²	106	146.3 Å²	146.3	74%	0.741	81%	0.81	S	S	*	*			trans	-169.7	172.3	155.5	56.5	0	0	0	0	112.2
162	I	36.8	Very low	34.2	Very low	152 Å²	152	147.8 Å²	147.8	78%	0.779	82%	0.819	S	S	*	*			trans	67.8	92.6	176.4	-45.6	175	0	0	0	113.1
163	K	38.7	Very low	33.9	Very low	187 Å²	187	140.2 Å²	140.2	81%	0.813	81%	0.814	S	S	*	*				79.2	116.5	55.4	-71.5	-171.9	171.7	174.5	0	116.6
164	R	36.9	Very low	33.6	Very low	255 Å²	255	136 Å²	136	96%	0.962	81%	0.809	S	S	*	*			trans	81	148.7	154.5	-65.7	177.2	170.8	179.4	-4.7	118.6
165	G	33.3	Very low	33.7	Very low	75 Å²	75	136.2 Å²	136.2	77%	0.773	80%	0.804	S	S	*	*			trans	99.5	68.3	-170	0	0	0	0	0	111.3
166	S	33.7	Very low	33.7	Very low	119 Å²	119	138.6 Å²	138.6	83%	0.832	81%	0.808	S	S	*	*				78.9	112.5	64.8	-165.8	0	0	0	0	113.3
167	A	32.3	Very low	33.7	Very low	81 Å²	81	136.1 Å²	136.1	67%	0.669	80%	0.804	S	S	*	*			trans	47.7	109.2	159.9	0	0	0	0	0	118.5
168	D	33.9	Very low	33.8	Very low	161 Å²	161	140.1 Å²	140.1	86%	0.861	81%	0.813	S	S	*	*				-165.2	171	81.7	-93.8	-30.4	0	0	0	112.1
169	T	33.1	Very low	33.7	Very low	138 Å²	138	136.8 Å²	136.8	85%	0.847	81%	0.809	S	S	*	*			trans	-104	96.6	-159	54.6	0	0	0	0	115.3
170	S	34.4	Very low	33.5	Very low	128 Å²	128	136.8 Å²	136.8	90%	0.895	82%	0.818	S	S	*	*			trans	-169.2	122.2	150.9	32.9	0	0	0	0	110.3
171	G	30.7	Very low	33.4	Very low	73 Å²	73	137.3 Å²	137.3	75%	0.753	81%	0.813	S	S	*	*			trans	173.2	31.3	-171	0	0	0	0	0	119.2
172	L	35.9	Very low	33.3	Very low	189 Å²	189	141.4 Å²	141.4	99%	0.99	82%	0.82	S	S	*	*			trans	-141.9	116.2	169.9	-71.4	174.7	0	0	0	109.4
173	G	30.7	Very low	33.3	Very low	76 Å²	76	139.3 Å²	139.3	78%	0.784	82%	0.815	S	S	*	*			cis	-167.4	122.5	-12.7	0	0	0	0	0	110.6
174	S	29	Very low	32.8	Very low	109 Å²	109	134.1 Å²	134.1	76%	0.762	81%	0.814	S	S	*	*			trans	-121.3	122.4	171.4	-173.9	0	0	0	0	108.8
175	S	33.5	Very low	32.7	Very low	117 Å²	117	131.5 Å²	131.5	82%	0.818	81%	0.813	S	S	*	*			trans	-154.1	60.8	-177.1	67.7	0	0	0	0	111.9
176	L	31.4	Very low	32.8	Very low	152 Å²	152	133.3 Å²	133.3	80%	0.796	81%	0.809	S	S	*	*			trans	-142.7	20.2	172.1	-119.2	161.7	0	0	0	114.4	W178	L176-W178 PolarHBondContact O-N 3.39Å
177	D	34.4	Very low	32.6	Very low	145 Å²	145	133.5 Å²	133.5	78%	0.775	81%	0.807	S	S	*	*			trans	-78.5	113.5	169.3	-70.8	-53.8	0	0	0	111.3
178	W	35	Very low	32.8	Very low	236 Å²	236	139 Å²	139	89%	0.894	82%	0.816	S	S	*	*			trans	-132.9	45	175.2	-84.8	103.4	0	0	0	112.8	L176	L176-W178 PolarHBondContact O-N 3.39Å
179	V	31.3	Very low	32.4	Very low	133 Å²	133	141.8 Å²	141.8	81%	0.806	82%	0.817	S	S	*	*			trans	-131.9	85.7	161.2	-173.8	0	0	0	0	109
180	S	30.1	Very low	32.3	Very low	116 Å²	116	146.6 Å²	146.6	81%	0.811	82%	0.819	S	S	*	*			trans	-71.4	130.8	170.3	-169.7	0	0	0	0	109.9	E182	S180-E182 PolarHBondContact O-N 2.78Å
181	L	32.2	Very low	32.2	Very low	135 Å²	135	148.4 Å²	148.4	71%	0.707	81%	0.811	S	S	*	*			trans	-94.4	91.6	-177	-157.2	89.3	0	0	0	110.1	T183	L181-T183 HydrophobicContact CD2-CG2 4.4Å; L181-T183 PolarHBondContact O-N 3.39Å
182	E	31.9	Very low	32.2	Very low	192 Å²	192	153 Å²	153	90%	0.897	82%	0.815	S	S	*	*			trans	-67.1	94	173.1	-77.2	-171	124.9	0	0	111.2	S180	S180-E182 PolarHBondContact O-N 2.78Å
183	T	36	Very low	32	Very low	109 Å²	109	149.1 Å²	149.1	67%	0.669	80%	0.803	S	S	*	*			trans	-134.1	87.6	169.4	42.9	0	0	0	0	111.1	L181	L181-T183 HydrophobicContact CD2-CG2 4.4Å; L181-T183 PolarHBondContact O-N 3.39Å
184	G	28.9	Very low	32.1	Very low	77 Å²	77	149.5 Å²	149.5	79%	0.794	79%	0.794	S	S	*	*			trans	42.4	100.4	154.2	0	0	0	0	0	119.6
185	Q	34.4	Very low	32.3	Very low	201 Å²	201	152.3 Å²	152.3	94%	0.939	80%	0.795	S	S	*	*			trans	-116	144.4	143.7	-79.5	-168.9	-18.2	0	0	110.6
186	T	35	Very low	32.3	Very low	113 Å²	113	157.1 Å²	157.1	69%	0.693	80%	0.797	S	S	*	*			trans	-77.3	145.8	-170.2	46.6	0	0	0	0	113.2	F188	T186-F188 PolarHBondContact O-N 3.19Å
187	P	30.6	Very low	32.1	Very low	122 Å²	122	155.4 Å²	155.4	79%	0.792	79%	0.793	S	S	*	*			trans	-74.4	127.9	-176.9	30.3	-34.9	0	0	0	112.4
188	F	36	Very low	32.1	Very low	196 Å²	196	157.4 Å²	157.4	86%	0.86	80%	0.797	S	S	*	*			trans	-106.2	134.9	166.9	-94.5	-86.9	0	0	0	111.8	T186	T186-F188 PolarHBondContact O-N 3.19Å
189	Y	26.9	Very low	31.9	Very low	221 Å²	221	152.5 Å²	152.5	87%	0.867	79%	0.788	S	S	*	*			trans	-74.5	133.7	-174.2	-83.8	-107.8	0	0	0	113.8
190	R	30.5	Very low	32.2	Very low	238 Å²	238	151.6 Å²	151.6	90%	0.898	79%	0.785	S	S	*	*			trans	177.1	148.3	143.2	-98.9	162.5	-171.7	-153	4.2	109.6
191	K	32.8	Very low	32.3	Very low	167 Å²	167	157.2 Å²	157.2	73%	0.726	79%	0.789	S	S	*	*			cis	-172.7	144.9	-31.4	-134.4	-175.4	-178.3	-175.5	0	106.8
192	M	29.6	Very low	32.3	Very low	169 Å²	169	156 Å²	156	83%	0.833	79%	0.787	S	S	*	*			trans	64.1	151.6	171.2	-66.8	131.1	165.5	0	0	115.1
193	S	31.7	Very low	32.3	Very low	107 Å²	107	154.2 Å²	154.2	75%	0.748	78%	0.782	S	S	*	*			cis	-153.8	173.4	-13.7	61	0	0	0	0	107.3
194	S	32.1	Very low	32.2	Very low	85 Å²	85	155.8 Å²	155.8	59%	0.594	79%	0.785	S	S	*	*			cis	-166.5	154.1	6	16.1	0	0	0	0	108.6
195	Q	35	Very low	32.1	Very low	168 Å²	168	157.3 Å²	157.3	79%	0.785	78%	0.779	S	S	*	*			trans	54.5	117.9	151.9	-62.1	159.3	-13.1	0	0	117.2
196	Y	32.7	Very low	31.9	Very low	217 Å²	217	154.6 Å²	154.6	85%	0.851	78%	0.776	S	S	*	*				-147.8	161	51.5	-108.8	-93.8	0	0	0	113
197	V	27.9	Very low	31.6	Very low	117 Å²	117	156.6 Å²	156.6	71%	0.709	78%	0.777	S	S	*	*			trans	-139.5	134.8	-172.9	173.6	0	0	0	0	111.7
198	H	34.1	Very low	31.8	Very low	186 Å²	186	161 Å²	161	86%	0.861	78%	0.784	S	S	*	*			trans	-169.2	148.8	153.2	-90.5	-22.9	0	0	0	109.5
199	N	31.1	Very low	31.4	Very low	133 Å²	133	155.8 Å²	155.8	71%	0.711	77%	0.772	S	S	*	*			cis	-159.7	136.7	-37	-150.4	18.8	0	0	0	106.9
200	P	36.3	Very low	31.7	Very low	115 Å²	115	152.4 Å²	152.4	75%	0.747	77%	0.767	S	S	*	*			trans	-89.3	169.7	-171.2	35.5	-35.4	0	0	0	113.9
201	R	33.2	Very low	31.7	Very low	234 Å²	234	147.5 Å²	147.5	88%	0.883	76%	0.759	S	S	*	*			trans	-133.4	124.2	166	-88.9	-174	170.4	179.2	-3.1	111.3
202	T	31.4	Very low	31.7	Very low	110 Å²	110	145.8 Å²	145.8	68%	0.675	75%	0.754	S	S	*	*			trans	27	128.6	140.3	56.8	0	0	0	0	118.3
203	I	32.7	Very low	31.7	Very low	154 Å²	154	147.8 Å²	147.8	79%	0.79	75%	0.752	S	S	*	*				-149	115.1	68.4	-79.1	151.8	0	0	0	107.7
204	I	32.5	Very low	31.9	Very low	141 Å²	141	151.3 Å²	151.3	72%	0.723	76%	0.757	S	S	*	*				75.3	120	90	-63.5	165.1	0	0	0	114.7
205	T	27	Very low	32	Very low	110 Å²	110	152.5 Å²	152.5	68%	0.675	76%	0.761	S	S	*	*			trans	-53.8	162.8	176	52.7	0	0	0	0	117.6
206	V	31.7	Very low	31.8	Very low	143 Å²	143	150.3 Å²	150.3	87%	0.867	76%	0.759	S	S	*	*				-146.5	145.2	114.6	164.1	0	0	0	0	109.8
207	H	27.9	Very low	31.7	Very low	156 Å²	156	151.4 Å²	151.4	72%	0.722	76%	0.761	S	S	*	*			trans	-81.3	153.7	174.7	-77.8	-131.6	0	0	0	113.1
208	K	33.8	Very low	31.9	Very low	214 Å²	214	151.3 Å²	151.3	93%	0.93	76%	0.763	S	S	*	*				-156.9	130.6	129.3	-116.5	171.6	-176.8	-178	0	112.9
209	S	28.2	Very low	31.8	Very low	87 Å²	87	150.3 Å²	150.3	61%	0.608	76%	0.763	S	S	*	*			trans	-123	-178.9	165.7	54.7	0	0	0	0	108
210	L	32.8	Very low	31.7	Very low	149 Å²	149	150 Å²	150	78%	0.78	77%	0.766	S	S	*	*			trans	70.9	150.9	-176.5	-75	75.9	0	0	0	114.7
211	D	31.9	Very low	31.4	Very low	136 Å²	136	150.9 Å²	150.9	73%	0.727	77%	0.769	S	S	*	*			cis	-167.1	-176.8	-33.4	-136.9	-53.5	0	0	0	109.6
212	E	31.7	Very low	31.3	Very low	130 Å²	130	148.7 Å²	148.7	61%	0.607	77%	0.766	S	S	*	*			trans	58.1	117.5	152.7	-72.4	-162.3	101.7	0	0	122.3
213	R	30.2	Very low	31.4	Very low	211 Å²	211	150.4 Å²	150.4	80%	0.796	76%	0.764	S	S	*	*				46.8	115.4	124.7	-57.7	175.2	173.2	157.4	-11.6	120.2
214	Q	34.9	Very low	31.4	Very low	181 Å²	181	151 Å²	151	85%	0.846	76%	0.763	S	S	*	*				-160.3	108.6	124.2	-108.7	165.7	45.2	0	0	111.4
215	T	35.9	Very low	31.2	Very low	111 Å²	111	151.4 Å²	151.4	68%	0.681	77%	0.766	S	S	*	*				77.9	91.5	103.3	58.4	0	0	0	0	117.9
216	T	30.8	Very low	31.6	Very low	121 Å²	121	152.3 Å²	152.3	74%	0.742	77%	0.771	S	S	*	*				36.1	120.8	124.4	66.4	0	0	0	0	120.8
217	R	30.2	Very low	31.6	Very low	240 Å²	240	149.8 Å²	149.8	91%	0.906	76%	0.76	S	S	*	*				171.1	149.3	96.8	-89.4	-174.6	-175.9	-172.3	0.1	112.1
218	P	31	Very low	31.9	Very low	115 Å²	115	149.4 Å²	149.4	75%	0.747	76%	0.763	S	S	*	*			trans	-97.6	144.6	174.7	36.6	-32.6	0	0	0	113.9
219	L	31.9	Very low	32	Very low	165 Å²	165	147.2 Å²	147.2	86%	0.864	76%	0.762	S	S	*	*			trans	-144.4	118.8	164	-71.6	173.5	0	0	0	106.9
220	V	29.7	Very low	32.3	Very low	126 Å²	126	146.3 Å²	146.3	76%	0.764	77%	0.767	S	S	*	*				77.4	99.9	62.8	179.3	0	0	0	0	113.6
221	V	30.4	Very low	32.3	Very low	135 Å²	135	146.9 Å²	146.9	82%	0.818	77%	0.77	S	S	*	*			trans	4	125.5	153.9	-174.5	0	0	0	0	118.7
222	K	31.7	Very low	32.5	Very low	188 Å²	188	147.5 Å²	147.5	82%	0.817	78%	0.779	S	S	*	*			trans	-174.9	147.9	153.1	-103.3	163.5	-174.1	174.4	0	108.2
223	K	32.6	Very low	32.5	Very low	145 Å²	145	147.5 Å²	147.5	63%	0.63	78%	0.779	S	S	*	*			cis	-169.1	155.2	-7.8	-143.7	-176.6	177.8	-159.8	0	109.9
224	H	32.5	Very low	32.4	Very low	167 Å²	167	146.1 Å²	146.1	77%	0.773	77%	0.774	S	S	*	*			trans	65.6	141.9	162.1	-62.4	-39.4	0	0	0	117.5
225	L	28.2	Very low	32.4	Very low	150 Å²	150	147 Å²	147	79%	0.785	77%	0.771	S	S	*	*			cis	87.7	101.4	34.8	-81.1	163.2	0	0	0	115.4
226	T	36.1	Very low	32.4	Very low	128 Å²	128	148.3 Å²	148.3	79%	0.785	77%	0.773	S	S	*	*			trans	177.1	124.7	142.3	33.8	0	0	0	0	105.5
227	S	32.3	Very low	32.3	Very low	91 Å²	91	149.5 Å²	149.5	64%	0.636	77%	0.774	S	S	*	*				63.9	141.3	69.6	86.9	0	0	0	0	112.4
228	D	32.6	Very low	32.4	Very low	147 Å²	147	144.9 Å²	144.9	79%	0.786	76%	0.763	S	S	*	*			cis	-150.9	165.9	-11.5	-98.3	-30.7	0	0	0	107.8
229	D	37.3	Very low	32.7	Very low	169 Å²	169	145.7 Å²	145.7	90%	0.904	76%	0.756	S	S	*	*			trans	161.4	133.6	140	-86.7	-16.6	0	0	0	110.5
230	G	32.8	Very low	32.8	Very low	68 Å²	68	146 Å²	146	70%	0.701	75%	0.751	S	S	*	*			trans	-127.9	-160.6	179.2	0	0	0	0	0	112.5
231	D	33.8	Very low	33.1	Very low	160 Å²	160	144.8 Å²	144.8	86%	0.856	75%	0.746	S	S	*	*			trans	52.3	97.6	163.2	-60.2	-13.8	0	0	0	118.8
232	T	35.6	Very low	33.1	Very low	149 Å²	149	145 Å²	145	91%	0.914	74%	0.742	S	S	*	*				-143.2	127.1	124.7	-39.1	0	0	0	0	111.2
233	E	31.4	Very low	33.1	Very low	130 Å²	130	143.5 Å²	143.5	61%	0.607	74%	0.735	S	S	*	*			trans	-84	155	176	-78.8	-156.3	102.5	0	0	113.4
234	R	29.6	Very low	32.8	Very low	182 Å²	182	143.6 Å²	143.6	69%	0.687	74%	0.741	S	S	*	*			trans	57.7	135.9	148.3	-63.4	157.1	-160.8	-169.9	14.4	118.8
235	Y	33.7	Very low	32.8	Very low	201 Å²	201	145.2 Å²	145.2	79%	0.788	74%	0.742	S	S	*	*				175.3	134.7	105.6	-100.4	-69.4	0	0	0	113
236	L	35.4	Very low	32.8	Very low	137 Å²	137	143.7 Å²	143.7	72%	0.717	74%	0.739	S	S	*	*			trans	63.9	124.2	162.4	-50.1	179.4	0	0	0	117
237	L	29.9	Very low	32.7	Very low	147 Å²	147	144.1 Å²	144.1	77%	0.77	74%	0.741	S	S	*	*				68.8	139.1	61.9	-63.1	173.1	0	0	0	112.7
238	Q	32.5	Very low	32.4	Very low	143 Å²	143	145.8 Å²	145.8	67%	0.668	75%	0.748	S	S	*	*			cis	-164.2	150.8	27	-145.7	170.7	-7.9	0	0	113.6
239	Q	36.5	Very low	32.5	Very low	131 Å²	131	146.8 Å²	146.8	61%	0.612	75%	0.752	S	S	*	*			trans	65	154	153.1	-78.8	159.7	1.7	0	0	119.9
240	F	34.7	Very low	32.2	Very low	173 Å²	173	142.7 Å²	142.7	76%	0.759	74%	0.741	S	S	*	*			cis	-143.1	172.5	3.2	-100.7	-49.3	0	0	0	110.2
241	P	35.8	Very low	32.2	Very low	100 Å²	100	145.9 Å²	145.9	65%	0.649	75%	0.749	S	S	*	*			trans	-134.8	-169.5	-137	32.5	-7.8	0	0	0	118.3
242	L	30.3	Very low	32.1	Very low	140 Å²	140	142 Å²	142	73%	0.733	75%	0.747	S	S	*	*			trans	78.4	142.9	173.2	-56.4	111.7	0	0	0	115.7
243	K	30.8	Very low	31.9	Very low	155 Å²	155	142.8 Å²	142.8	67%	0.674	74%	0.744	S	S	*	*			cis	-152	132.3	9.8	-142.8	159.9	-172.1	173.4	0	111.5
244	I	27.5	Very low	32	Very low	147 Å²	147	141 Å²	141	75%	0.754	74%	0.744	S	S	*	*			trans	-125.4	142.6	167.2	-65.7	175	0	0	0	107.8	T246	I244-T246 HydrophobicContact CG2-CG2 4.05Å
245	Y	31.3	Very low	32	Very low	201 Å²	201	139.7 Å²	139.7	79%	0.788	75%	0.746	S	S	*	*			trans	-119.2	112	166.3	-90.4	-76.2	0	0	0	109.5
246	T	28.1	Very low	31.9	Very low	118 Å²	118	137.5 Å²	137.5	72%	0.724	74%	0.743	S	S	*	*			trans	-137.3	120.3	168.8	46.2	0	0	0	0	107.6	I244	I244-T246 HydrophobicContact CG2-CG2 4.05Å
247	T	33.6	Very low	31.5	Very low	137 Å²	137	134.9 Å²	134.9	84%	0.84	74%	0.736	S	S	*	*			trans	-122.2	96.9	174.6	48.7	0	0	0	0	109.7
248	T	27	Very low	31.5	Very low	127 Å²	127	137.3 Å²	137.3	78%	0.779	74%	0.741	S	S	*	*			trans	-79.8	-170.8	159.9	-44.4	0	0	0	0	108.7
249	I	33.9	Very low	31.4	Very low	168 Å²	168	138.8 Å²	138.8	86%	0.862	75%	0.752	S	S	*	*			trans	83.4	123.8	-179.1	-50.1	164.3	0	0	0	111.4
250	A	32.2	Very low	30.9	Very low	83 Å²	83	135.7 Å²	135.7	69%	0.686	76%	0.756	S	S	*	*			cis	-151.3	162.4	-5.1	0	0	0	0	0	111.2
251	P	31.6	Very low	30.8	Very low	134 Å²	134	138.2 Å²	138.2	87%	0.87	76%	0.76	S	S	*	*			trans	-82.3	143.6	171.6	33.8	-33.9	0	0	0	112.6
252	G	32.5	Very low	30.4	Very low	79 Å²	79	140.3 Å²	140.3	81%	0.814	77%	0.766	S	S	*	*			trans	-166.4	112.7	175.5	0	0	0	0	0	112
253	I	31.6	Very low	30.3	Very low	165 Å²	165	142.4 Å²	142.4	85%	0.846	77%	0.77	S	S	*	*			trans	-99.3	148	178.2	-43.5	172.7	0	0	0	104.6
254	P	34	Very low	30.3	Very low	94 Å²	94	140.7 Å²	140.7	61%	0.61	77%	0.772	S	S	*	*			cis	-152.7	176.5	44.2	45.9	-25.4	0	0	0	120.1
255	Q	28.8	Very low	30.4	Very low	153 Å²	153	143.1 Å²	143.1	72%	0.715	78%	0.777	S	S	*	*			trans	66.2	144.4	149.3	-76.8	167	-63.8	0	0	118.9
256	E	32.2	Very low	30.5	Very low	155 Å²	155	139.5 Å²	139.5	72%	0.724	78%	0.778	S	S	*	*			cis	-151.5	-179	-6.6	-140.8	155.9	-131.3	0	0	111.7
257	S	27.1	Very low	30.5	Very low	82 Å²	82	138.7 Å²	138.7	57%	0.573	78%	0.777	S	S	*	*			trans	-54.1	152.8	176.1	39.9	0	0	0	0	113.9
258	F	30.2	Very low	30.3	Very low	198 Å²	198	140.8 Å²	140.8	87%	0.868	78%	0.777	S	S	*	*				-160	155	68.4	-104.2	-87.1	0	0	0	115.7
259	L	30	Very low	30.4	Very low	174 Å²	174	142.5 Å²	142.5	91%	0.911	78%	0.776	S	S	*	*			trans	-80.4	161.8	166.2	-82	161.9	0	0	0	111.9
260	G	26.7	Very low	30.2	Very low	67 Å²	67	146.7 Å²	146.7	69%	0.691	78%	0.781	S	S	*	*			trans	109.9	78.7	150.2	0	0	0	0	0	117.6
261	R	31.3	Very low	30.1	Very low	225 Å²	225	150.1 Å²	150.1	85%	0.849	78%	0.783	S	S	*	*			trans	-159.6	122.9	135.2	-134.4	166	-81.4	-157.2	-7.4	113.2	F263	R261-F263 HydrophobicContact CG-CD2 4.42Å
262	D	28.4	Very low	30.1	Very low	144 Å²	144	150.7 Å²	150.7	77%	0.77	77%	0.772	S	S	*	*			trans	-57.9	157.6	152.3	-54.9	-89.7	0	0	0	110.4
263	F	28.1	Very low	29.9	Very low	185 Å²	185	154.3 Å²	154.3	81%	0.811	77%	0.772	S	S	*	*				179.5	148.3	126.3	-98.7	-56.1	0	0	0	113.6	R261	R261-F263 HydrophobicContact CG-CD2 4.42Å
264	V	30.9	Very low	30.1	Very low	118 Å²	118	152.2 Å²	152.2	72%	0.715	76%	0.758	S	S	*	*			trans	60.1	115.9	149.9	177.1	0	0	0	0	118.7	P266	V264-P266 WeakPolarHBondContact O-CD 3.36Å
265	K	28.1	Very low	30.1	Very low	198 Å²	198	157 Å²	157	86%	0.861	77%	0.77	S	S	*	*			trans	-66.6	120.9	154.3	-66.6	171.6	178.6	171.4	0	109.5	S267	K265-S267 PolarHBondContact O-N 3.2Å; K265-S267 VanDerWaalsContact O-N 3.09Å
266	P	35	Very low	30.2	Very low	125 Å²	125	156.3 Å²	156.3	81%	0.812	77%	0.77	S	S	*	*			trans	-80.5	92.4	174.7	31.7	-33.3	0	0	0	110.9	V264	V264-P266 WeakPolarHBondContact O-CD 3.36Å
267	S	27.6	Very low	30.3	Very low	101 Å²	101	157.6 Å²	157.6	71%	0.706	78%	0.776	S	S	*	*			trans	-79.8	119.9	157.1	57.5	0	0	0	0	109.4	K265	K265-S267 PolarHBondContact O-N 3.2Å; K265-S267 VanDerWaalsContact O-N 3.09Å
268	Q	30.2	Very low	30.6	Very low	182 Å²	182	163.6 Å²	163.6	85%	0.85	79%	0.786	S	S	*	*			trans	166.3	129.9	135.8	-93.1	173.5	20.6	0	0	113.5
269	H	27.7	Very low	30.8	Very low	163 Å²	163	160.3 Å²	160.3	76%	0.755	78%	0.784	S	S	*	*			trans	29.6	117.3	131.6	-100.5	-109.9	0	0	0	120.1
270	R	30.6	Very low	31	Very low	255 Å²	255	155.2 Å²	155.2	96%	0.962	76%	0.76	S	S	*	*			trans	-146.5	138.8	130.9	-133.7	170.7	-176.5	168.4	1.3	115
271	Q	30.1	Very low	31.4	Very low	156 Å²	156	163.4 Å²	163.4	73%	0.729	77%	0.772	S	S	*	*			trans	-85	151.1	-160.3	-71.3	162.7	-43.3	0	0	116
272	K	30.2	Very low	31.6	Very low	145 Å²	145	158 Å²	158	63%	0.63	76%	0.757	S	S	*	*				64	119.8	124.4	-165.8	-159	-162.6	-131.9	0	121.7	E274	K272-E274 VanDerWaalsContact CE-CD 3.44Å; K272-E274 WeakPolarHBondContact CE-OE1 3.41Å; K272-E274 WeakPolarHBondContact CE-OE2 3.46Å; K272-E274 HydrophobicContact CG-CB 4.4Å; K272-E274 IonicContact NZ-OE1 3.52Å; K272-E274 PolarHBondContact NZ-OE1 3.03Å; K272-E274 IonicContact NZ-OE2 3.4Å; K272-E274 PolarHBondContact NZ-OE2 3.26Å
273	L	30.2	Very low	32	Very low	156 Å²	156	156.2 Å²	156.2	82%	0.817	75%	0.753	S	S	*	*				-165.8	128.3	123.3	-127	65.2	0	0	0	107.2
274	E	34.2	Very low	32.4	Very low	121 Å²	121	153.3 Å²	153.3	57%	0.565	75%	0.746	S	S	*	*			cis	112.6	105.2	14.6	-177.5	172.3	-114.7	0	0	113.2	K272	K272-E274 VanDerWaalsContact CE-CD 3.44Å; K272-E274 WeakPolarHBondContact CE-OE1 3.41Å; K272-E274 WeakPolarHBondContact CE-OE2 3.46Å; K272-E274 HydrophobicContact CG-CB 4.4Å; K272-E274 IonicContact NZ-OE1 3.52Å; K272-E274 PolarHBondContact NZ-OE1 3.03Å; K272-E274 IonicContact NZ-OE2 3.4Å; K272-E274 PolarHBondContact NZ-OE2 3.26Å
275	K	34.3	Very low	32.4	Very low	195 Å²	195	156.3 Å²	156.3	85%	0.848	75%	0.746	S	S	*	*			trans	163.3	141.8	156.1	-95	160.6	178.6	178.6	0	109.5
276	L	30.9	Very low	32.5	Very low	138 Å²	138	153.9 Å²	153.9	72%	0.723	74%	0.737	S	S	*	*			cis	-160.3	166.9	-17.8	-160.1	65.6	0	0	0	110.4
277	Q	34.7	Very low	32.2	Very low	181 Å²	181	154.2 Å²	154.2	85%	0.846	73%	0.732	S	S	*	*			trans	83.4	156.2	160	-91.8	160.2	-22.3	0	0	120
278	R	33.3	Very low	32.4	Very low	208 Å²	208	157.3 Å²	157.3	79%	0.785	74%	0.735	S	S	*	*			trans	-166.6	165.1	-144	-132.5	177.5	-172.3	-161.8	1	106.9	V280	R278-V280 HydrophobicContact CG-CG2 4.26Å; R278-V280 VanDerWaalsContact CZ-CG2 3.44Å
279	P	34.6	Very low	32.2	Very low	129 Å²	129	154.2 Å²	154.2	84%	0.838	73%	0.728	S	S	*	*				-146.6	156.3	80.5	35.8	-16.3	0	0	0	117.8
280	V	33.2	Very low	32.3	Very low	67 Å²	67	153.4 Å²	153.4	41%	0.406	74%	0.735	S	S	.	*			trans	-78.4	161.1	178	164	0	0	0	0	112.4	R278 Q282	R278-V280 HydrophobicContact CG-CG2 4.26Å; R278-V280 VanDerWaalsContact CZ-CG2 3.44Å; V280-Q282 HydrophobicContact CG1-CB 3.96Å
281	Y	36.1	Very low	32.1	Very low	240 Å²	240	148.7 Å²	148.7	94%	0.941	73%	0.727	S	S	*	*			trans	-139.7	145.4	132.1	-123.4	-83.3	0	0	0	110.9
282	Q	35.8	Very low	32	Very low	111 Å²	111	147 Å²	147	52%	0.519	73%	0.733	S	S	.	*			trans	-153.1	157.9	-168.5	-173.3	178.3	-15	0	0	110.6	V280	V280-Q282 HydrophobicContact CG1-CB 3.96Å
283	P	36	Very low	31.8	Very low	107 Å²	107	146.6 Å²	146.6	70%	0.695	74%	0.743	S	S	*	*				-142.7	-155.8	123.1	32.1	-12.6	0	0	0	112.1
284	D	36.5	Very low	31.7	Very low	123 Å²	123	145.1 Å²	145.1	66%	0.658	75%	0.746	S	S	*	*				-153.9	155.7	-79.7	-80.7	-37.2	0	0	0	108.5
285	Y	30.4	Very low	31.4	Very low	182 Å²	182	147.9 Å²	147.9	71%	0.714	76%	0.759	S	S	*	*			cis	87.3	127.3	32.6	-78	-20.2	0	0	0	114.1
286	Q	30.4	Very low	31.1	Very low	147 Å²	147	144.8 Å²	144.8	69%	0.687	76%	0.761	S	S	*	*			cis	-153.9	-169.7	-5	-49	-166.7	17.5	0	0	111.6
287	L	28.7	Very low	31	Very low	132 Å²	132	141.9 Å²	141.9	69%	0.691	77%	0.765	S	S	*	*			trans	77.5	157.3	150.4	-103.3	61.6	0	0	0	119.5
288	E	32.2	Very low	31.1	Very low	166 Å²	166	138.6 Å²	138.6	78%	0.776	76%	0.762	S	S	*	*			cis	-150.8	175.2	-3.8	-161.1	144.8	-136.7	0	0	113.6
289	T	26.8	Very low	31.2	Very low	116 Å²	116	133.6 Å²	133.6	71%	0.712	76%	0.756	S	S	*	*			trans	-78.3	144.6	-175.5	-42.9	0	0	0	0	115.7
290	T	29.3	Very low	31	Very low	146 Å²	146	137.7 Å²	137.7	90%	0.896	76%	0.757	S	S	*	*			trans	-167.1	163.8	136.1	6.2	0	0	0	0	113.5
291	I	26	Very low	30.9	Very low	156 Å²	156	145.4 Å²	145.4	80%	0.8	78%	0.778	S	S	*	*			trans	-119	132.6	-177.8	-60.4	163.8	0	0	0	109.4
292	S	28.7	Very low	31	Very low	122 Å²	122	139.2 Å²	139.2	85%	0.853	77%	0.768	S	S	*	*			trans	-162.9	145.7	151.9	50.8	0	0	0	0	112.6
293	T	25.5	Very low	30.9	Very low	135 Å²	135	143.6 Å²	143.6	83%	0.828	79%	0.785	S	S	*	*			trans	-97.9	142.1	179.7	48.2	0	0	0	0	112
294	S	28.5	Very low	30.6	Very low	126 Å²	126	143.1 Å²	143.1	88%	0.881	78%	0.784	S	S	*	*			trans	-168	161.7	141.5	49.8	0	0	0	0	112.4
295	E	28.4	Very low	30.5	Very low	179 Å²	179	143.3 Å²	143.3	84%	0.836	79%	0.785	S	S	*	*			trans	-102	174.9	-162	-56.9	164.5	99	0	0	114.8
296	S	27.2	Very low	30.5	Very low	129 Å²	129	142 Å²	142	90%	0.902	79%	0.789	S	S	*	*			trans	82.4	153.5	145.8	81.8	0	0	0	0	119.7
297	G	29.7	Very low	31	Very low	77 Å²	77	140.3 Å²	140.3	79%	0.794	79%	0.79	S	S	*	*			trans	127.5	62.7	162.9	0	0	0	0	0	118.5
298	S	35.4	Very low	31.4	Very low	112 Å²	112	139.3 Å²	139.3	78%	0.783	79%	0.792	S	S	*	*			trans	-83.5	150.4	150.6	86.6	0	0	0	0	109
299	P	36.2	Very low	31.1	Very low	103 Å²	103	135.8 Å²	135.8	67%	0.669	79%	0.786	S	S	*	*				-159.3	143.2	99.8	36.2	-16	0	0	0	118.3
300	Y	30.3	Very low	31.3	Very low	216 Å²	216	138.6 Å²	138.6	85%	0.847	79%	0.79	S	S	*	*			trans	59.8	168.9	146	-73.7	-111.2	0	0	0	117.7
301	R	31.8	Very low	31.3	Very low	229 Å²	229	135.3 Å²	135.3	86%	0.864	78%	0.778	S	S	*	*			cis	-151.2	145	12.9	-160.1	172.8	-166.2	162.5	4.4	111
302	P	37.9	Very low	31.5	Very low	110 Å²	110	135 Å²	135	71%	0.714	78%	0.777	S	S	*	*			trans	-89.1	166.3	174	36.3	-36.2	0	0	0	113.5
303	K	33	Very low	31.7	Very low	202 Å²	202	138.7 Å²	138.7	88%	0.878	78%	0.777	S	S	*	*			trans	-146	153.9	158.8	-97.3	-163.7	173.1	-167	0	111.9
304	S	30.2	Very low	32	Very low	98 Å²	98	139.6 Å²	139.6	69%	0.685	78%	0.777	S	S	*	*			trans	-101.9	-154.9	-175.1	50.8	0	0	0	0	112.2
305	D	34.3	Very low	32.2	Very low	126 Å²	126	138.6 Å²	138.6	67%	0.674	77%	0.768	S	S	*	*			trans	98.7	91.9	161.9	-44.4	-15.3	0	0	0	112.6
306	I	30.5	Very low	32.5	Very low	155 Å²	155	138.3 Å²	138.3	80%	0.795	77%	0.766	S	S	*	*				100.1	129.8	59.4	-76	171.5	0	0	0	111.6
307	P	40.7	Very low	32.6	Very low	111 Å²	111	139.9 Å²	139.9	72%	0.721	76%	0.761	S	S	*	*			trans	-84.6	-173.6	-173	40.8	-43	0	0	0	112.2
308	P	36.3	Very low	32.7	Very low	112 Å²	112	142.6 Å²	142.6	73%	0.727	76%	0.756	S	S	*	*			cis	-151.8	-165.5	22.1	44.5	-21.8	0	0	0	119.2
309	S	25.4	Very low	32.5	Very low	91 Å²	91	142.4 Å²	142.4	64%	0.636	75%	0.75	S	S	*	*			trans	97.7	159.9	144.1	77.5	0	0	0	0	121.5
310	H	31.1	Very low	32.2	Very low	175 Å²	175	148 Å²	148	81%	0.81	76%	0.758	S	S	*	*			trans	71.2	138.7	176.3	-60.6	-72.5	0	0	0	118.4
311	A	30.9	Very low	32.1	Very low	77 Å²	77	141.9 Å²	141.9	64%	0.636	75%	0.747	S	S	*	*			cis	-157.4	129.7	-14.9	0	0	0	0	0	114.4
312	I	29.4	Very low	32.1	Very low	151 Å²	151	139.5 Å²	139.5	77%	0.774	74%	0.743	S	S	*	*				40.1	116.4	123.8	-46.8	163.8	0	0	0	118.9
313	K	32.2	Very low	31.7	Very low	198 Å²	198	139.7 Å²	139.7	86%	0.861	74%	0.738	S	S	*	*				-174.8	102.1	118.7	-102.8	175.2	-175.4	178.3	0	113.4
314	D	32.2	Very low	31.5	Very low	155 Å²	155	139 Å²	139	83%	0.829	74%	0.738	S	S	*	*			trans	-71.6	164.3	151.9	-67.1	-61.4	0	0	0	110
315	P	32.8	Very low	31.5	Very low	105 Å²	105	138.7 Å²	138.7	68%	0.682	74%	0.742	S	S	*	*				-144.5	135.2	89.3	35.8	-19.5	0	0	0	115
316	H	36	Very low	31.2	Very low	172 Å²	172	143.8 Å²	143.8	80%	0.796	75%	0.753	S	S	*	*				173.7	77	112.1	-93.6	-70.3	0	0	0	113.3
317	M	28	Very low	31.1	Very low	162 Å²	162	147.5 Å²	147.5	80%	0.798	76%	0.759	S	S	*	*			trans	-7	126.8	132.7	-149.3	-155.7	-44.2	0	0	115.8
318	I	31.8	Very low	30.5	Very low	134 Å²	134	146.4 Å²	146.4	69%	0.687	76%	0.759	S	S	*	*				169.7	112.1	116	-86.9	160.8	0	0	0	114.1
319	T	31	Very low	30.4	Very low	109 Å²	109	149.4 Å²	149.4	67%	0.669	76%	0.763	S	S	*	*			trans	66.8	123.9	150.4	57.3	0	0	0	0	125
320	R	30.3	Very low	30.4	Very low	220 Å²	220	153 Å²	153	83%	0.83	78%	0.775	S	S	*	*				97.3	76.3	124.9	-76.8	171.7	-177.2	173.4	0.5	121.8
321	S	29.3	Very low	30.5	Very low	88 Å²	88	150.4 Å²	150.4	62%	0.615	77%	0.766	S	S	*	*				74	146.9	101.6	64.6	0	0	0	0	122.5
322	F	31.5	Very low	30.5	Very low	178 Å²	178	151.8 Å²	151.8	78%	0.781	77%	0.768	S	S	*	*			trans	88.2	57.8	166.9	-66.3	-68.9	0	0	0	118.5
323	D	29.2	Very low	30.6	Very low	114 Å²	114	154.1 Å²	154.1	61%	0.61	77%	0.769	S	S	*	*				63.1	109	100.5	-49.6	-14.2	0	0	0	121
324	Q	28.4	Very low	30.6	Very low	187 Å²	187	152.3 Å²	152.3	87%	0.874	77%	0.769	S	S	*	*				48.5	104	114.4	-61.3	176.9	-21.1	0	0	120.2
325	A	29.6	Very low	30.4	Very low	93 Å²	93	152.8 Å²	152.8	77%	0.769	77%	0.765	S	S	*	*			trans	-158.7	81.3	145.3	0	0	0	0	0	111
326	Y	29	Very low	30.2	Very low	233 Å²	233	152.3 Å²	152.3	91%	0.914	77%	0.765	S	S	*	*			trans	-141.5	35.4	175.6	-114.7	-79.1	0	0	0	113.9
327	Y	28.5	Very low	29.9	Very low	233 Å²	233	151.2 Å²	151.2	91%	0.914	76%	0.764	S	S	*	*	S	Bend	trans	-136.8	155.8	162.5	-90.8	-85	0	0	0	108.8
328	A	27.7	Very low	29.9	Very low	88 Å²	88	150.5 Å²	150.5	73%	0.727	76%	0.763	S	S	*	*			trans	69.7	100	-175.7	0	0	0	0	0	116.7
329	H	33	Very low	29.8	Very low	174 Å²	174	148.6 Å²	148.6	81%	0.806	76%	0.759	S	S	*	*			trans	-154.5	55.8	137.8	-108.6	-56.9	0	0	0	112.2
330	N	27.3	Very low	29.6	Very low	166 Å²	166	149.1 Å²	149.1	89%	0.888	76%	0.763	S	S	*	*			trans	-90.9	99.8	156.1	-88.9	-7.2	0	0	0	107.9
331	I	33.3	Very low	29.5	Very low	122 Å²	122	144 Å²	144	63%	0.626	76%	0.756	S	S	*	*			trans	-137.4	113.8	167.1	-57.7	-179.5	0	0	0	107.9
332	P	30.7	Very low	29.4	Very low	105 Å²	105	146.1 Å²	146.1	68%	0.682	76%	0.761	S	S	*	*			trans	-78.3	133.6	172.1	31.7	-32	0	0	0	110.4	N334	P332-N334 PolarHBondContact O-N 2.82Å
333	Y	30.2	Very low	29.3	Very low	201 Å²	201	144.2 Å²	144.2	79%	0.788	76%	0.757	S	S	*	*			trans	-79.4	105.4	170.6	-94.5	-92.8	0	0	0	110.1
334	N	32	Very low	29.2	Very low	160 Å²	160	147.8 Å²	147.8	86%	0.856	76%	0.763	S	S	*	*			trans	-100.3	112.6	168.2	-127.7	-1.3	0	0	0	108.9	P332	P332-N334 PolarHBondContact O-N 2.82Å
335	H	28.3	Very low	29.2	Very low	164 Å²	164	149 Å²	149	76%	0.759	76%	0.76	S	S	*	*			trans	-134.3	103.5	-175.9	-112.6	-5.3	0	0	0	110.7
336	S	29.7	Very low	29.3	Very low	96 Å²	96	148.5 Å²	148.5	67%	0.671	75%	0.751	S	S	*	*			trans	-170.7	123.6	155.2	55.4	0	0	0	0	111.8
337	N	30	Very low	29.5	Very low	148 Å²	148	144.2 Å²	144.2	79%	0.791	74%	0.744	S	S	*	*			trans	66.7	146.7	138.7	-55.3	-12.6	0	0	0	118.5
338	L	27.5	Very low	29.6	Very low	148 Å²	148	142.2 Å²	142.2	78%	0.775	74%	0.743	S	S	*	*			cis	-141	-153.1	-4.5	-148.1	74	0	0	0	109.6
339	P	29.9	Very low	29.8	Very low	93 Å²	93	141.5 Å²	141.5	60%	0.604	74%	0.744	S	S	*	*				-119.1	170.3	-123.1	41.1	-24.4	0	0	0	117.4
340	T	26.1	Very low	29.7	Very low	121 Å²	121	140.6 Å²	140.6	74%	0.742	75%	0.745	S	S	*	*			trans	72.1	145.5	147.2	37.2	0	0	0	0	122
341	T	28.5	Very low	29.9	Very low	112 Å²	112	138.4 Å²	138.4	69%	0.687	74%	0.738	S	S	*	*			trans	66.3	101.2	152.1	46.5	0	0	0	0	120.5
342	N	27.9	Very low	29.7	Very low	133 Å²	133	138.5 Å²	138.5	71%	0.711	75%	0.746	S	S	*	*				82.7	112.4	117.4	-64.6	-2.9	0	0	0	121.3
343	I	27.4	Very low	29.8	Very low	137 Å²	137	139.6 Å²	139.6	70%	0.703	75%	0.751	S	S	*	*				79	106.4	120.8	-67	170.9	0	0	0	117.8
344	Y	27.6	Very low	29.7	Very low	189 Å²	189	135.3 Å²	135.3	74%	0.741	75%	0.745	S	S	*	*			trans	81	117.7	143.7	-83.7	-126.4	0	0	0	121.5
345	R	28.8	Very low	29.7	Very low	212 Å²	212	138.4 Å²	138.4	80%	0.8	75%	0.746	S	S	*	*				103.6	126.1	122.7	-103.3	-174.6	177.2	139.4	-0.6	120.1
346	S	32.1	Very low	29.7	Very low	84 Å²	84	139 Å²	139	59%	0.587	75%	0.747	S	S	*	*			trans	70.1	145.3	139.7	-61.9	0	0	0	0	119.8
347	D	32.8	Very low	29.6	Very low	142 Å²	142	141 Å²	141	76%	0.759	75%	0.75	S	S	*	*			cis	-156.5	172.7	-27.6	-101.4	-37.2	0	0	0	108.8
348	E	30.4	Very low	29.5	Very low	192 Å²	192	144.2 Å²	144.2	90%	0.897	75%	0.752	S	S	*	*			trans	-56	144.4	-171.2	-52.9	174.5	145.6	0	0	115.5
349	G	32.5	Very low	29.5	Very low	73 Å²	73	143.3 Å²	143.3	75%	0.753	74%	0.743	S	S	*	*			trans	-179.7	68.5	179.3	0	0	0	0	0	118.8
350	N	30	Very low	29.4	Very low	154 Å²	154	146.5 Å²	146.5	82%	0.824	75%	0.75	S	S	*	*			trans	5.6	141.8	145	-46.7	-40.2	0	0	0	118.7
351	V	32.4	Very low	29.5	Very low	121 Å²	121	146.9 Å²	146.9	73%	0.733	75%	0.752	S	S	*	*			cis	-156	142.8	32.5	177.3	0	0	0	0	110.7	V353	V351-V353 HydrophobicContact CG1-CG2 4.15Å
352	P	28.8	Very low	29.5	Very low	123 Å²	123	149.4 Å²	149.4	80%	0.799	76%	0.76	S	S	*	*			trans	-95	138.7	163.6	35.2	-29.9	0	0	0	112.7
353	V	33.6	Very low	29.4	Very low	129 Å²	129	150 Å²	150	78%	0.782	76%	0.763	S	S	*	*			trans	-123.2	122.9	174.2	-179.7	0	0	0	0	110.9	V351	V351-V353 HydrophobicContact CG1-CG2 4.15Å
354	T	27.5	Very low	29.5	Very low	110 Å²	110	150.6 Å²	150.6	68%	0.675	77%	0.767	S	S	*	*			trans	-85.9	151.1	177.7	52.9	0	0	0	0	112.6
355	Y	31.4	Very low	29.6	Very low	225 Å²	225	146.1 Å²	146.1	88%	0.882	76%	0.761	S	S	*	*			trans	-150.8	166	141.7	-106.2	-70.2	0	0	0	112
356	F	29.2	Very low	29.5	Very low	177 Å²	177	143.8 Å²	143.8	78%	0.776	76%	0.763	S	S	*	*			trans	-98.1	137.4	-155.8	-85.4	-107.5	0	0	0	115.9
357	D	27.8	Very low	29.4	Very low	138 Å²	138	148.9 Å²	148.9	74%	0.738	78%	0.775	S	S	*	*				20.5	124	126.6	-175.1	20.2	0	0	0	119.7
358	R	27.3	Very low	29.3	Very low	216 Å²	216	148.1 Å²	148.1	82%	0.815	78%	0.775	S	S	*	*			trans	-163.8	131.8	135.9	-113.1	-163.9	160.2	169.1	-4.7	115.5
359	H	28.2	Very low	29.2	Very low	128 Å²	128	148.1 Å²	148.1	59%	0.593	78%	0.775	S	S	*	*			trans	42	123.3	153.2	-71.1	-80.6	0	0	0	122.3
360	E	26.7	Very low	29.1	Very low	161 Å²	161	151 Å²	151	75%	0.752	78%	0.778	S	S	*	*			trans	55.4	100	131.1	-67.2	163.4	-133.9	0	0	120.4
361	T	29.3	Very low	29.3	Very low	129 Å²	129	150.3 Å²	150.3	79%	0.791	77%	0.774	S	S	*	*				-155.9	133	118.9	0.3	0	0	0	0	110.5	N363	T361-N363 PolarHBondContact O-N 3.01Å
362	I	27.2	Very low	29.4	Very low	165 Å²	165	150.9 Å²	150.9	85%	0.846	77%	0.774	S	S	*	*			trans	-84.9	91.6	177.4	-59.9	173.7	0	0	0	108.3
363	N	27.6	Very low	29.9	Very low	144 Å²	144	151.9 Å²	151.9	77%	0.77	77%	0.772	S	S	*	*			trans	-83.2	115.6	169	-75.1	-33.2	0	0	0	109.6	T361	T361-N363 PolarHBondContact O-N 3.01Å
364	L	28.2	Very low	30.1	Very low	150 Å²	150	153.1 Å²	153.1	79%	0.785	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-74.4	129	179.9	-157.1	78.1	0	0	0	109.9	I366	L364-I366 PolarHBondContact O-N 3.35Å
365	P	29.6	Very low	30.4	Very low	96 Å²	96	151.4 Å²	151.4	62%	0.623	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-69.1	128.1	171.1	28.3	-32.5	0	0	0	109.9	F367	P365-F367 PolarHBondContact O-N 3.25Å
366	I	26.5	Very low	30.7	Very low	162 Å²	162	150.5 Å²	150.5	83%	0.831	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-66	125.7	178	-63.6	160.3	0	0	0	108.9	L364	L364-I366 PolarHBondContact O-N 3.35Å
367	F	30.4	Very low	31	Very low	192 Å²	192	152.8 Å²	152.8	84%	0.842	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-89.6	136.4	168.4	-89.9	-86.9	0	0	0	110.5	P365	P365-F367 PolarHBondContact O-N 3.25Å
368	T	30.6	Very low	31.5	Very low	125 Å²	125	149.2 Å²	149.2	77%	0.767	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-78.1	154.8	-172.7	47.4	0	0	0	0	113.5
369	E	28.7	Very low	32	Very low	193 Å²	193	144.3 Å²	144.3	90%	0.902	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-68.2	125.7	-177.1	-59.8	161.8	117.9	0	0	113.1
370	T	30.2	Very low	32.8	Very low	132 Å²	132	141.6 Å²	141.6	81%	0.81	76%	0.761	S	S	*	*			trans	-157.5	80.1	157.9	46.6	0	0	0	0	111.1
371	D	33.6	Very low	33.6	Very low	140 Å²	140	138.4 Å²	138.4	75%	0.749	75%	0.749	S	S	*	*			trans	-175.9	86.8	148.8	-111.7	-25.2	0	0	0	111.6	N373	D371-N373 PolarHBondContact O-N 3.02Å
372	D	35.5	Very low	34.9	Very low	134 Å²	134	137 Å²	137	72%	0.717	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	-0.4	-171.1	-79.2	-53	0	0	0	116.8
373	N	39.5	Very low	36.3	Very low	144 Å²	144	133.7 Å²	133.7	77%	0.77	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.1	-5.8	-171.1	-67.5	-67.4	0	0	0	114.5	D371	D371-N373 PolarHBondContact O-N 3.02Å
374	L	36.3	Very low	38	Very low	155 Å²	155	129.1 Å²	129.1	81%	0.812	71%	0.707	S	S	*	*	S	Bend	trans	-106.4	-18.9	179.8	-141.4	74.1	0	0	0	114.4	R376	L374-R376 PolarHBondContact O-N 2.86Å
375	S	35.5	Very low	39.6	Very low	73 Å²	73	124.2 Å²	124.2	51%	0.51	68%	0.684	S	S	.	*	G	3₁₀ helix	trans	-67.6	-30.9	-176.2	54.8	0	0	0	0	114	Y377 A378	S375-Y377 PolarHBondContact O-N 2.94Å; S375-Y377 VanDerWaalsContact O-N 3.11Å; S375-A378 PolarHBondContact O-N 3.1Å
376	R	36.5	Very low	40.8	Very low	207 Å²	207	126.2 Å²	126.2	78%	0.781	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-73.5	-1.4	-168.9	-154.7	172.9	-66.5	-175	0.4	115.8	L374	L374-R376 PolarHBondContact O-N 2.86Å
377	Y	36	Very low	42.3	Very low	225 Å²	225	125.1 Å²	125.1	88%	0.882	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-113.1	0.4	177.7	-88.8	-79.1	0	0	0	114.7	S375	S375-Y377 PolarHBondContact O-N 2.94Å; S375-Y377 VanDerWaalsContact O-N 3.11Å
378	A	38.7	Very low	43.9	Very low	63 Å²	63	123.5 Å²	123.5	52%	0.521	66%	0.663	S	S	.	*	T	Hydrogen-bonded Turn	trans	-116.2	-6.1	-177.4	0	0	0	0	0	114.7	S375 G380	S375-A378 PolarHBondContact O-N 3.1Å; A378-G380 PolarHBondContact O-N 3.37Å
379	S	37.6	Very low	44.8	Very low	113 Å²	113	123 Å²	123	79%	0.79	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	45.6	-171.3	65.1	0	0	0	0	114.5
380	G	44.2	Very low	46	Very low	71 Å²	71	118.7 Å²	118.7	73%	0.732	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-170.2	16.8	-174.6	0	0	0	0	0	115.8	A378	A378-G380 PolarHBondContact O-N 3.37Å
381	L	43.8	Very low	47.1	Very low	94 Å²	94	116.3 Å²	116.3	49%	0.492	62%	0.624	S	S	.	*	S	Bend	trans	-119.3	145.1	171.2	-74.2	97.6	0	0	0	111.3	T385	L381-T385 HydrophobicContact CD2-CG2 3.63Å
382	D	56.5	Low	47.9	Very low	98 Å²	98	113 Å²	113	52%	0.524	61%	0.607	S	S	.	*			trans	-65	145.1	175.2	56.9	-62	0	0	0	112.2	G384 T385 R386	D382-G384 VanDerWaalsContact C-N 3.25Å; D382-G384 PolarHBondContact O-N 3.36Å; D382-T385 VanDerWaalsContact CG-OG1 3.25Å; D382-T385 WeakPolarHBondContact O-CA 3.39Å; D382-T385 PolarHBondContact O-N 3.25Å; D382-T385 VanDerWaalsContact OD1-CB 3.31Å; D382-T385 WeakPolarHBondContact OD1-CB 3.42Å; D382-T385 PolarHBondContact OD1-OG1 2.89Å; D382-T385 PolarHBondContact OD2-N 2.88Å; D382-T385 PolarHBondContact OD2-OG1 2.89Å; D382-R386 PolarHBondContact O-N 2.93Å
383	D	56	Low	48.2	Very low	96 Å²	96	112.9 Å²	112.9	51%	0.513	60%	0.603	S	S	.	*	H	α-helix	trans	-58.6	-34.7	-175.2	-79.8	-61.5	0	0	0	113.5	T385 R386 E387	D383-T385 VanDerWaalsContact C-N 3.29Å; D383-T385 PolarHBondContact O-N 3.39Å; D383-R386 WeakPolarHBondContact O-CB 3.37Å; D383-R386 PolarHBondContact O-N 3.33Å; D383-R386 VanDerWaalsContact O-N 3.13Å; D383-R386 IonicContact OD1-CZ 3.97Å; D383-R386 IonicContact OD1-NE 3.94Å; D383-R386 PolarHBondContact OD1-NE 2.75Å; D383-R386 IonicContact OD1-NH2 3.31Å; D383-R386 PolarHBondContact OD1-NH2 3.36Å; D383-E387 PolarHBondContact O-N 3.3Å
384	G	63.2	Low	48.4	Very low	48 Å²	48	113.8 Å²	113.8	50%	0.495	60%	0.603	S	S	.	*	H	α-helix	trans	-62.3	-34.5	174.2	0	0	0	0	0	113.2	D382 K388	D382-G384 VanDerWaalsContact C-N 3.25Å; D382-G384 PolarHBondContact O-N 3.36Å; G384-K388 WeakPolarHBondContact O-CB 3.32Å; G384-K388 PolarHBondContact O-N 2.89Å
385	T	63.5	Low	48.6	Very low	48 Å²	48	110 Å²	110	29%	0.294	59%	0.589	S	S	.	*	H	α-helix	trans	-79	-32.2	172.3	-58.3	0	0	0	0	112	L381 D382 D383 K388 M389	L381-T385 HydrophobicContact CD2-CG2 3.63Å; D382-T385 VanDerWaalsContact CG-OG1 3.25Å; D382-T385 WeakPolarHBondContact O-CA 3.39Å; D382-T385 PolarHBondContact O-N 3.25Å; D382-T385 VanDerWaalsContact OD1-CB 3.31Å; D382-T385 WeakPolarHBondContact OD1-CB 3.42Å; D382-T385 PolarHBondContact OD1-OG1 2.89Å; D382-T385 PolarHBondContact OD2-N 2.88Å; D382-T385 PolarHBondContact OD2-OG1 2.89Å; D383-T385 VanDerWaalsContact C-N 3.29Å; D383-T385 PolarHBondContact O-N 3.39Å; T385-K388 PolarHBondContact O-N 3.41Å; T385-M389 WeakPolarHBondContact O-CB 3.39Å; T385-M389 PolarHBondContact O-N 3.42Å
386	R	53.1	Low	48.7	Very low	138 Å²	138	115.2 Å²	115.2	52%	0.521	60%	0.597	S	S	.	*	H	α-helix	trans	-63.4	-49.4	174.1	-168.7	170.8	68	100.9	-3.5	112	D382 D383 K388 M389 L390	D382-R386 PolarHBondContact O-N 2.93Å; D383-R386 WeakPolarHBondContact O-CB 3.37Å; D383-R386 PolarHBondContact O-N 3.33Å; D383-R386 VanDerWaalsContact O-N 3.13Å; D383-R386 IonicContact OD1-CZ 3.97Å; D383-R386 IonicContact OD1-NE 3.94Å; D383-R386 PolarHBondContact OD1-NE 2.75Å; D383-R386 IonicContact OD1-NH2 3.31Å; D383-R386 PolarHBondContact OD1-NH2 3.36Å; R386-K388 VanDerWaalsContact C-N 3.32Å; R386-K388 PolarHBondContact O-N 3.46Å; R386-M389 PolarHBondContact O-N 2.86Å; R386-L390 HydrophobicContact CG-CD1 4.35Å; R386-L390 WeakPolarHBondContact O-CG 3.3Å; R386-L390 PolarHBondContact O-N 3.18Å
387	E	59.8	Low	48.4	Very low	139 Å²	139	109 Å²	109	65%	0.65	59%	0.586	S	S	*	*	H	α-helix	trans	-61.5	-40.5	173.7	-71.8	-169.7	155.6	0	0	111.8	D383 L390 S391	D383-E387 PolarHBondContact O-N 3.3Å; E387-L390 PolarHBondContact O-N 2.94Å; E387-S391 VanDerWaalsContact O-CB 3.25Å; E387-S391 WeakPolarHBondContact O-CB 3.33Å; E387-S391 PolarHBondContact O-N 2.79Å
388	K	64	Low	48.2	Very low	157 Å²	157	103.2 Å²	103.2	68%	0.683	57%	0.573	S	S	*	*	H	α-helix	trans	-67.7	-35.6	178.3	-167.7	170.3	-174.9	175.6	0	112.6	G384 T385 R386 D392	G384-K388 WeakPolarHBondContact O-CB 3.32Å; G384-K388 PolarHBondContact O-N 2.89Å; T385-K388 PolarHBondContact O-N 3.41Å; R386-K388 VanDerWaalsContact C-N 3.32Å; R386-K388 PolarHBondContact O-N 3.46Å; K388-D392 WeakPolarHBondContact O-CB 3.48Å; K388-D392 PolarHBondContact O-N 3.49Å
389	M	48.5	Very low	47.9	Very low	116 Å²	116	108.9 Å²	108.9	57%	0.571	59%	0.589	S	S	*	*	H	α-helix	trans	-69.4	-41.9	170.5	-87.1	-169	157	0	0	112.4	T385 R386 S391 D392 M393	T385-M389 WeakPolarHBondContact O-CB 3.39Å; T385-M389 PolarHBondContact O-N 3.42Å; R386-M389 PolarHBondContact O-N 2.86Å; M389-S391 VanDerWaalsContact C-N 3.33Å; M389-S391 PolarHBondContact O-N 2.88Å; M389-D392 CarbonylContact O-C 3.56Å; M389-D392 PolarHBondContact O-N 3.48Å; M389-M393 WeakPolarHBondContact O-CB 3.07Å; M389-M393 WeakPolarHBondContact O-CG 3.1Å; M389-M393 PolarHBondContact O-N 2.9Å
390	L	53	Low	47.5	Very low	102 Å²	102	113 Å²	113	53%	0.534	59%	0.587	S	S	.	*	H	α-helix	trans	-63	-41.5	175.6	-74	166.2	0	0	0	111.3	R386 E387 M393 H394	R386-L390 HydrophobicContact CG-CD1 4.35Å; R386-L390 WeakPolarHBondContact O-CG 3.3Å; R386-L390 PolarHBondContact O-N 3.18Å; E387-L390 PolarHBondContact O-N 2.94Å; L390-M393 PolarHBondContact O-N 3.47Å; L390-H394 PolarHBondContact O-N 2.9Å
391	S	53.7	Low	46.7	Very low	81 Å²	81	111.3 Å²	111.3	57%	0.566	57%	0.57	S	S	*	*	H	α-helix	trans	-59.3	-47.5	171.7	-178.1	0	0	0	0	112	E387 M389 M393 H394 S395	E387-S391 VanDerWaalsContact O-CB 3.25Å; E387-S391 WeakPolarHBondContact O-CB 3.33Å; E387-S391 PolarHBondContact O-N 2.79Å; M389-S391 VanDerWaalsContact C-N 3.33Å; M389-S391 PolarHBondContact O-N 2.88Å; S391-M393 VanDerWaalsContact C-N 3.32Å; S391-M393 PolarHBondContact O-N 3.04Å; S391-H394 PolarHBondContact O-N 3.1Å; S391-S395 WeakPolarHBondContact O-CB 3.42Å; S391-S395 PolarHBondContact O-N 3.46Å
392	D	51.2	Low	46	Very low	72 Å²	72	111 Å²	111	39%	0.385	57%	0.574	S	S	.	*	H	α-helix	trans	-78.5	-13.4	-179.9	-145.2	45.5	0	0	0	113.9	K388 M389 S395 R396	K388-D392 WeakPolarHBondContact O-CB 3.48Å; K388-D392 PolarHBondContact O-N 3.49Å; M389-D392 CarbonylContact O-C 3.56Å; M389-D392 PolarHBondContact O-N 3.48Å; D392-S395 WeakPolarHBondContact CA-OG 3.46Å; D392-S395 PolarHBondContact O-OG 3.25Å; D392-S395 VanDerWaalsContact O-OG 3.1Å; D392-S395 PolarHBondContact OD1-OG 3.24Å; D392-R396 WeakPolarHBondContact O-CB 3.49Å; D392-R396 WeakPolarHBondContact O-CD 3.45Å; D392-R396 WeakPolarHBondContact O-CG 3.42Å; D392-R396 IonicContact OD1-NE 2.73Å; D392-R396 IonicContact OD2-CZ 2.69Å; D392-R396 IonicContact OD2-NE 3.3Å; D392-R396 PolarHBondContact OD2-NE 3.2Å; D392-R396 IonicContact OD2-NH2 2.82Å; D392-R396 PolarHBondContact OD2-NH2 3.5Å
393	M	41.1	Very low	44.7	Very low	131 Å²	131	112 Å²	112	65%	0.645	58%	0.578	S	S	*	*	H	α-helix	trans	-78.6	-44.6	164.3	-77.3	-175.8	67.7	0	0	111.2	M389 L390 S391 S395 R396 S397	M389-M393 WeakPolarHBondContact O-CB 3.07Å; M389-M393 WeakPolarHBondContact O-CG 3.1Å; M389-M393 PolarHBondContact O-N 2.9Å; L390-M393 PolarHBondContact O-N 3.47Å; S391-M393 VanDerWaalsContact C-N 3.32Å; S391-M393 PolarHBondContact O-N 3.04Å; M393-S395 VanDerWaalsContact C-N 3.27Å; M393-S395 PolarHBondContact O-N 3.21Å; M393-R396 CarbonylContact O-C 3.57Å; M393-R396 PolarHBondContact O-N 2.91Å; M393-R396 VanDerWaalsContact O-N 3.1Å; M393-S397 VanDerWaalsContact O-CB 3.31Å; M393-S397 WeakPolarHBondContact O-CB 3.49Å; M393-S397 PolarHBondContact O-N 3.03Å; M393-S397 PolarHBondContact O-OG 3.37Å
394	H	43.6	Very low	43.4	Very low	163 Å²	163	118 Å²	118	76%	0.755	59%	0.594	S	S	*	*	H	α-helix	trans	-61.5	-33.4	171.9	-103	19	0	0	0	112.6	L390 S391 R396	L390-H394 PolarHBondContact O-N 2.9Å; S391-H394 PolarHBondContact O-N 3.1Å; H394-R396 VanDerWaalsContact C-N 3.27Å; H394-R396 PolarHBondContact O-N 3.04Å
395	S	41	Very low	41.8	Very low	74 Å²	74	125.8 Å²	125.8	52%	0.517	61%	0.609	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.5	-21.4	175.1	84.5	0	0	0	0	113.2	S391 D392 M393	S391-S395 WeakPolarHBondContact O-CB 3.42Å; S391-S395 PolarHBondContact O-N 3.46Å; D392-S395 WeakPolarHBondContact CA-OG 3.46Å; D392-S395 PolarHBondContact O-OG 3.25Å; D392-S395 VanDerWaalsContact O-OG 3.1Å; D392-S395 PolarHBondContact OD1-OG 3.24Å; M393-S395 VanDerWaalsContact C-N 3.27Å; M393-S395 PolarHBondContact O-N 3.21Å
396	R	36.8	Very low	40.2	Very low	183 Å²	183	132.7 Å²	132.7	69%	0.691	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.6	-16.6	-174.9	-66.2	174.7	-166.5	-127.5	7	114.7	D392 M393 H394 V398	D392-R396 WeakPolarHBondContact O-CB 3.49Å; D392-R396 WeakPolarHBondContact O-CD 3.45Å; D392-R396 WeakPolarHBondContact O-CG 3.42Å; D392-R396 IonicContact OD1-NE 2.73Å; D392-R396 IonicContact OD2-CZ 2.69Å; D392-R396 IonicContact OD2-NE 3.3Å; D392-R396 PolarHBondContact OD2-NE 3.2Å; D392-R396 IonicContact OD2-NH2 2.82Å; D392-R396 PolarHBondContact OD2-NH2 3.5Å; M393-R396 CarbonylContact O-C 3.57Å; M393-R396 PolarHBondContact O-N 2.91Å; M393-R396 VanDerWaalsContact O-N 3.1Å; H394-R396 VanDerWaalsContact C-N 3.27Å; H394-R396 PolarHBondContact O-N 3.04Å; R396-V398 PolarHBondContact O-N 3.24Å
397	S	30.7	Very low	39.1	Very low	77 Å²	77	131.2 Å²	131.2	54%	0.538	64%	0.637	S	S	.	*			trans	-76.6	64.8	-179.9	64.2	0	0	0	0	112	M393 H399	M393-S397 VanDerWaalsContact O-CB 3.31Å; M393-S397 WeakPolarHBondContact O-CB 3.49Å; M393-S397 PolarHBondContact O-N 3.03Å; M393-S397 PolarHBondContact O-OG 3.37Å; S397-H399 PolarHBondContact O-N 2.74Å
398	V	32.4	Very low	37.8	Very low	103 Å²	103	132.3 Å²	132.3	62%	0.624	64%	0.643	S	S	*	*			trans	-68.6	96.5	176.1	-179.9	0	0	0	0	109.4	R396 W400	R396-V398 PolarHBondContact O-N 3.24Å; V398-W400 PolarHBondContact O-N 2.97Å
399	H	32	Very low	36.3	Very low	183 Å²	183	133.5 Å²	133.5	85%	0.847	64%	0.643	S	S	*	*			trans	-74.7	114.2	174.9	-158	69.1	0	0	0	109.3	S397 G401	S397-H399 PolarHBondContact O-N 2.74Å; H399-G401 VanDerWaalsContact C-N 3.28Å; H399-G401 PolarHBondContact O-N 3.09Å
400	W	28.6	Very low	35.4	Very low	199 Å²	199	138.9 Å²	138.9	75%	0.754	66%	0.658	S	S	*	*			trans	-79.7	71.7	-174.2	-71.1	78	0	0	0	111.9	V398 I403	V398-W400 PolarHBondContact O-N 2.97Å; W400-I403 HydrophobicContact CE3-CD1 3.82Å; W400-I403 HydrophobicContact CZ3-CD1 3.66Å
401	G	27.7	Very low	34.6	Very low	36 Å²	36	140.9 Å²	140.9	37%	0.371	66%	0.66	S	S	.	*			trans	-72.7	176.7	162.9	0	0	0	0	0	112.7	H399 I403	H399-G401 VanDerWaalsContact C-N 3.28Å; H399-G401 PolarHBondContact O-N 3.09Å; G401-I403 PolarHBondContact O-N 3.34Å; G401-I403 VanDerWaalsContact O-N 3.16Å
402	P	30.5	Very low	34.1	Very low	87 Å²	87	141 Å²	141	57%	0.565	66%	0.657	S	S	*	*			trans	-67.5	117.3	-169.6	23.7	-30.5	0	0	0	111.3	Y404 E1048	P402-Y404 VanDerWaalsContact C-N 3.3Å; P402-Y404 PolarHBondContact O-N 2.94Å; P402-E1048 VanDerWaalsContact CB-OE1 3.3Å; P402-E1048 WeakPolarHBondContact CB-OE1 3.41Å; P402-E1048 WeakPolarHBondContact CD-OE1 3.45Å
403	I	28.1	Very low	33.9	Very low	119 Å²	119	145.9 Å²	145.9	61%	0.61	68%	0.675	S	S	*	*			trans	-73.7	80.4	-171.7	-48.8	174.1	0	0	0	111.4	W400 G401 R405	W400-I403 HydrophobicContact CE3-CD1 3.82Å; W400-I403 HydrophobicContact CZ3-CD1 3.66Å; G401-I403 PolarHBondContact O-N 3.34Å; G401-I403 VanDerWaalsContact O-N 3.16Å; I403-R405 VanDerWaalsContact C-N 3.33Å; I403-R405 PolarHBondContact O-N 3Å
404	Y	28.4	Very low	34.7	Very low	221 Å²	221	144.6 Å²	144.6	87%	0.867	67%	0.671	S	S	*	*			trans	-62.7	101.9	149	-86.2	-85.1	0	0	0	107.7	P402 K406	P402-Y404 VanDerWaalsContact C-N 3.3Å; P402-Y404 PolarHBondContact O-N 2.94Å; Y404-K406 VanDerWaalsContact C-N 3.28Å; Y404-K406 PolarHBondContact O-N 3.31Å
405	R	29.7	Very low	35.2	Very low	212 Å²	212	140.9 Å²	140.9	80%	0.8	65%	0.654	S	S	*	*			trans	-63	77.7	-167.9	-166.1	-175.9	-166.2	163.7	8.4	112.8	I403 D407	I403-R405 VanDerWaalsContact C-N 3.33Å; I403-R405 PolarHBondContact O-N 3Å; R405-D407 HydrophobicContact CG-CB 4.3Å; R405-D407 PolarHBondContact O-N 3.43Å
406	K	30	Very low	36.3	Very low	193 Å²	193	143.8 Å²	143.8	84%	0.839	66%	0.657	S	S	*	*			trans	-77.9	37.1	-176.3	-150.6	176.8	-176.2	-179	0	113.3	Y404 Q408	Y404-K406 VanDerWaalsContact C-N 3.28Å; Y404-K406 PolarHBondContact O-N 3.31Å; K406-Q408 PolarHBondContact O-N 3.47Å
407	D	30.7	Very low	37.6	Very low	107 Å²	107	141.9 Å²	141.9	57%	0.572	65%	0.65	S	S	*	*			trans	-76.1	42	175.9	-127.7	-27.8	0	0	0	110.9	R405 R409	R405-D407 HydrophobicContact CG-CB 4.3Å; R405-D407 PolarHBondContact O-N 3.43Å; D407-R409 PolarHBondContact O-N 3.48Å
408	Q	32.6	Very low	39.7	Very low	162 Å²	162	142.5 Å²	142.5	76%	0.757	65%	0.646	S	S	*	*			trans	-75.1	73.6	168.5	-80.4	-169.3	-15.7	0	0	109	K406 Y410	K406-Q408 PolarHBondContact O-N 3.47Å; Q408-Y410 PolarHBondContact O-N 3.13Å
409	R	32.1	Very low	41.4	Very low	182 Å²	182	141.3 Å²	141.3	69%	0.687	64%	0.636	S	S	*	*			trans	-52.1	127	153.4	-60.9	-174.7	-171.6	-162.7	-0.1	106.9	D407 Y411	D407-R409 PolarHBondContact O-N 3.48Å; R409-Y411 HydrophobicContact CB-CD2 4.42Å; R409-Y411 HydrophobicContact CB-CE2 4.38Å; R409-Y411 PolarHBondContact O-N 3.38Å
410	Y	30.3	Very low	43.4	Very low	229 Å²	229	136 Å²	136	90%	0.898	61%	0.612	S	S	*	*			trans	-68.1	74.7	174.7	-86.4	-103.6	0	0	0	110.2	Q408 T412	Q408-Y410 PolarHBondContact O-N 3.13Å; Y410-T412 PolarHBondContact O-N 3.45Å; Y410-T412 VanDerWaalsContact O-N 3.12Å
411	Y	34.9	Very low	45.7	Very low	144 Å²	144	131.1 Å²	131.1	57%	0.565	60%	0.598	S	S	*	*			trans	-61.5	110.3	153.6	-76.3	-70.3	0	0	0	106.5	R409 H415	R409-Y411 HydrophobicContact CB-CD2 4.42Å; R409-Y411 HydrophobicContact CB-CE2 4.38Å; R409-Y411 PolarHBondContact O-N 3.38Å; Y411-H415 HydrophobicContact CD1-CB 3.96Å; Y411-H415 AromaticContact CD1-CD2 3.79Å; Y411-H415 AromaticContact CD1-CG 3.63Å; Y411-H415 AromaticContact CD1-ND1 3.99Å
412	T	44.6	Very low	48.1	Very low	84 Å²	84	134.5 Å²	134.5	52%	0.515	60%	0.604	S	S	.	*			trans	-51.2	150.8	169.8	53.5	0	0	0	0	109.4	Y410 D414 H415 F416	Y410-T412 PolarHBondContact O-N 3.45Å; Y410-T412 VanDerWaalsContact O-N 3.12Å; T412-D414 PolarHBondContact O-N 3.13Å; T412-H415 PolarHBondContact O-N 2.84Å; T412-F416 PolarHBondContact O-N 3.25Å
413	K	45.9	Very low	50	Low	175 Å²	175	139.1 Å²	139.1	76%	0.761	61%	0.61	S	S	*	*	H	α-helix	trans	-51.2	-35	-176.5	-134.4	169.5	-175.4	174.6	0	111.2	F416 W417	K413-F416 PolarHBondContact O-N 3.05Å; K413-W417 VanDerWaalsContact O-CD1 3.31Å; K413-W417 PolarHBondContact O-N 2.97Å; K413-W417 VanDerWaalsContact O-N 3.14Å
414	D	57.2	Low	52.5	Low	103 Å²	103	138.4 Å²	138.4	55%	0.551	60%	0.602	S	S	*	*	H	α-helix	trans	-63.4	-41	176.5	-40.5	-66.4	0	0	0	112.8	T412 F416 W417 I418	T412-D414 PolarHBondContact O-N 3.13Å; D414-F416 VanDerWaalsContact C-N 3.29Å; D414-F416 PolarHBondContact O-N 2.9Å; D414-W417 CarbonylContact O-C 3.56Å; D414-W417 PolarHBondContact O-N 3.5Å; D414-W417 VanDerWaalsContact O-N 3.13Å; D414-I418 WeakPolarHBondContact O-CB 3.43Å; D414-I418 WeakPolarHBondContact O-CG1 3.14Å; D414-I418 PolarHBondContact O-N 3.45Å
415	H	55.4	Low	54.7	Low	86 Å²	86	135.3 Å²	135.3	40%	0.398	59%	0.589	S	S	.	*	H	α-helix	trans	-71.1	-24.6	-177.7	-154.8	-32.9	0	0	0	112.7	Y411 T412 N419	Y411-H415 HydrophobicContact CD1-CB 3.96Å; Y411-H415 AromaticContact CD1-CD2 3.79Å; Y411-H415 AromaticContact CD1-CG 3.63Å; Y411-H415 AromaticContact CD1-ND1 3.99Å; T412-H415 PolarHBondContact O-N 2.84Å; H415-N419 PolarHBondContact ND1-ND2 3.39Å; H415-N419 PolarHBondContact O-N 3.36Å; H415-N419 PolarHBondContact O-ND2 3.32Å
416	F	63.2	Low	56.8	Low	135 Å²	135	129.3 Å²	129.3	59%	0.592	57%	0.573	S	S	*	*	H	α-helix	trans	-74.6	-44	166.8	-175.3	-95.2	0	0	0	111.5	T412 K413 D414 N419 Q420	T412-F416 PolarHBondContact O-N 3.25Å; K413-F416 PolarHBondContact O-N 3.05Å; D414-F416 VanDerWaalsContact C-N 3.29Å; D414-F416 PolarHBondContact O-N 2.9Å; F416-N419 PolarHBondContact O-N 2.89Å; F416-Q420 HydrophobicContact CE1-CG 4.35Å; F416-Q420 PolarHBondContact O-N 3.34Å
417	W	65.5	Low	59	Low	143 Å²	143	125.6 Å²	125.6	54%	0.542	56%	0.558	S	S	.	*	H	α-helix	trans	-62.4	-42.3	176.4	-90.1	111.3	0	0	0	113.4	K413 D414 Q420 Q421	K413-W417 VanDerWaalsContact O-CD1 3.31Å; K413-W417 PolarHBondContact O-N 2.97Å; K413-W417 VanDerWaalsContact O-N 3.14Å; D414-W417 CarbonylContact O-C 3.56Å; D414-W417 PolarHBondContact O-N 3.5Å; D414-W417 VanDerWaalsContact O-N 3.13Å; W417-Q420 PolarHBondContact O-N 2.96Å; W417-Q421 WeakPolarHBondContact O-CB 3.39Å; W417-Q421 PolarHBondContact O-N 3.37Å
418	I	73.3	Confident	61	Low	89 Å²	89	126.1 Å²	126.1	46%	0.456	56%	0.558	S	S	.	*	H	α-helix	trans	-60.5	-47.9	175.4	-70.9	162.9	0	0	0	109.7	D414 Q420 Q421 Q422	D414-I418 WeakPolarHBondContact O-CB 3.43Å; D414-I418 WeakPolarHBondContact O-CG1 3.14Å; D414-I418 PolarHBondContact O-N 3.45Å; I418-Q420 VanDerWaalsContact C-N 3.35Å; I418-Q420 PolarHBondContact O-N 3.23Å; I418-Q421 PolarHBondContact O-N 3.4Å; I418-Q422 VanDerWaalsContact O-CB 3.24Å; I418-Q422 WeakPolarHBondContact O-CB 3.48Å; I418-Q422 PolarHBondContact O-N 3.19Å
419	N	69.5	Low	62.8	Low	78 Å²	78	124.4 Å²	124.4	42%	0.417	55%	0.55	S	S	.	.	H	α-helix	trans	-60.8	-40.3	175.6	-90.3	-62.8	0	0	0	112.7	H415 F416 Q422 R423	H415-N419 PolarHBondContact ND1-ND2 3.39Å; H415-N419 PolarHBondContact O-N 3.36Å; H415-N419 PolarHBondContact O-ND2 3.32Å; F416-N419 PolarHBondContact O-N 2.89Å; N419-Q422 PolarHBondContact O-N 2.96Å; N419-R423 WeakPolarHBondContact O-CG 3.48Å; N419-R423 PolarHBondContact O-N 2.98Å
420	Q	73.5	Confident	64.5	Low	72 Å²	72	122.8 Å²	122.8	34%	0.336	55%	0.547	S	S	.	.	H	α-helix	trans	-64.2	-46.4	173.4	-97.5	-138.8	30.9	0	0	112.5	F416 W417 I418 Q422 R423 K424	F416-Q420 HydrophobicContact CE1-CG 4.35Å; F416-Q420 PolarHBondContact O-N 3.34Å; W417-Q420 PolarHBondContact O-N 2.96Å; I418-Q420 VanDerWaalsContact C-N 3.35Å; I418-Q420 PolarHBondContact O-N 3.23Å; Q420-Q422 VanDerWaalsContact C-N 3.31Å; Q420-Q422 PolarHBondContact O-N 3.28Å; Q420-R423 PolarHBondContact O-N 3.47Å; Q420-K424 WeakPolarHBondContact O-CB 3.28Å; Q420-K424 WeakPolarHBondContact O-CG 3.28Å; Q420-K424 PolarHBondContact O-N 2.91Å
421	Q	77.3	Confident	66	Low	96 Å²	96	117.4 Å²	117.4	45%	0.449	53%	0.534	S	S	.	.	H	α-helix	trans	-64.5	-36.7	177.3	-77.6	-169.9	-5.7	0	0	111.6	W417 I418 K424 R425	W417-Q421 WeakPolarHBondContact O-CB 3.39Å; W417-Q421 PolarHBondContact O-N 3.37Å; I418-Q421 PolarHBondContact O-N 3.4Å; Q421-K424 PolarHBondContact O-N 3.35Å; Q421-R425 WeakPolarHBondContact O-CB 3.37Å; Q421-R425 VanDerWaalsContact O-CG 3.28Å; Q421-R425 WeakPolarHBondContact O-CG 3.18Å; Q421-R425 PolarHBondContact O-N 2.88Å
422	Q	78.2	Confident	67.3	Low	108 Å²	108	117.6 Å²	117.6	51%	0.505	54%	0.538	S	S	.	.	H	α-helix	trans	-73.6	-35	-179.6	-161.5	162.5	5.5	0	0	111.8	I418 N419 Q420 N426	I418-Q422 VanDerWaalsContact O-CB 3.24Å; I418-Q422 WeakPolarHBondContact O-CB 3.48Å; I418-Q422 PolarHBondContact O-N 3.19Å; N419-Q422 PolarHBondContact O-N 2.96Å; Q420-Q422 VanDerWaalsContact C-N 3.31Å; Q420-Q422 PolarHBondContact O-N 3.28Å; Q422-N426 WeakPolarHBondContact O-CB 3.47Å; Q422-N426 VanDerWaalsContact O-CG 3.31Å; Q422-N426 PolarHBondContact O-N 3.45Å
423	R	70.6	Confident	67.8	Low	184 Å²	184	117.7 Å²	117.7	69%	0.694	54%	0.538	S	S	*	.	H	α-helix	trans	-60.9	-50.1	165.4	-74.8	-174.1	-179.6	-157.8	1.3	111.6	N419 Q420 R425 N426 E427	N419-R423 WeakPolarHBondContact O-CG 3.48Å; N419-R423 PolarHBondContact O-N 2.98Å; Q420-R423 PolarHBondContact O-N 3.47Å; R423-R425 VanDerWaalsContact C-N 3.33Å; R423-R425 PolarHBondContact O-N 2.77Å; R423-N426 PolarHBondContact O-N 3.48Å; R423-N426 VanDerWaalsContact O-N 3.12Å; R423-E427 WeakPolarHBondContact O-CG 3.49Å; R423-E427 PolarHBondContact O-N 3.49Å
424	K	78.7	Confident	68	Low	103 Å²	103	117 Å²	117	45%	0.448	54%	0.536	S	S	.	.	H	α-helix	trans	-60.4	-38	177.4	-75.5	166.2	171.9	164.4	0	112.8	Q420 Q421 Q428	Q420-K424 WeakPolarHBondContact O-CB 3.28Å; Q420-K424 WeakPolarHBondContact O-CG 3.28Å; Q420-K424 PolarHBondContact O-N 2.91Å; Q421-K424 PolarHBondContact O-N 3.35Å; K424-Q428 WeakPolarHBondContact O-CB 3.34Å; K424-Q428 WeakPolarHBondContact O-CG 3.31Å; K424-Q428 PolarHBondContact O-N 2.9Å
425	R	75.4	Confident	67.2	Low	157 Å²	157	120.1 Å²	120.1	59%	0.592	54%	0.541	S	S	*	.	H	α-helix	trans	-66.2	-42.6	172.7	-75	-179.7	-157.3	-178.2	9.9	111.7	Q421 R423 Q428 Q429	Q421-R425 WeakPolarHBondContact O-CB 3.37Å; Q421-R425 VanDerWaalsContact O-CG 3.28Å; Q421-R425 WeakPolarHBondContact O-CG 3.18Å; Q421-R425 PolarHBondContact O-N 2.88Å; R423-R425 VanDerWaalsContact C-N 3.33Å; R423-R425 PolarHBondContact O-N 2.77Å; R425-Q428 CarbonylContact O-C 3.57Å; R425-Q428 PolarHBondContact O-N 2.69Å; R425-Q429 WeakPolarHBondContact O-CB 3.29Å; R425-Q429 PolarHBondContact O-N 2.73Å
426	N	74.8	Confident	66.5	Low	85 Å²	85	125.3 Å²	125.3	46%	0.455	56%	0.557	S	S	.	*	H	α-helix	trans	-67	-36.8	177	-76.1	-2.1	0	0	0	112.2	Q422 R423 Q429 K430	Q422-N426 WeakPolarHBondContact O-CB 3.47Å; Q422-N426 VanDerWaalsContact O-CG 3.31Å; Q422-N426 PolarHBondContact O-N 3.45Å; R423-N426 PolarHBondContact O-N 3.48Å; R423-N426 VanDerWaalsContact O-N 3.12Å; N426-Q429 PolarHBondContact O-N 3.25Å; N426-K430 WeakPolarHBondContact O-CB 3.37Å; N426-K430 WeakPolarHBondContact O-CG 3.43Å; N426-K430 PolarHBondContact O-N 3.42Å
427	E	74.6	Confident	65.2	Low	115 Å²	115	128.9 Å²	128.9	54%	0.537	57%	0.566	S	S	.	*	H	α-helix	trans	-66.9	-44.1	172.1	-73.6	167	179.3	0	0	111.3	R423 Q429 K430 L431	R423-E427 WeakPolarHBondContact O-CG 3.49Å; R423-E427 PolarHBondContact O-N 3.49Å; E427-Q429 VanDerWaalsContact C-N 3.34Å; E427-Q429 PolarHBondContact O-N 2.93Å; E427-K430 PolarHBondContact O-N 3.47Å; E427-L431 WeakPolarHBondContact O-CB 3.46Å; E427-L431 WeakPolarHBondContact O-CG 3.39Å; E427-L431 PolarHBondContact O-N 3.35Å
428	Q	73	Confident	63.9	Low	119 Å²	119	126.1 Å²	126.1	56%	0.556	57%	0.568	S	S	*	*	H	α-helix	trans	-64.9	-32.7	172.4	-76.8	-174.5	-3.7	0	0	113.2	K424 R425 K432	K424-Q428 WeakPolarHBondContact O-CB 3.34Å; K424-Q428 WeakPolarHBondContact O-CG 3.31Å; K424-Q428 PolarHBondContact O-N 2.9Å; R425-Q428 CarbonylContact O-C 3.57Å; R425-Q428 PolarHBondContact O-N 2.69Å; Q428-K432 WeakPolarHBondContact O-CB 3.33Å; Q428-K432 VanDerWaalsContact O-CG 3.28Å; Q428-K432 WeakPolarHBondContact O-CG 3.37Å; Q428-K432 PolarHBondContact O-N 3.03Å
429	Q	70.5	Confident	62.1	Low	126 Å²	126	131.9 Å²	131.9	59%	0.589	59%	0.585	S	S	*	*	H	α-helix	trans	-73.1	-36	173.1	-83.9	-173.8	-28	0	0	112	R425 N426 E427 T433	R425-Q429 WeakPolarHBondContact O-CB 3.29Å; R425-Q429 PolarHBondContact O-N 2.73Å; N426-Q429 PolarHBondContact O-N 3.25Å; E427-Q429 VanDerWaalsContact C-N 3.34Å; E427-Q429 PolarHBondContact O-N 2.93Å; Q429-T433 WeakPolarHBondContact O-CB 3.34Å; Q429-T433 WeakPolarHBondContact O-CG2 3.48Å; Q429-T433 PolarHBondContact O-N 3.31Å; Q429-T433 PolarHBondContact O-OG1 3.47Å
430	K	67.9	Low	60.7	Low	147 Å²	147	133 Å²	133	64%	0.639	59%	0.594	S	S	*	*	H	α-helix	trans	-63.3	-47.5	169.4	-78.2	-179.6	175.9	-175.8	0	111.2	N426 E427 K432 T433 F434	N426-K430 WeakPolarHBondContact O-CB 3.37Å; N426-K430 WeakPolarHBondContact O-CG 3.43Å; N426-K430 PolarHBondContact O-N 3.42Å; E427-K430 PolarHBondContact O-N 3.47Å; K430-K432 PolarHBondContact O-N 2.8Å; K430-T433 WeakPolarHBondContact CA-OG1 3.49Å; K430-T433 PolarHBondContact O-N 2.95Å; K430-T433 PolarHBondContact O-OG1 3.41Å; K430-T433 VanDerWaalsContact O-OG1 3.06Å; K430-F434 WeakPolarHBondContact O-CD2 3.47Å; K430-F434 PolarHBondContact O-N 3.31Å
431	L	63.2	Low	58.9	Low	117 Å²	117	137.1 Å²	137.1	61%	0.613	62%	0.618	S	S	*	*	H	α-helix	trans	-61.1	-44.7	175	-76.3	163.5	0	0	0	111.9	E427 F434 Y435	E427-L431 WeakPolarHBondContact O-CB 3.46Å; E427-L431 WeakPolarHBondContact O-CG 3.39Å; E427-L431 PolarHBondContact O-N 3.35Å; L431-F434 PolarHBondContact O-N 3.07Å; L431-Y435 WeakPolarHBondContact O-CB 3.39Å; L431-Y435 PolarHBondContact O-N 3.12Å
432	K	60.4	Low	56.6	Low	148 Å²	148	136.2 Å²	136.2	64%	0.643	63%	0.634	S	S	*	*	H	α-helix	trans	-68.1	-32.4	175.8	-78	-179.3	175.3	-177.2	0	113.3	Q428 K430 Y435 R436	Q428-K432 WeakPolarHBondContact O-CB 3.33Å; Q428-K432 VanDerWaalsContact O-CG 3.28Å; Q428-K432 WeakPolarHBondContact O-CG 3.37Å; Q428-K432 PolarHBondContact O-N 3.03Å; K430-K432 PolarHBondContact O-N 2.8Å; K432-Y435 PolarHBondContact O-N 3.49Å; K432-R436 WeakPolarHBondContact O-CB 3.48Å; K432-R436 PolarHBondContact O-N 3.17Å
433	T	55.8	Low	54.3	Low	86 Å²	86	138.9 Å²	138.9	53%	0.528	65%	0.652	S	S	.	*	H	α-helix	trans	-75	-34.7	174.8	45	0	0	0	0	111.7	Q429 K430 R436 R437	Q429-T433 WeakPolarHBondContact O-CB 3.34Å; Q429-T433 WeakPolarHBondContact O-CG2 3.48Å; Q429-T433 PolarHBondContact O-N 3.31Å; Q429-T433 PolarHBondContact O-OG1 3.47Å; K430-T433 WeakPolarHBondContact CA-OG1 3.49Å; K430-T433 PolarHBondContact O-N 2.95Å; K430-T433 PolarHBondContact O-OG1 3.41Å; K430-T433 VanDerWaalsContact O-OG1 3.06Å; T433-R436 PolarHBondContact O-N 3.49Å; T433-R437 WeakPolarHBondContact O-CB 3.41Å; T433-R437 PolarHBondContact O-N 2.77Å
434	F	50	Low	52.4	Low	161 Å²	161	135.8 Å²	135.8	71%	0.706	66%	0.658	S	S	*	*	H	α-helix	trans	-60.3	-51.5	164.7	-93.5	-93.3	0	0	0	111.2	K430 L431 R436 R437 S438	K430-F434 WeakPolarHBondContact O-CD2 3.47Å; K430-F434 PolarHBondContact O-N 3.31Å; L431-F434 PolarHBondContact O-N 3.07Å; F434-R436 VanDerWaalsContact C-N 3.26Å; F434-R436 PolarHBondContact O-N 3.5Å; F434-R437 PolarHBondContact O-N 2.89Å; F434-S438 PolarHBondContact O-N 3.38Å; F434-S438 PolarHBondContact O-OG 2.91Å
435	Y	41	Very low	50.1	Low	168 Å²	168	135 Å²	135	66%	0.659	67%	0.671	S	S	*	*	H	α-helix	trans	-64.3	-23.8	179.1	-112.5	-81	0	0	0	115	L431 K432 S438 R439	L431-Y435 WeakPolarHBondContact O-CB 3.39Å; L431-Y435 PolarHBondContact O-N 3.12Å; K432-Y435 PolarHBondContact O-N 3.49Å; Y435-S438 WeakPolarHBondContact CA-OG 3.38Å; Y435-S438 PolarHBondContact O-OG 3.06Å; Y435-R439 WeakPolarHBondContact O-CB 3.43Å
436	R	39.6	Very low	47.9	Very low	195 Å²	195	135.7 Å²	135.7	74%	0.736	68%	0.681	S	S	*	*	H	α-helix	trans	-86.5	-36.5	175.6	-160.8	175.7	-162.6	-176.1	4.8	111	K432 T433 F434 S438 R439 T440	K432-R436 WeakPolarHBondContact O-CB 3.48Å; K432-R436 PolarHBondContact O-N 3.17Å; T433-R436 PolarHBondContact O-N 3.49Å; F434-R436 VanDerWaalsContact C-N 3.26Å; F434-R436 PolarHBondContact O-N 3.5Å; R436-S438 VanDerWaalsContact C-N 3.26Å; R436-S438 PolarHBondContact O-N 2.91Å; R436-R439 PolarHBondContact O-N 3.15Å; R436-T440 WeakPolarHBondContact O-CG2 3.33Å
437	R	36.5	Very low	45.8	Very low	210 Å²	210	138.4 Å²	138.4	79%	0.792	70%	0.696	S	S	*	*	H	α-helix	trans	-70.6	-22.6	173	-158.7	175.3	-146.8	167.2	6.1	112.5	T433 F434 R439	T433-R437 WeakPolarHBondContact O-CB 3.41Å; T433-R437 PolarHBondContact O-N 2.77Å; F434-R437 PolarHBondContact O-N 2.89Å; R437-R439 VanDerWaalsContact C-N 3.34Å
438	S	38.9	Very low	43.9	Very low	84 Å²	84	141.1 Å²	141.1	59%	0.587	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.4	18.7	166.8	74.5	0	0	0	0	113.6	F434 Y435 R436	F434-S438 PolarHBondContact O-N 3.38Å; F434-S438 PolarHBondContact O-OG 2.91Å; Y435-S438 WeakPolarHBondContact CA-OG 3.38Å; Y435-S438 PolarHBondContact O-OG 3.06Å; R436-S438 VanDerWaalsContact C-N 3.26Å; R436-S438 PolarHBondContact O-N 2.91Å
439	R	35.2	Very low	42	Very low	211 Å²	211	142.4 Å²	142.4	80%	0.796	72%	0.723	S	S	*	*	S	Bend	trans	-132.4	14.5	175.9	-97.1	-170.9	168.2	-159.9	-3.8	112.9	Y435 R436 R437	Y435-R439 WeakPolarHBondContact O-CB 3.43Å; R436-R439 PolarHBondContact O-N 3.15Å; R437-R439 VanDerWaalsContact C-N 3.34Å
440	T	38.7	Very low	40.1	Very low	101 Å²	101	141.4 Å²	141.4	62%	0.62	73%	0.725	S	S	*	*	S	Bend	trans	-126.8	38	179.3	56.1	0	0	0	0	111.2	R436	R436-T440 WeakPolarHBondContact O-CG2 3.33Å
441	L	36.2	Very low	38.5	Very low	158 Å²	158	142 Å²	142	83%	0.827	74%	0.735	S	S	*	*	S	Bend	trans	-149.5	118	175.2	-101.9	131.5	0	0	0	109
442	G	30.2	Very low	36.9	Very low	77 Å²	77	146.9 Å²	146.9	79%	0.794	75%	0.746	S	S	*	*			trans	77.6	81	159.9	0	0	0	0	0	117
443	D	28.8	Very low	35.4	Very low	165 Å²	165	149.1 Å²	149.1	88%	0.882	76%	0.756	S	S	*	*			trans	-67.6	129	150.9	-61.1	-76.1	0	0	0	109.4
444	S	31.3	Very low	34.2	Very low	118 Å²	118	150.7 Å²	150.7	83%	0.825	77%	0.767	S	S	*	*			trans	-165.9	124.2	160.6	-82.4	0	0	0	0	112.2
445	A	29.3	Very low	33.2	Very low	87 Å²	87	149.8 Å²	149.8	72%	0.719	78%	0.775	S	S	*	*			trans	41.3	97.8	150.1	0	0	0	0	0	119.7
446	E	30	Very low	32.6	Very low	172 Å²	172	153.1 Å²	153.1	80%	0.804	79%	0.787	S	S	*	*				56.7	146.4	111.5	-66.4	172.2	-167.3	0	0	122.5
447	N	30.2	Very low	32.1	Very low	142 Å²	142	149.2 Å²	149.2	76%	0.759	79%	0.789	S	S	*	*			trans	57.3	100.9	160.5	-65.1	-39.7	0	0	0	118.2
448	I	36.4	Very low	31.7	Very low	172 Å²	172	148.9 Å²	148.9	88%	0.882	79%	0.794	S	S	*	*				-159.1	151.1	93.9	-97.4	156.7	0	0	0	110.7
449	N	31.1	Very low	31.2	Very low	146 Å²	146	151 Å²	151	78%	0.781	80%	0.803	S	S	*	*			trans	-68.2	152.3	-167.1	-106.4	-23.9	0	0	0	115.5
450	T	31.5	Very low	30.8	Very low	104 Å²	104	148.5 Å²	148.5	64%	0.638	80%	0.8	S	S	*	*			trans	-4.4	131.8	148.2	55.7	0	0	0	0	118.1
451	D	34.8	Very low	30.2	Very low	159 Å²	159	149.9 Å²	149.9	85%	0.85	81%	0.808	S	S	*	*				-152.6	158.6	105.7	-138.6	-21.3	0	0	0	113.8
452	W	28.2	Very low	29.6	Very low	221 Å²	221	148.7 Å²	148.7	84%	0.837	80%	0.796	S	S	*	*			trans	-97.1	127.1	-168.7	-77	71	0	0	0	114.2
453	K	30.8	Very low	29.5	Very low	195 Å²	195	150.7 Å²	150.7	85%	0.848	79%	0.794	S	S	*	*			trans	-158.4	127.6	142.6	-113	148.6	-170.6	162.3	0	112	T455	K453-T455 PolarHBondContact O-N 2.68Å
454	P	29.6	Very low	29.4	Very low	119 Å²	119	147.4 Å²	147.4	77%	0.773	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-66.6	131.8	175.8	27.8	-33.3	0	0	0	110	R456	P454-R456 PolarHBondContact O-N 3.17Å
455	T	30	Very low	29.2	Very low	142 Å²	142	149.2 Å²	149.2	87%	0.871	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-61	136.3	178.4	-6.2	0	0	0	0	109.9	K453 S457	K453-T455 PolarHBondContact O-N 2.68Å; T455-S457 PolarHBondContact O-N 3.4Å
456	R	28	Very low	29	Very low	237 Å²	237	153.6 Å²	153.6	89%	0.894	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-48.8	141.4	173.4	-90.2	-178.8	168.7	172.2	-3.8	110	P454 K458	P454-R456 PolarHBondContact O-N 3.17Å; R456-K458 PolarHBondContact O-N 3.09Å; R456-K458 VanDerWaalsContact O-N 3.14Å
457	S	27.8	Very low	29	Very low	113 Å²	113	151.5 Å²	151.5	79%	0.79	77%	0.771	S	S	*	*			trans	-44.7	119.8	179.6	37.6	0	0	0	0	111.1	T455 T459	T455-S457 PolarHBondContact O-N 3.4Å; S457-T459 PolarHBondContact O-N 2.9Å
458	K	28.4	Very low	29.3	Very low	204 Å²	204	150.2 Å²	150.2	89%	0.887	77%	0.768	S	S	*	*			trans	-52.1	120.7	167.5	-73.2	-178.1	177.1	179	0	106.9	R456 Q460	R456-K458 PolarHBondContact O-N 3.09Å; R456-K458 VanDerWaalsContact O-N 3.14Å; K458-Q460 PolarHBondContact O-N 2.91Å; K458-Q460 VanDerWaalsContact O-N 3.16Å
459	T	28.4	Very low	29.2	Very low	127 Å²	127	147.1 Å²	147.1	78%	0.779	76%	0.76	S	S	*	*			trans	-51.7	125	-178.7	19.3	0	0	0	0	108.7	S457 V461	S457-T459 PolarHBondContact O-N 2.9Å; T459-V461 PolarHBondContact O-N 3.33Å
460	Q	26.6	Very low	29.6	Very low	159 Å²	159	145.3 Å²	145.3	74%	0.743	76%	0.756	S	S	*	*			trans	-58.5	110.2	162.8	-68.8	-177.5	-3	0	0	105.9	K458 K462	K458-Q460 PolarHBondContact O-N 2.91Å; K458-Q460 VanDerWaalsContact O-N 3.16Å; Q460-K462 HydrophobicContact CB-CB 4.12Å; Q460-K462 PolarHBondContact O-N 2.85Å
461	V	26.9	Very low	30.2	Very low	131 Å²	131	144 Å²	144	79%	0.794	75%	0.749	S	S	*	*			trans	-72.6	67.7	156.6	-175	0	0	0	0	106.1	T459 T463	T459-V461 PolarHBondContact O-N 3.33Å; V461-T463 VanDerWaalsContact C-N 3.26Å; V461-T463 HydrophobicContact CG1-CG2 4.45Å; V461-T463 PolarHBondContact O-N 3.43Å
462	K	24.1	Very low	31.1	Very low	132 Å²	132	142.8 Å²	142.8	57%	0.574	75%	0.747	S	S	*	*			trans	-66.8	93.9	169	-164.9	-173.1	-178.4	-173.6	0	103.3	Q460 Q464	Q460-K462 HydrophobicContact CB-CB 4.12Å; Q460-K462 PolarHBondContact O-N 2.85Å; K462-Q464 HydrophobicContact CB-CG 4.48Å; K462-Q464 HydrophobicContact CD-CG 3.81Å; K462-Q464 HydrophobicContact CG-CG 3.82Å; K462-Q464 PolarHBondContact O-N 3.23Å
463	T	27.2	Very low	32.2	Very low	120 Å²	120	136 Å²	136	74%	0.736	73%	0.727	S	S	*	*			trans	-66.9	71.8	163.9	45.7	0	0	0	0	107.8	V461 L465	V461-T463 VanDerWaalsContact C-N 3.26Å; V461-T463 HydrophobicContact CG1-CG2 4.45Å; V461-T463 PolarHBondContact O-N 3.43Å; T463-L465 PolarHBondContact O-N 3Å; T463-L465 VanDerWaalsContact O-N 3.15Å
464	Q	26.3	Very low	33.2	Very low	95 Å²	95	134.8 Å²	134.8	44%	0.444	73%	0.725	S	S	.	*			trans	-56.8	113.5	151.8	-63.2	-178.4	-89.5	0	0	104.4	K462 Y466	K462-Q464 HydrophobicContact CB-CG 4.48Å; K462-Q464 HydrophobicContact CD-CG 3.81Å; K462-Q464 HydrophobicContact CG-CG 3.82Å; K462-Q464 PolarHBondContact O-N 3.23Å; Q464-Y466 HydrophobicContact CB-CD2 3.84Å; Q464-Y466 HydrophobicContact CB-CE2 3.79Å; Q464-Y466 HydrophobicContact CG-CE2 4.46Å; Q464-Y466 PolarHBondContact O-N 3.36Å; Q464-Y466 PolarHBondContact OE1-OH 3.4Å
465	L	27.2	Very low	34.5	Very low	156 Å²	156	136.2 Å²	136.2	82%	0.817	72%	0.719	S	S	*	*			trans	-57.8	97.6	146.1	-98.3	64.5	0	0	0	104.6	T463 T467	T463-L465 PolarHBondContact O-N 3Å; T463-L465 VanDerWaalsContact O-N 3.15Å; L465-T467 PolarHBondContact O-N 3.5Å
466	Y	25.7	Very low	35.5	Very low	179 Å²	179	134.3 Å²	134.3	70%	0.702	70%	0.7	S	S	*	*			trans	-64.7	97.8	156	-83.2	-92.1	0	0	0	104.8	Q464 T468	Q464-Y466 HydrophobicContact CB-CD2 3.84Å; Q464-Y466 HydrophobicContact CB-CE2 3.79Å; Q464-Y466 HydrophobicContact CG-CE2 4.46Å; Q464-Y466 PolarHBondContact O-N 3.36Å; Q464-Y466 PolarHBondContact OE1-OH 3.4Å; Y466-T468 PolarHBondContact O-N 3.44Å
467	T	29.7	Very low	36.7	Very low	128 Å²	128	125.2 Å²	125.2	79%	0.785	68%	0.675	S	S	*	*			trans	-60.3	93.7	159.5	39	0	0	0	0	106.1	L465	L465-T467 PolarHBondContact O-N 3.5Å
468	T	35.8	Very low	38	Very low	116 Å²	116	125.5 Å²	125.5	71%	0.712	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-52.6	127.6	164.6	37.9	0	0	0	0	106.9	Y466	Y466-T468 PolarHBondContact O-N 3.44Å
469	P	34.9	Very low	39.1	Very low	107 Å²	107	123.9 Å²	123.9	70%	0.695	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-58.2	153.8	174.3	26.3	-33.9	0	0	0	109.4
470	P	39.8	Very low	40.2	Very low	108 Å²	108	121.8 Å²	121.8	70%	0.701	63%	0.634	S	S	*	*	P	Polyproline II helix	trans	-56.9	136.4	172	26.2	-33.9	0	0	0	109	T472	P470-T472 PolarHBondContact O-N 2.94Å
471	P	43.4	Very low	41.5	Very low	75 Å²	75	116 Å²	116	49%	0.487	62%	0.617	S	S	.	*	P	Polyproline II helix	trans	-62.5	126.1	-177.1	25.5	-33.6	0	0	0	110	E476 A477	P471-E476 HydrophobicContact CB-CB 4.19Å; P471-A477 HydrophobicContact CB-CB 4.24Å; P471-A477 HydrophobicContact CG-CB 4.05Å
472	T	54.3	Low	42.6	Very low	135 Å²	135	112.4 Å²	112.4	83%	0.828	59%	0.593	S	S	*	*	S	Bend	trans	-90.4	-5.8	-177.8	43.8	0	0	0	0	113.6	P470	P470-T472 PolarHBondContact O-N 2.94Å
473	D	50.7	Low	43.7	Very low	77 Å²	77	110.2 Å²	110.2	41%	0.412	59%	0.587	S	S	.	*	S	Bend	trans	-134.6	138.7	175.7	-174.9	-19.8	0	0	0	109.4	K475 E476 A477	D473-K475 PolarHBondContact O-N 2.71Å; D473-K475 PolarHBondContact OD1-N 2.94Å; D473-E476 PolarHBondContact O-N 3.44Å; D473-A477 PolarHBondContact O-N 3.32Å
474	E	53.2	Low	44.3	Very low	171 Å²	171	110.8 Å²	110.8	80%	0.799	58%	0.583	S	S	*	*	H	α-helix	trans	-56	-30.5	176	-60.9	-171.7	146.9	0	0	112.3	A477 Y478	E474-A477 WeakPolarHBondContact O-CB 3.45Å; E474-A477 PolarHBondContact O-N 3.16Å; E474-Y478 PolarHBondContact O-N 3.16Å
475	K	57.1	Low	45.3	Very low	148 Å²	148	112.7 Å²	112.7	64%	0.643	59%	0.592	S	S	*	*	H	α-helix	trans	-65.1	-40.4	176	-68.6	170.1	-174.7	161.7	0	112	D473 A477 Y478 Y479	D473-K475 PolarHBondContact O-N 2.71Å; D473-K475 PolarHBondContact OD1-N 2.94Å; K475-A477 VanDerWaalsContact C-N 3.35Å; K475-Y478 PolarHBondContact O-N 3.21Å; K475-Y479 WeakPolarHBondContact O-CD2 3.41Å; K475-Y479 PolarHBondContact O-N 3.43Å
476	E	50.7	Low	46	Very low	102 Å²	102	112.6 Å²	112.6	48%	0.477	59%	0.587	S	S	.	*	H	α-helix	trans	-69.5	-34.7	176.2	-67.9	-161.6	134.9	0	0	111.6	P471 D473 Y479 N480	P471-E476 HydrophobicContact CB-CB 4.19Å; D473-E476 PolarHBondContact O-N 3.44Å; E476-Y479 PolarHBondContact O-N 3.18Å; E476-N480 WeakPolarHBondContact O-CB 3.37Å; E476-N480 PolarHBondContact O-N 2.89Å; E476-N480 PolarHBondContact O-ND2 2.99Å
477	A	51.7	Low	46.6	Very low	46 Å²	46	111.6 Å²	111.6	38%	0.38	59%	0.587	S	S	.	*	H	α-helix	trans	-61	-44.3	172.8	0	0	0	0	0	111.7	P471 D473 E474 K475 G481	P471-A477 HydrophobicContact CB-CB 4.24Å; P471-A477 HydrophobicContact CG-CB 4.05Å; D473-A477 PolarHBondContact O-N 3.32Å; E474-A477 WeakPolarHBondContact O-CB 3.45Å; E474-A477 PolarHBondContact O-N 3.16Å; K475-A477 VanDerWaalsContact C-N 3.35Å; A477-G481 PolarHBondContact O-N 3.41Å
478	Y	56.2	Low	47.1	Very low	120 Å²	120	112.6 Å²	112.6	47%	0.471	59%	0.586	S	S	.	*	H	α-helix	trans	-64.8	-44	176.8	177.9	-112.8	0	0	0	113	E474 K475 G481 L482 K696	E474-Y478 PolarHBondContact O-N 3.16Å; K475-Y478 PolarHBondContact O-N 3.21Å; Y478-G481 PolarHBondContact O-N 3.33Å; Y478-L482 HydrophobicContact CD1-CD1 4.09Å; Y478-L482 HydrophobicContact CD2-CD1 4.43Å; Y478-L482 HydrophobicContact CE1-CD1 3.65Å; Y478-L482 HydrophobicContact CE2-CD1 4Å; Y478-L482 HydrophobicContact CG-CD1 4.48Å; Y478-L482 PolarHBondContact O-N 3Å; Y478-K696 PolarHBondContact OH-NZ 2.94Å; Y478-K696 VanDerWaalsContact OH-NZ 3.11Å
479	Y	51.7	Low	46.9	Very low	169 Å²	169	114.7 Å²	114.7	66%	0.663	59%	0.586	S	S	*	*	H	α-helix	trans	-67	-39.2	177	-89.9	-79.7	0	0	0	112.9	K475 E476 L482 L483	K475-Y479 WeakPolarHBondContact O-CD2 3.41Å; K475-Y479 PolarHBondContact O-N 3.43Å; E476-Y479 PolarHBondContact O-N 3.18Å; Y479-L482 PolarHBondContact O-N 3.47Å; Y479-L483 WeakPolarHBondContact O-CB 3.28Å; Y479-L483 PolarHBondContact O-N 3.47Å
480	N	50.9	Low	47	Very low	84 Å²	84	117.7 Å²	117.7	45%	0.449	59%	0.59	S	S	.	*	H	α-helix	trans	-69.2	-34.5	175.3	-77.2	-64.3	0	0	0	112.5	E476 L483 M484	E476-N480 WeakPolarHBondContact O-CB 3.37Å; E476-N480 PolarHBondContact O-N 2.89Å; E476-N480 PolarHBondContact O-ND2 2.99Å; N480-L483 PolarHBondContact O-N 2.88Å; N480-M484 PolarHBondContact O-N 3.3Å
481	G	53.2	Low	46.9	Very low	38 Å²	38	117.9 Å²	117.9	39%	0.392	59%	0.591	S	S	.	*	H	α-helix	trans	-60.8	-48.5	171.2	0	0	0	0	0	112.5	A477 Y478 L483 M484 E485	A477-G481 PolarHBondContact O-N 3.41Å; Y478-G481 PolarHBondContact O-N 3.33Å; G481-L483 VanDerWaalsContact C-N 3.32Å; G481-L483 PolarHBondContact O-N 2.95Å; G481-M484 WeakPolarHBondContact O-CB 3.47Å; G481-M484 PolarHBondContact O-N 2.88Å; G481-M484 VanDerWaalsContact O-N 3.16Å; G481-E485 PolarHBondContact O-N 3.05Å
482	L	51.3	Low	46.5	Very low	55 Å²	55	123 Å²	123	29%	0.288	61%	0.608	S	S	.	*	H	α-helix	trans	-60.7	-38.2	174.2	-84.6	163.3	0	0	0	112.7	Y478 Y479 M484 E485 Q486	Y478-L482 HydrophobicContact CD1-CD1 4.09Å; Y478-L482 HydrophobicContact CD2-CD1 4.43Å; Y478-L482 HydrophobicContact CE1-CD1 3.65Å; Y478-L482 HydrophobicContact CE2-CD1 4Å; Y478-L482 HydrophobicContact CG-CD1 4.48Å; Y478-L482 PolarHBondContact O-N 3Å; Y479-L482 PolarHBondContact O-N 3.47Å; L482-M484 VanDerWaalsContact C-N 3.28Å; L482-M484 PolarHBondContact O-N 3.09Å; L482-E485 PolarHBondContact O-N 2.9Å; L482-Q486 WeakPolarHBondContact O-CB 3.15Å; L482-Q486 PolarHBondContact O-N 3.39Å
483	L	46.3	Very low	45.8	Very low	86 Å²	86	121.8 Å²	121.8	45%	0.45	60%	0.595	S	S	.	*	H	α-helix	trans	-68.5	-26.8	177.6	-158.1	74.8	0	0	0	112.8	Y479 N480 G481 K487	Y479-L483 WeakPolarHBondContact O-CB 3.28Å; Y479-L483 PolarHBondContact O-N 3.47Å; N480-L483 PolarHBondContact O-N 2.88Å; G481-L483 VanDerWaalsContact C-N 3.32Å; G481-L483 PolarHBondContact O-N 2.95Å; L483-K487 WeakPolarHBondContact O-CG 3.39Å; L483-K487 PolarHBondContact O-N 3.22Å
484	M	40.9	Very low	45.5	Very low	131 Å²	131	123.8 Å²	123.8	65%	0.645	61%	0.605	S	S	*	*	H	α-helix	trans	-74.5	-47.9	169.9	-80.7	-68.3	-173	0	0	111.9	N480 G481 L482 Q486 K487 L488	N480-M484 PolarHBondContact O-N 3.3Å; G481-M484 WeakPolarHBondContact O-CB 3.47Å; G481-M484 PolarHBondContact O-N 2.88Å; G481-M484 VanDerWaalsContact O-N 3.16Å; L482-M484 VanDerWaalsContact C-N 3.28Å; L482-M484 PolarHBondContact O-N 3.09Å; M484-Q486 PolarHBondContact O-N 3.45Å; M484-K487 PolarHBondContact O-N 2.78Å; M484-K487 VanDerWaalsContact O-N 3.1Å; M484-L488 PolarHBondContact O-N 3.28Å; M484-L488 VanDerWaalsContact O-N 3.11Å
485	E	47.4	Very low	45.3	Very low	135 Å²	135	119.5 Å²	119.5	63%	0.631	58%	0.584	S	S	*	*	H	α-helix	trans	-55.5	-41.8	174.7	-74.6	-161.1	118.6	0	0	111.9	G481 L482 K487 L488	G481-E485 PolarHBondContact O-N 3.05Å; L482-E485 PolarHBondContact O-N 2.9Å; E485-K487 VanDerWaalsContact C-N 3.27Å; E485-K487 PolarHBondContact O-N 3.27Å; E485-L488 PolarHBondContact O-N 2.83Å
486	Q	40.9	Very low	44.9	Very low	154 Å²	154	118.7 Å²	118.7	72%	0.72	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	-17	-178.1	-156.8	171.8	26.3	0	0	113.5	L482 M484	L482-Q486 WeakPolarHBondContact O-CB 3.15Å; L482-Q486 PolarHBondContact O-N 3.39Å; M484-Q486 PolarHBondContact O-N 3.45Å
487	K	38.5	Very low	45.1	Very low	159 Å²	159	116.9 Å²	116.9	69%	0.691	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	-7	173.1	-75.9	178.9	177.8	173.5	0	114.1	L483 M484 E485	L483-K487 WeakPolarHBondContact O-CG 3.39Å; L483-K487 PolarHBondContact O-N 3.22Å; M484-K487 PolarHBondContact O-N 2.78Å; M484-K487 VanDerWaalsContact O-N 3.1Å; E485-K487 VanDerWaalsContact C-N 3.27Å; E485-K487 PolarHBondContact O-N 3.27Å
488	L	40.1	Very low	45.2	Very low	148 Å²	148	119.3 Å²	119.3	78%	0.775	58%	0.581	S	S	*	*	S	Bend	trans	-97.2	-0.9	175.4	-87.2	158.1	0	0	0	113.5	M484 E485	M484-L488 PolarHBondContact O-N 3.28Å; M484-L488 VanDerWaalsContact O-N 3.11Å; E485-L488 PolarHBondContact O-N 2.83Å
489	K	32.3	Very low	44.8	Very low	161 Å²	161	115.3 Å²	115.3	70%	0.7	57%	0.57	S	S	*	*	S	Bend	trans	-93.6	128.2	168.7	-81.7	-178.8	173.1	175.1	0	111.4
490	E	35.8	Very low	44.6	Very low	170 Å²	170	115.6 Å²	115.6	79%	0.794	57%	0.57	S	S	*	*			trans	69.5	154.8	171.3	-79.5	-179.5	-134.4	0	0	116.8
491	P	38.7	Very low	44.5	Very low	111 Å²	111	115.1 Å²	115.1	72%	0.721	57%	0.567	S	S	*	*			cis	-94.9	148.2	11.2	36.5	-34.5	0	0	0	115.8	M493	P491-M493 PolarHBondContact O-N 2.76Å
492	H	35.3	Very low	44.3	Very low	182 Å²	182	121.7 Å²	121.7	84%	0.843	58%	0.58	S	S	*	*			trans	-62.5	114.2	160.2	-100	-105.9	0	0	0	110.1
493	M	39.3	Very low	44.1	Very low	110 Å²	110	129.2 Å²	129.2	54%	0.542	60%	0.604	S	S	.	*			trans	-94.2	111.6	170.9	-89.5	-74.1	-73.2	0	0	110.3	P491 F495 T497 L501	P491-M493 PolarHBondContact O-N 2.76Å; M493-F495 PolarHBondContact O-N 3.22Å; M493-T497 HydrophobicContact CE-CG2 4.11Å; M493-L501 HydrophobicContact CE-CD1 3.72Å
494	D	44.7	Very low	44	Very low	120 Å²	120	131.5 Å²	131.5	64%	0.642	62%	0.616	S	S	*	*			trans	-56.6	133.5	177.6	-95.5	-41.2	0	0	0	112.3	Q496 T497 F498	D494-Q496 PolarHBondContact O-N 3.39Å; D494-Q496 VanDerWaalsContact O-N 3.12Å; D494-T497 WeakPolarHBondContact O-CA 3.49Å; D494-T497 WeakPolarHBondContact O-CB 3.09Å; D494-T497 PolarHBondContact O-N 3.18Å; D494-F498 PolarHBondContact O-N 3.27Å
495	F	47.8	Very low	43.6	Very low	80 Å²	80	128.6 Å²	128.6	35%	0.351	62%	0.62	S	S	.	*	H	α-helix	trans	-57.1	-32.7	-179.7	-169.6	-93.5	0	0	0	112	M493 F498 C499 C1089	M493-F495 PolarHBondContact O-N 3.22Å; F495-F498 PolarHBondContact O-N 2.82Å; F495-C499 WeakPolarHBondContact CE1-SG 3.27Å; F495-C499 WeakPolarHBondContact O-CB 3.42Å; F495-C499 PolarHBondContact O-N 3.38Å; F495-C499 PolarHBondContact O-SG 2.88Å; F495-C1089 HydrophobicContact CZ-CB 3.91Å
496	Q	50.2	Low	42.8	Very low	132 Å²	132	133 Å²	133	62%	0.617	63%	0.631	S	S	*	*	H	α-helix	trans	-67.7	-36.5	176.4	-155.9	179.2	46.7	0	0	112.2	D494 R500	D494-Q496 PolarHBondContact O-N 3.39Å; D494-Q496 VanDerWaalsContact O-N 3.12Å; Q496-R500 WeakPolarHBondContact O-CG 3.49Å; Q496-R500 PolarHBondContact O-N 2.99Å
497	T	54.5	Low	42.4	Very low	63 Å²	63	133.6 Å²	133.6	39%	0.387	63%	0.631	S	S	.	*	H	α-helix	trans	-70.5	-44.3	175.2	-54.9	0	0	0	0	110.9	M493 D494 C499 R500 L501	M493-T497 HydrophobicContact CE-CG2 4.11Å; D494-T497 WeakPolarHBondContact O-CA 3.49Å; D494-T497 WeakPolarHBondContact O-CB 3.09Å; D494-T497 PolarHBondContact O-N 3.18Å; T497-C499 VanDerWaalsContact C-N 3.34Å; T497-C499 PolarHBondContact O-N 2.88Å; T497-R500 PolarHBondContact O-N 2.81Å; T497-L501 HydrophobicContact CG2-CD1 4.17Å; T497-L501 WeakPolarHBondContact O-CG 3.16Å; T497-L501 PolarHBondContact O-N 3.34Å
498	F	53	Low	42.1	Very low	98 Å²	98	133.5 Å²	133.5	43%	0.43	64%	0.638	S	S	.	*	H	α-helix	trans	-57.7	-44.4	171.9	-177.4	-103.3	0	0	0	111.9	D494 F495 L501 R502	D494-F498 PolarHBondContact O-N 3.27Å; F495-F498 PolarHBondContact O-N 2.82Å; F498-L501 PolarHBondContact O-N 3.01Å; F498-R502 WeakPolarHBondContact O-CB 3.27Å; F498-R502 PolarHBondContact O-N 3.29Å
499	C	47.9	Very low	41.7	Very low	35 Å²	35	134.2 Å²	134.2	24%	0.236	64%	0.643	C	S	.	*	H	α-helix	trans	-65.9	-35.4	175	-74.4	0	0	0	0	113.7	F495 T497 R503	F495-C499 WeakPolarHBondContact CE1-SG 3.27Å; F495-C499 WeakPolarHBondContact O-CB 3.42Å; F495-C499 PolarHBondContact O-N 3.38Å; F495-C499 PolarHBondContact O-SG 2.88Å; T497-C499 VanDerWaalsContact C-N 3.34Å; T497-C499 PolarHBondContact O-N 2.88Å; C499-R503 WeakPolarHBondContact O-CB 3.31Å; C499-R503 PolarHBondContact O-N 3.32Å; C499-R503 VanDerWaalsContact O-N 3.08Å
500	R	47.1	Very low	41.6	Very low	176 Å²	176	135.8 Å²	135.8	66%	0.664	65%	0.65	S	S	*	*	H	α-helix	trans	-65.9	-47.9	173.4	-80.6	-179.5	173.9	-174.3	-0.7	111.4	Q496 T497 R502 R503 L504	Q496-R500 WeakPolarHBondContact O-CG 3.49Å; Q496-R500 PolarHBondContact O-N 2.99Å; T497-R500 PolarHBondContact O-N 2.81Å; R500-R502 PolarHBondContact O-N 2.97Å; R500-R503 WeakPolarHBondContact O-CB 3.49Å; R500-R503 PolarHBondContact O-N 2.99Å; R500-R503 VanDerWaalsContact O-N 3.12Å; R500-L504 PolarHBondContact O-N 3.44Å
501	L	49.2	Very low	41.1	Very low	74 Å²	74	137.9 Å²	137.9	39%	0.387	65%	0.652	S	S	.	*	H	α-helix	trans	-58.9	-45.8	176.4	-73.1	163	0	0	0	111.7	M493 T497 F498 R503 L504	M493-L501 HydrophobicContact CE-CD1 3.72Å; T497-L501 HydrophobicContact CG2-CD1 4.17Å; T497-L501 WeakPolarHBondContact O-CG 3.16Å; T497-L501 PolarHBondContact O-N 3.34Å; F498-L501 PolarHBondContact O-N 3.01Å; L501-R503 VanDerWaalsContact C-N 3.26Å; L501-R503 PolarHBondContact O-N 3.3Å; L501-L504 PolarHBondContact O-N 2.98Å; L501-L504 VanDerWaalsContact O-N 3.11Å
502	R	49.5	Very low	40.8	Very low	176 Å²	176	140.5 Å²	140.5	66%	0.664	66%	0.66	S	S	*	*	H	α-helix	trans	-66	-25.9	177	-161.3	173.2	-171.4	173.3	3.8	113.2	F498 R500	F498-R502 WeakPolarHBondContact O-CB 3.27Å; F498-R502 PolarHBondContact O-N 3.29Å; R500-R502 PolarHBondContact O-N 2.97Å
503	R	47.5	Very low	40.4	Very low	213 Å²	213	141.1 Å²	141.1	80%	0.804	66%	0.66	S	S	*	*	H	α-helix	trans	-76.4	-21.2	174.4	-165.6	-179.1	-71.8	-166.4	-2.6	112.8	C499 R500 L501	C499-R503 WeakPolarHBondContact O-CB 3.31Å; C499-R503 PolarHBondContact O-N 3.32Å; C499-R503 VanDerWaalsContact O-N 3.08Å; R500-R503 WeakPolarHBondContact O-CB 3.49Å; R500-R503 PolarHBondContact O-N 2.99Å; R500-R503 VanDerWaalsContact O-N 3.12Å; L501-R503 VanDerWaalsContact C-N 3.26Å; L501-R503 PolarHBondContact O-N 3.3Å
504	L	42.6	Very low	40	Very low	133 Å²	133	139.4 Å²	139.4	70%	0.696	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	2.3	179.9	-76.8	165.1	0	0	0	114.8	R500 L501 R506	R500-L504 PolarHBondContact O-N 3.44Å; L501-L504 PolarHBondContact O-N 2.98Å; L501-L504 VanDerWaalsContact O-N 3.11Å; L504-R506 PolarHBondContact O-N 3.47Å
505	G	33.9	Very low	39.2	Very low	70 Å²	70	140.5 Å²	140.5	72%	0.722	68%	0.676	S	S	*	*			trans	71.2	-8.6	165.5	0	0	0	0	0	117.4	F507	G505-F507 PolarHBondContact O-N 3.32Å
506	R	31	Very low	38.5	Very low	229 Å²	229	144.5 Å²	144.5	86%	0.864	70%	0.701	S	S	*	*			trans	-93.5	90.5	178.1	-58.6	-169.2	-163.8	-157.1	7.2	111.3	L504	L504-R506 PolarHBondContact O-N 3.47Å
507	F	32.6	Very low	37.5	Very low	166 Å²	166	143.7 Å²	143.7	73%	0.728	71%	0.705	S	S	*	*			trans	-136.9	59.3	162.6	-113.4	-80.3	0	0	0	110.5	G505	G505-F507 PolarHBondContact O-N 3.32Å
508	N	31.4	Very low	36.4	Very low	156 Å²	156	144.1 Å²	144.1	83%	0.834	72%	0.722	S	S	*	*	S	Bend	trans	-152.9	64.4	167.2	-140.2	18.9	0	0	0	109.2
509	D	31.5	Very low	35.3	Very low	163 Å²	163	145.7 Å²	145.7	87%	0.872	73%	0.733	S	S	*	*	S	Bend	trans	-169.1	153.3	154.5	-97.9	-33.3	0	0	0	109.3
510	K	29.2	Very low	34.5	Very low	194 Å²	194	150.8 Å²	150.8	84%	0.843	76%	0.757	S	S	*	*			trans	-74.4	149	179.2	-77.2	-178.8	176.3	179.4	0	111.4	N512	K510-N512 PolarHBondContact O-N 2.85Å
511	Y	27.1	Very low	33.7	Very low	214 Å²	214	148.8 Å²	148.8	84%	0.839	76%	0.76	S	S	*	*			trans	-18.2	117.7	163.7	-64.3	-96.6	0	0	0	115.7
512	N	32.1	Very low	32.8	Very low	166 Å²	166	154.4 Å²	154.4	89%	0.888	78%	0.784	S	S	*	*			trans	-147.3	118.8	141.1	-99.2	-35.6	0	0	0	108.3	K510	K510-N512 PolarHBondContact O-N 2.85Å
513	F	26.9	Very low	31.9	Very low	196 Å²	196	151.3 Å²	151.3	86%	0.86	79%	0.789	S	S	*	*			trans	-79.3	133.2	167.7	-100.7	-100.3	0	0	0	108.6	L515	F513-L515 HydrophobicContact CD1-CD1 4.44Å
514	G	30.5	Very low	31	Very low	73 Å²	73	149.9 Å²	149.9	75%	0.753	79%	0.791	S	S	*	*			trans	-166.6	80.9	177.4	0	0	0	0	0	108.3
515	L	27.9	Very low	30.5	Very low	143 Å²	143	154.5 Å²	154.5	75%	0.749	80%	0.8	S	S	*	*			trans	-74.9	129.6	160.4	-88.9	75.2	0	0	0	107	F513	F513-L515 HydrophobicContact CD1-CD1 4.44Å
516	D	32.1	Very low	30.4	Very low	165 Å²	165	159.5 Å²	159.5	88%	0.882	81%	0.809	S	S	*	*			trans	-138.2	153.2	141.1	-114.4	-40.5	0	0	0	108.9
517	T	29.9	Very low	30.2	Very low	115 Å²	115	156.6 Å²	156.6	71%	0.706	81%	0.81	S	S	*	*			trans	-113.3	123.6	-162.1	49.9	0	0	0	0	113.5
518	G	32.2	Very low	30.1	Very low	72 Å²	72	156.6 Å²	156.6	74%	0.742	81%	0.812	S	S	*	*			trans	179.1	96.6	171.8	0	0	0	0	0	108
519	I	30.2	Very low	30	Very low	130 Å²	130	155.5 Å²	155.5	67%	0.667	80%	0.802	S	S	*	*			cis	77.9	104.7	47.5	-56.5	-177.8	0	0	0	112.2
520	I	30	Very low	30.1	Very low	142 Å²	142	153.4 Å²	153.4	73%	0.728	80%	0.8	S	S	*	*			trans	85.7	144.7	154.8	-71.4	169.5	0	0	0	119.1
521	D	29.6	Very low	30	Very low	135 Å²	135	151.8 Å²	151.8	72%	0.722	80%	0.795	S	S	*	*			trans	49.7	95.9	167.5	-62.1	-17.9	0	0	0	121.8
522	E	30.8	Very low	30.4	Very low	192 Å²	192	149.5 Å²	149.5	90%	0.897	80%	0.798	S	S	*	*			trans	-149.5	53.4	134	-151.9	172.7	-146.3	0	0	112.3
523	S	29.9	Very low	30.2	Very low	110 Å²	110	145.5 Å²	145.5	77%	0.769	78%	0.782	S	S	*	*	S	Bend	trans	-125.1	43	-178	63.6	0	0	0	0	113.8
524	Q	30.6	Very low	30.5	Very low	184 Å²	184	145.8 Å²	145.8	86%	0.86	78%	0.784	S	S	*	*	S	Bend	trans	-154.8	28.2	-174.9	-139.5	173	19.4	0	0	116.2
525	R	31.4	Very low	30.5	Very low	230 Å²	230	149.9 Å²	149.9	87%	0.868	78%	0.783	S	S	*	*	S	Bend	trans	-134.6	14	-169.6	-100.4	-172.6	177.3	-162.5	-2.4	119.5
526	L	30.6	Very low	30.8	Very low	175 Å²	175	151 Å²	151	92%	0.916	79%	0.789	S	S	*	*	S	Bend	trans	-138	52.3	175.9	-71.2	175.8	0	0	0	113
527	L	28	Very low	30.7	Very low	168 Å²	168	152.2 Å²	152.2	88%	0.88	79%	0.786	S	S	*	*			trans	-148.2	59	174.5	-106.2	175.1	0	0	0	112.3
528	Q	30.2	Very low	30.7	Very low	166 Å²	166	151.8 Å²	151.8	78%	0.776	79%	0.785	S	S	*	*			trans	-165.7	96.6	161.7	-144.3	76.2	64	0	0	103.8
529	E	30.1	Very low	30.5	Very low	132 Å²	132	154.1 Å²	154.1	62%	0.617	79%	0.785	S	S	*	*				78.5	115.4	77.7	-174.7	173.9	-151	0	0	113.2	Q531	E529-Q531 HydrophobicContact CG-CG 4.46Å; E529-Q531 PolarHBondContact OE1-NE2 3.05Å
530	S	31.8	Very low	30.6	Very low	120 Å²	120	157.8 Å²	157.8	84%	0.839	79%	0.793	S	S	*	*			trans	-146.8	100.6	154.6	60.7	0	0	0	0	106.4
531	Q	29.1	Very low	30.5	Very low	159 Å²	159	156 Å²	156	74%	0.743	79%	0.793	S	S	*	*			trans	-69.5	142.5	169.5	-57.8	177.8	27.1	0	0	108.1	E529	E529-Q531 HydrophobicContact CG-CG 4.46Å; E529-Q531 PolarHBondContact OE1-NE2 3.05Å
532	D	34.4	Very low	30.7	Very low	167 Å²	167	156.3 Å²	156.3	89%	0.893	80%	0.8	S	S	*	*			trans	-147.2	148.1	148.3	-130.1	-33.7	0	0	0	110.8
533	S	28.7	Very low	30.6	Very low	81 Å²	81	156.1 Å²	156.1	57%	0.566	79%	0.791	S	S	*	*			trans	-102.7	152.6	-160.5	74.4	0	0	0	0	113.4
534	F	32.8	Very low	30.6	Very low	203 Å²	203	162.3 Å²	162.3	89%	0.89	80%	0.797	S	S	*	*			trans	-162.2	161.1	130.6	-105.4	-66.6	0	0	0	111.2
535	H	30	Very low	30.6	Very low	158 Å²	158	164.2 Å²	164.2	73%	0.731	80%	0.796	S	S	*	*			trans	-86	144.4	-162.8	-70.2	-136	0	0	0	113.7
536	L	33.9	Very low	30.6	Very low	168 Å²	168	163.3 Å²	163.3	88%	0.88	79%	0.793	S	S	*	*				179.4	147.2	105.5	-108.1	105.4	0	0	0	111.6
537	K	30	Very low	30.9	Very low	189 Å²	189	160.6 Å²	160.6	82%	0.822	78%	0.784	S	S	*	*			trans	-88.7	149.2	170.6	-69.3	177.6	176.5	171.7	0	109.6
538	P	30.5	Very low	31	Very low	106 Å²	106	157.9 Å²	157.9	69%	0.688	78%	0.779	S	S	*	*				-138.5	153.7	88.4	38.2	-26.3	0	0	0	115.4	Y540	P538-Y540 HydrophobicContact CG-CE2 4.24Å
539	T	27.5	Very low	30.9	Very low	121 Å²	121	154.1 Å²	154.1	74%	0.742	78%	0.776	S	S	*	*			trans	-71.7	130.8	175.4	-52.3	0	0	0	0	112
540	Y	32.6	Very low	31.1	Very low	208 Å²	208	157 Å²	157	82%	0.816	79%	0.79	S	S	*	*			trans	-132.4	102.6	163.7	-86.1	-78.2	0	0	0	111.7	P538	P538-Y540 HydrophobicContact CG-CE2 4.24Å
541	S	27.7	Very low	31.3	Very low	105 Å²	105	159.1 Å²	159.1	73%	0.734	79%	0.79	S	S	*	*			trans	-97.4	125.9	164.3	75.2	0	0	0	0	109.5
542	T	34.6	Very low	31.7	Very low	141 Å²	141	156.6 Å²	156.6	87%	0.865	79%	0.788	S	S	*	*			trans	-104.6	74.5	178.9	34.2	0	0	0	0	111.6
543	R	27.9	Very low	31.6	Very low	187 Å²	187	157 Å²	157	71%	0.706	78%	0.784	S	S	*	*			trans	-79.5	113	171.8	-176.7	-171.4	-172.7	-154.2	4.1	111.1
544	R	30.3	Very low	31.6	Very low	241 Å²	241	158.3 Å²	158.3	91%	0.909	79%	0.788	S	S	*	*			trans	-143.6	132.3	156.2	-69.4	-169	-178.5	-174.8	2.2	108.9
545	R	29.6	Very low	31.5	Very low	223 Å²	223	158.1 Å²	158.1	84%	0.842	79%	0.787	S	S	*	*			cis	-147.1	144.2	-2	-154.9	179.5	-163.5	177.7	3.6	109.6
546	W	32.8	Very low	31.6	Very low	212 Å²	212	156.3 Å²	156.3	80%	0.803	79%	0.787	S	S	*	*			trans	-110.5	144.6	168	-87.8	62.8	0	0	0	109.1
547	T	35.3	Very low	31.5	Very low	117 Å²	117	153.8 Å²	153.8	72%	0.718	78%	0.783	S	S	*	*			trans	-163.8	141.7	163.4	44.4	0	0	0	0	106.3
548	S	30.3	Very low	31.8	Very low	111 Å²	111	150.2 Å²	150.2	78%	0.776	78%	0.779	S	S	*	*			cis	-172.5	161.9	-9.6	-82.7	0	0	0	0	105.7
549	A	29.2	Very low	31.8	Very low	87 Å²	87	152.2 Å²	152.2	72%	0.719	79%	0.789	S	S	*	*			cis	-166.5	156.2	-21.9	0	0	0	0	0	107.2
550	E	33.1	Very low	31.9	Very low	192 Å²	192	156 Å²	156	90%	0.897	80%	0.796	S	S	*	*				169.5	116	129.9	-93.5	175.1	-177.8	0	0	112.1
551	I	36.1	Very low	31.8	Very low	165 Å²	165	151 Å²	151	85%	0.846	80%	0.797	S	S	*	*			trans	-154.4	122.5	175.7	-65.1	173.8	0	0	0	103.2
552	P	37.7	Very low	32	Very low	107 Å²	107	149.8 Å²	149.8	70%	0.695	80%	0.801	S	S	*	*				-154	-179.8	101.6	38.1	-14.6	0	0	0	113.6
553	E	33.1	Very low	31.9	Very low	175 Å²	175	149 Å²	149	82%	0.818	80%	0.801	S	S	*	*			cis	-157.4	129.5	47.5	-72.3	-164	154	0	0	117.3
554	V	29	Very low	32.2	Very low	108 Å²	108	144.9 Å²	144.9	66%	0.655	81%	0.808	S	S	*	*			trans	22.6	123.9	130.8	-159	0	0	0	0	122.8	V556	V554-V556 HydrophobicContact CG1-CG2 3.93Å
555	K	31.3	Very low	32.1	Very low	200 Å²	200	141 Å²	141	87%	0.87	80%	0.8	S	S	*	*				173.4	119.5	123.5	-92.1	154	-171.7	167.9	0	109.1
556	V	31	Very low	31.9	Very low	119 Å²	119	137 Å²	137	72%	0.721	79%	0.793	S	S	*	*			cis	83.1	100.7	43.4	-178.4	0	0	0	0	114.2	V554	V554-V556 HydrophobicContact CG1-CG2 3.93Å
557	S	31.4	Very low	31.8	Very low	116 Å²	116	134.9 Å²	134.9	81%	0.811	79%	0.792	S	S	*	*				-178.5	147	119.2	-103	0	0	0	0	113.7
558	P	36.4	Very low	31.4	Very low	113 Å²	113	139.1 Å²	139.1	73%	0.734	80%	0.796	S	S	*	*			trans	-113	-178.8	173.8	42.4	-33.9	0	0	0	113.3
559	V	31.7	Very low	31.6	Very low	149 Å²	149	141 Å²	141	90%	0.903	80%	0.797	S	S	*	*			trans	-159.3	167.8	150.3	124.3	0	0	0	0	111.7
560	F	29.1	Very low	31.8	Very low	201 Å²	201	143.6 Å²	143.6	88%	0.882	80%	0.795	S	S	*	*			trans	-117.1	175.2	-160.3	-108.8	-103.2	0	0	0	115
561	A	29.5	Very low	31.8	Very low	101 Å²	101	140 Å²	140	84%	0.835	78%	0.781	S	S	*	*			trans	104.8	143.1	142.3	0	0	0	0	0	120
562	G	32.8	Very low	31.7	Very low	80 Å²	80	138.1 Å²	138.1	83%	0.825	77%	0.769	S	S	*	*			trans	147.5	101.1	176.5	0	0	0	0	0	112
563	S	31.4	Very low	31.4	Very low	124 Å²	124	140.6 Å²	140.6	87%	0.867	77%	0.765	S	S	*	*			trans	-151.3	132.7	-173	56.1	0	0	0	0	113.3
564	A	34.3	Very low	31.5	Very low	102 Å²	102	139 Å²	139	84%	0.843	76%	0.757	S	S	*	*			trans	-170.5	170.6	161.9	0	0	0	0	0	110.1
565	E	29.2	Very low	31.8	Very low	158 Å²	158	139.5 Å²	139.5	74%	0.738	76%	0.756	S	S	*	*				-176.7	140.1	-58.9	171.8	162.1	-139.5	0	0	109.7
566	M	26.1	Very low	31.8	Very low	140 Å²	140	136.9 Å²	136.9	69%	0.69	75%	0.747	S	S	*	*			trans	61.2	169.5	169.6	-77.5	-171.8	-110.6	0	0	117
567	Q	29.5	Very low	31.9	Very low	167 Å²	167	139.4 Å²	139.4	78%	0.78	75%	0.748	S	S	*	*			cis	-141.1	-165.7	3.4	-144.6	157.3	-11.6	0	0	113.3
568	Y	28.4	Very low	31.8	Very low	207 Å²	207	139.7 Å²	139.7	81%	0.812	75%	0.745	S	S	*	*			trans	-94	162.4	-168	-74.5	-112	0	0	0	114.3
569	D	33.8	Very low	31.5	Very low	149 Å²	149	141 Å²	141	80%	0.797	74%	0.744	S	S	*	*				166.3	160.2	127.6	-88	-0.8	0	0	0	110.5
570	E	32.8	Very low	31.3	Very low	143 Å²	143	141.3 Å²	141.3	67%	0.668	74%	0.736	S	S	*	*			cis	-163.9	166.3	-41.3	-149.9	-172.3	-150.7	0	0	107.1
571	N	32.9	Very low	31.3	Very low	115 Å²	115	137.7 Å²	137.7	62%	0.615	72%	0.721	S	S	*	*			trans	68.6	148.9	157.7	-59.1	-31.6	0	0	0	119.2
572	E	35	Very low	31.1	Very low	126 Å²	126	141.5 Å²	141.5	59%	0.589	72%	0.719	S	S	*	*			cis	-160.2	163.4	-8.1	-124.1	-169.8	-174.2	0	0	112.9
573	R	31.3	Very low	30.9	Very low	160 Å²	160	142 Å²	142	60%	0.604	71%	0.71	S	S	*	*			trans	65.2	116.1	147.8	-69.9	-161.4	149.4	78.7	33.6	120.9
574	E	34.1	Very low	30.8	Very low	142 Å²	142	144.2 Å²	144.2	66%	0.664	71%	0.707	S	S	*	*				83.8	144.3	84.2	-70.9	163.1	-158.1	0	0	112
575	D	36.4	Very low	30.6	Very low	118 Å²	118	145.7 Å²	145.7	63%	0.631	71%	0.705	S	S	*	*			cis	-148.7	163.9	16.4	-153.1	25.2	0	0	0	117.9
576	H	31.6	Very low	30.6	Very low	145 Å²	145	148.6 Å²	148.6	67%	0.671	71%	0.711	S	S	*	*			trans	-42.5	147.1	-178.1	-59.5	-52.8	0	0	0	123.4
577	K	33.2	Very low	31	Very low	172 Å²	172	147.4 Å²	147.4	75%	0.748	71%	0.714	S	S	*	*				155.9	123.3	111.8	-96.7	133.1	-174.3	164.4	0	110.9
578	T	28.6	Very low	31	Very low	122 Å²	122	146.5 Å²	146.5	75%	0.748	71%	0.713	S	S	*	*				50.9	134.2	66.5	70.7	0	0	0	0	112.8
579	I	31	Very low	31	Very low	140 Å²	140	143.7 Å²	143.7	72%	0.718	71%	0.712	S	S	*	*			cis	-145.5	142.7	45.1	-72.4	166.6	0	0	0	112.3
580	E	27.1	Very low	30.7	Very low	155 Å²	155	141.7 Å²	141.7	72%	0.724	70%	0.704	S	S	*	*			trans	-7.9	171.2	148.7	-44.3	172.9	125.5	0	0	123.3
581	H	28	Very low	30.6	Very low	126 Å²	126	142.3 Å²	142.3	58%	0.583	71%	0.707	S	S	*	*			trans	96.6	123.8	135.3	-98.6	-61.6	0	0	0	122
582	F	26.5	Very low	30.4	Very low	180 Å²	180	144.3 Å²	144.3	79%	0.789	72%	0.718	S	S	*	*			trans	66.9	143.6	156.6	-60.4	-55.5	0	0	0	118.5
583	S	27.5	Very low	30.3	Very low	91 Å²	91	148 Å²	148	64%	0.636	73%	0.728	S	S	*	*			cis	-166.1	-175.6	-12.5	56	0	0	0	0	111.9
584	Q	29.8	Very low	30	Very low	171 Å²	171	144.4 Å²	144.4	80%	0.799	73%	0.733	S	S	*	*			trans	88.1	82.3	156.6	-68.9	177.3	12.8	0	0	121.3
585	V	29.5	Very low	29.6	Very low	132 Å²	132	145.9 Å²	145.9	80%	0.8	74%	0.737	S	S	*	*				75.6	107.7	102.4	168.6	0	0	0	0	119.5
586	Y	30.5	Very low	29.2	Very low	219 Å²	219	149.1 Å²	149.1	86%	0.859	74%	0.741	S	S	*	*			trans	-58.1	151.5	146	-87	-90.8	0	0	0	110.9
587	P	33.3	Very low	29.4	Very low	116 Å²	116	148.2 Å²	148.2	75%	0.753	75%	0.752	S	S	*	*				-156.3	-176	73.2	43.2	-22.3	0	0	0	118.4
588	I	30.9	Very low	29.2	Very low	148 Å²	148	146.3 Å²	146.3	76%	0.759	76%	0.755	S	S	*	*			trans	-50.6	133.5	162.5	-61.1	147.1	0	0	0	111.2
589	D	27.8	Very low	29.1	Very low	148 Å²	148	143.8 Å²	143.8	79%	0.791	75%	0.753	S	S	*	*				-160.3	154.8	121	-124.7	-27.1	0	0	0	117.7
590	V	26.8	Very low	29.2	Very low	106 Å²	106	149.2 Å²	149.2	64%	0.642	76%	0.764	S	S	*	*			trans	-50.3	141.7	172.4	171.5	0	0	0	0	114.4
591	H	31.5	Very low	29.2	Very low	156 Å²	156	151.3 Å²	151.3	72%	0.722	77%	0.771	S	S	*	*			trans	-164.5	139.1	131.9	-103.4	26.2	0	0	0	114.7	Y593	H591-Y593 HydrophobicContact CB-CD2 4.5Å; H591-Y593 HydrophobicContact CB-CE2 4.42Å; H591-Y593 AromaticContact CD2-CE2 3.93Å
592	N	28.2	Very low	29.5	Very low	158 Å²	158	155.7 Å²	155.7	85%	0.845	78%	0.782	S	S	*	*			trans	-79.4	136.4	163.5	-91.1	-49.2	0	0	0	109.4
593	Y	31.9	Very low	29.7	Very low	202 Å²	202	152.4 Å²	152.4	79%	0.792	78%	0.779	S	S	*	*			trans	-132.2	99.3	157.8	-91.2	-76.3	0	0	0	112.2	H591	H591-Y593 HydrophobicContact CB-CD2 4.5Å; H591-Y593 HydrophobicContact CB-CE2 4.42Å; H591-Y593 AromaticContact CD2-CE2 3.93Å
594	A	26.3	Very low	30	Very low	86 Å²	86	158.1 Å²	158.1	71%	0.711	79%	0.788	S	S	*	*			trans	-88.4	161.6	152.3	0	0	0	0	0	109.5
595	K	26.2	Very low	29.9	Very low	172 Å²	172	157.4 Å²	157.4	75%	0.748	79%	0.785	S	S	*	*			trans	78.8	156.1	165.4	-134.8	172	-171.9	-179.6	0	115.7
596	Y	28	Very low	29.8	Very low	186 Å²	186	157.8 Å²	157.8	73%	0.729	78%	0.778	S	S	*	*			trans	72.5	89	174.4	-58.2	-75.9	0	0	0	120.2
597	S	35.1	Very low	29.6	Very low	127 Å²	127	154.6 Å²	154.6	89%	0.888	77%	0.77	S	S	*	*			trans	-147.2	44.1	132.4	63.4	0	0	0	0	112.1	G599	S597-G599 PolarHBondContact O-N 3.01Å
598	T	28.6	Very low	29.4	Very low	132 Å²	132	156.3 Å²	156.3	81%	0.81	77%	0.772	S	S	*	*			trans	-68.5	109.9	173.6	46.1	0	0	0	0	111.3
599	G	27.7	Very low	29.2	Very low	69 Å²	69	154.1 Å²	154.1	71%	0.711	77%	0.77	S	S	*	*			trans	155.9	105.5	158.6	0	0	0	0	0	118.1	S597	S597-G599 PolarHBondContact O-N 3.01Å
600	R	31.9	Very low	29.3	Very low	254 Å²	254	152.4 Å²	152.4	96%	0.958	77%	0.768	S	S	*	*				-156.8	148.4	95	-107.6	177	179.7	-175.7	0.2	112.1
601	K	28.1	Very low	29.2	Very low	198 Å²	198	158.3 Å²	158.3	86%	0.861	78%	0.78	S	S	*	*			trans	-89.8	146.7	177.7	-53.1	172.6	-177.9	178.9	0	109.4
602	R	33.2	Very low	29.2	Very low	218 Å²	218	159.4 Å²	159.4	82%	0.823	78%	0.783	S	S	*	*				-171	135.7	115.5	-101.6	170.9	-170.2	-161.9	1.6	110.6
603	P	31.4	Very low	29.1	Very low	111 Å²	111	160.6 Å²	160.6	72%	0.721	78%	0.783	S	S	*	*			trans	-86.4	155.8	169.9	36.5	-33.1	0	0	0	110.4
604	Y	32.7	Very low	28.9	Very low	211 Å²	211	158.3 Å²	158.3	83%	0.827	78%	0.779	S	S	*	*			trans	-145.4	123	158.3	-96.2	-71	0	0	0	110.5
605	H	27.8	Very low	28.8	Very low	157 Å²	157	165 Å²	165	73%	0.727	79%	0.786	S	S	*	*			trans	-54.5	159.1	142.7	-87.8	-142.4	0	0	0	108.5
606	E	27.6	Very low	28.9	Very low	140 Å²	140	163.1 Å²	163.1	65%	0.654	78%	0.783	S	S	*	*			cis	-160.7	170.6	42.8	-157	119.9	-129.3	0	0	112.9
607	Q	25.9	Very low	28.8	Very low	151 Å²	151	157.6 Å²	157.6	71%	0.706	78%	0.776	S	S	*	*			trans	-5.8	129.4	159.2	-57.8	156	33.4	0	0	117.9
608	L	29.9	Very low	28.4	Very low	152 Å²	152	162.6 Å²	162.6	80%	0.796	78%	0.777	S	S	*	*				-169.2	117.4	106.2	-125.3	82.4	0	0	0	113.9
609	S	27	Very low	28.5	Very low	102 Å²	102	164.4 Å²	164.4	71%	0.713	78%	0.776	S	S	*	*			trans	47	155.2	138.1	77.7	0	0	0	0	123.1
610	P	29.5	Very low	28.4	Very low	113 Å²	113	168 Å²	168	73%	0.734	78%	0.779	S	S	*	*			trans	-126.8	108.3	-146.7	36.3	-18	0	0	0	115.6
611	Y	25.4	Very low	28.3	Very low	229 Å²	229	163.2 Å²	163.2	90%	0.898	77%	0.767	S	S	*	*			trans	-146.2	99.1	171.7	-98.4	-82.5	0	0	0	114.8
612	K	30.3	Very low	28.3	Very low	180 Å²	180	160 Å²	160	78%	0.783	76%	0.764	S	S	*	*				178.6	98.7	116	-97.8	173.4	-178.5	177.8	0	111.7	H614	K612-H614 PolarHBondContact O-N 3.23Å; K612-H614 VanDerWaalsContact O-N 3.15Å
613	Q	26.2	Very low	28	Very low	182 Å²	182	155.6 Å²	155.6	85%	0.85	76%	0.755	S	S	*	*			trans	-71.5	99.7	169.6	-176.8	176.7	8	0	0	109.3	R615	Q613-R615 PolarHBondContact O-N 2.86Å
614	H	28.4	Very low	27.9	Very low	154 Å²	154	158.7 Å²	158.7	71%	0.713	76%	0.758	S	S	*	*			trans	-73.3	76.1	176.7	-99.8	-53.9	0	0	0	111.9	K612 I616	K612-H614 PolarHBondContact O-N 3.23Å; K612-H614 VanDerWaalsContact O-N 3.15Å; H614-I616 VanDerWaalsContact ND1-CD1 3.31Å; H614-I616 WeakPolarHBondContact ND1-CD1 3.34Å; H614-I616 PolarHBondContact O-N 3.49Å
615	R	23.9	Very low	27.6	Very low	228 Å²	228	158.3 Å²	158.3	86%	0.86	76%	0.755	S	S	*	*			trans	-91.8	76.4	162.5	-166.2	-176.3	-164.5	-171	5.1	108.3	Q613	Q613-R615 PolarHBondContact O-N 2.86Å
616	I	28.5	Very low	27.7	Very low	132 Å²	132	157 Å²	157	68%	0.677	76%	0.76	S	S	*	*			trans	-138.4	130.8	178.7	-54.8	-174.2	0	0	0	107.9	H614	H614-I616 VanDerWaalsContact ND1-CD1 3.31Å; H614-I616 WeakPolarHBondContact ND1-CD1 3.34Å; H614-I616 PolarHBondContact O-N 3.49Å
617	A	26.6	Very low	27.6	Very low	70 Å²	70	159.7 Å²	159.7	58%	0.579	76%	0.764	S	S	*	*			cis	-152.7	152.1	-24.4	0	0	0	0	0	107.5	E619	A617-E619 HydrophobicContact CB-CG 4.34Å
618	Y	27	Very low	27.6	Very low	231 Å²	231	157.6 Å²	157.6	91%	0.906	77%	0.766	S	S	*	*			trans	-81.2	112	150.3	-92.6	-104.8	0	0	0	105.5	D620	Y618-D620 PolarHBondContact O-N 2.91Å
619	E	28.7	Very low	27.5	Very low	170 Å²	170	159 Å²	159	79%	0.794	77%	0.769	S	S	*	*			trans	-85	96.5	170.7	-73.8	-171.2	146.1	0	0	109.1	A617 E621	A617-E619 HydrophobicContact CB-CG 4.34Å; E619-E621 PolarHBondContact O-N 3.41Å
620	D	27	Very low	27.6	Very low	144 Å²	144	159.5 Å²	159.5	77%	0.77	77%	0.767	S	S	*	*			trans	-67.4	81.7	157.9	-77.7	-50.8	0	0	0	108.8	Y618 V622	Y618-D620 PolarHBondContact O-N 2.91Å; D620-V622 HydrophobicContact CB-CG2 4.31Å; D620-V622 PolarHBondContact O-N 3.46Å
621	E	29.3	Very low	27.4	Very low	155 Å²	155	162.4 Å²	162.4	72%	0.724	77%	0.771	S	S	*	*			trans	-68.6	86	164.9	-89.5	-142.1	124.8	0	0	109.6	E619 I623	E619-E621 PolarHBondContact O-N 3.41Å; E621-I623 HydrophobicContact CB-CG1 4.46Å; E621-I623 PolarHBondContact O-N 3.34Å
622	V	27.3	Very low	27.7	Very low	129 Å²	129	161.1 Å²	161.1	78%	0.782	77%	0.77	S	S	*	*			trans	-70.6	71.2	172.5	-174.7	0	0	0	0	110.1	D620 K624	D620-V622 HydrophobicContact CB-CG2 4.31Å; D620-V622 PolarHBondContact O-N 3.46Å; V622-K624 VanDerWaalsContact C-N 3.33Å; V622-K624 PolarHBondContact O-N 3.42Å; V622-K624 VanDerWaalsContact O-N 3.12Å
623	I	28.4	Very low	27.4	Very low	127 Å²	127	157.7 Å²	157.7	65%	0.651	76%	0.764	S	S	*	*			trans	-86.3	81.7	169.5	-56.4	-174.8	0	0	0	109.3	E621	E621-I623 HydrophobicContact CB-CG1 4.46Å; E621-I623 PolarHBondContact O-N 3.34Å
624	K	27.9	Very low	27.5	Very low	176 Å²	176	155.9 Å²	155.9	77%	0.765	76%	0.756	S	S	*	*			trans	41	103.6	146.7	-63.8	174.2	179.9	174.8	0	117	V622 P626	V622-K624 VanDerWaalsContact C-N 3.33Å; V622-K624 PolarHBondContact O-N 3.42Å; V622-K624 VanDerWaalsContact O-N 3.12Å; K624-P626 WeakPolarHBondContact O-CD 3.34Å
625	R	27.6	Very low	27.4	Very low	202 Å²	202	156.3 Å²	156.3	76%	0.762	75%	0.751	S	S	*	*			trans	-53.3	134.3	150.5	-63.2	174.4	176.2	-179.9	1.6	109.9
626	P	30.5	Very low	27.8	Very low	129 Å²	129	154.5 Å²	154.5	84%	0.838	75%	0.746	S	S	*	*			trans	-81.7	112.4	136	-6.9	26	0	0	0	106.8	K624	K624-P626 WeakPolarHBondContact O-CD 3.34Å
627	W	24.9	Very low	28	Very low	198 Å²	198	155.8 Å²	155.8	75%	0.75	75%	0.753	S	S	*	*			trans	-79.2	162	165.7	-118.8	28.7	0	0	0	109.7
628	S	25.5	Very low	28.1	Very low	106 Å²	106	158.1 Å²	158.1	74%	0.741	76%	0.76	S	S	*	*			trans	50.9	112.8	166.5	59.5	0	0	0	0	118.1
629	Q	28.6	Very low	28.5	Very low	183 Å²	183	153.3 Å²	153.3	86%	0.855	76%	0.758	S	S	*	*				-142.9	103	119.2	-118.8	173.6	12.7	0	0	112.5
630	T	27.1	Very low	28.5	Very low	111 Å²	111	153.5 Å²	153.5	68%	0.681	76%	0.758	S	S	*	*			trans	45.4	117.9	138.5	57.1	0	0	0	0	120.2	K632	T630-K632 PolarHBondContact O-N 2.91Å
631	H	25.7	Very low	28.8	Very low	175 Å²	175	157.2 Å²	157.2	81%	0.81	76%	0.761	S	S	*	*				5	111.6	129.9	-78.1	-106.8	0	0	0	116.2
632	K	31.7	Very low	28.7	Very low	201 Å²	201	153.3 Å²	153.3	87%	0.874	76%	0.763	S	S	*	*			trans	-131.4	96.9	137.5	-75.3	-162	174.5	-178.1	0	110.3	T630	T630-K632 PolarHBondContact O-N 2.91Å
633	T	25.6	Very low	29	Very low	109 Å²	109	153 Å²	153	67%	0.669	76%	0.756	S	S	*	*			trans	-56.2	172.1	146.3	41.5	0	0	0	0	110.5
634	E	26.7	Very low	29.2	Very low	144 Å²	144	152 Å²	152	67%	0.673	76%	0.761	S	S	*	*			trans	80	129.7	-179.8	-56.1	-176.2	-156.2	0	0	114.2
635	R	26.9	Very low	29.4	Very low	163 Å²	163	151.1 Å²	151.1	62%	0.615	76%	0.764	S	S	*	*			cis	-158.5	170.4	1.9	-104.8	166.9	-134.9	-153.3	1.8	108.7
636	Y	31.3	Very low	29.4	Very low	190 Å²	190	153.4 Å²	153.4	75%	0.745	77%	0.772	S	S	*	*			trans	73.3	136.1	166.7	-41.1	-61.6	0	0	0	115.7
637	L	33	Very low	29.3	Very low	158 Å²	158	156.7 Å²	156.7	83%	0.827	77%	0.774	S	S	*	*			cis	-151.6	130.5	-4.4	-116.8	163.3	0	0	0	109.1
638	T	28.9	Very low	29.7	Very low	120 Å²	120	151.9 Å²	151.9	74%	0.736	78%	0.776	S	S	*	*			trans	-116	133.2	179.7	38.1	0	0	0	0	112.1
639	P	35.3	Very low	30	Very low	130 Å²	130	154.2 Å²	154.2	84%	0.844	78%	0.779	S	S	*	*			trans	-75.6	126.1	161.3	-13.1	29.6	0	0	0	110.2
640	H	29	Very low	30	Very low	173 Å²	173	150.2 Å²	150.2	80%	0.801	77%	0.771	S	S	*	*			trans	-65.6	136.5	175.3	-75.1	-119.1	0	0	0	111.9
641	R	32.8	Very low	30.2	Very low	222 Å²	222	151.5 Å²	151.5	84%	0.838	77%	0.773	S	S	*	*				-175.6	134.8	95.1	-106.3	-176.7	169.6	133.6	0.8	113.3	D643	R641-D643 IonicContact NE-OD2 3.33Å; R641-D643 PolarHBondContact NE-OD2 3.02Å
642	G	27.5	Very low	30.6	Very low	74 Å²	74	149.9 Å²	149.9	76%	0.763	77%	0.771	S	S	*	*			trans	-143.2	34.6	172.7	0	0	0	0	0	111.2
643	D	33.9	Very low	30.5	Very low	121 Å²	121	149.6 Å²	149.6	65%	0.647	77%	0.77	S	S	*	*			trans	-78.5	125.9	-176.9	-62.2	-45.6	0	0	0	110.5	R641	R641-D643 IonicContact NE-OD2 3.33Å; R641-D643 PolarHBondContact NE-OD2 3.02Å
644	S	32.5	Very low	30.9	Very low	107 Å²	107	150.5 Å²	150.5	75%	0.748	78%	0.778	S	S	*	*			trans	-86.4	-176.8	179.9	-67	0	0	0	0	112.5
645	L	32	Very low	30.9	Very low	158 Å²	158	148.4 Å²	148.4	83%	0.827	78%	0.779	S	S	*	*			trans	74.4	71.3	160.9	-57.9	170.9	0	0	0	118.1	K647	L645-K647 PolarHBondContact O-N 3.19Å; L645-K647 VanDerWaalsContact O-N 3.11Å
646	R	27.1	Very low	31.2	Very low	249 Å²	249	151.6 Å²	151.6	94%	0.94	79%	0.792	S	S	*	*				32.8	74.5	111	-168	-166.2	-107.7	-149.1	-1.7	115.7
647	K	30	Very low	31	Very low	199 Å²	199	150.4 Å²	150.4	87%	0.865	80%	0.796	S	S	*	*			trans	-151.6	144.2	163.3	-110.6	174.7	179.5	177.9	0	109.6	L645	L645-K647 PolarHBondContact O-N 3.19Å; L645-K647 VanDerWaalsContact O-N 3.11Å
648	A	33.1	Very low	31.1	Very low	96 Å²	96	147.9 Å²	147.9	79%	0.793	79%	0.789	S	S	*	*			trans	51.8	97.8	-170.9	0	0	0	0	0	113.8
649	L	30.7	Very low	31.3	Very low	155 Å²	155	147.8 Å²	147.8	81%	0.812	79%	0.788	S	S	*	*			cis	64.4	113.9	18.5	-122.1	177.1	0	0	0	114.7
650	S	29.3	Very low	31.2	Very low	99 Å²	99	147 Å²	147	69%	0.692	78%	0.783	S	S	*	*			trans	79.4	149.9	156.3	78.1	0	0	0	0	120.7
651	L	31.6	Very low	31.2	Very low	138 Å²	138	146.3 Å²	146.3	72%	0.723	78%	0.784	S	S	*	*			trans	79.7	93.6	158.8	-60.2	163.6	0	0	0	119.5
652	D	33.7	Very low	31.3	Very low	142 Å²	142	143.8 Å²	143.8	76%	0.759	78%	0.782	S	S	*	*				82	132.2	121.2	-59.6	-6.9	0	0	0	123.3
653	K	29.8	Very low	31.5	Very low	195 Å²	195	147 Å²	147	85%	0.848	78%	0.78	S	S	*	*			trans	-75.4	159.4	159.4	-56.3	170.1	-177.8	171.4	0	108.5
654	P	34.1	Very low	31.6	Very low	128 Å²	128	147.4 Å²	147.4	83%	0.831	79%	0.789	S	S	*	*				-126	140.6	114.7	34.6	-31.8	0	0	0	113.2
655	S	27.1	Very low	31.4	Very low	100 Å²	100	147 Å²	147	70%	0.699	79%	0.786	S	S	*	*			trans	-87.2	133.3	167	49.6	0	0	0	0	110.5
656	Y	32.5	Very low	31.5	Very low	229 Å²	229	145.5 Å²	145.5	90%	0.898	78%	0.784	S	S	*	*			trans	-146.8	126.2	153.3	-101.5	-77.3	0	0	0	111.5
657	M	26.7	Very low	31.7	Very low	166 Å²	166	140.2 Å²	140.2	82%	0.818	77%	0.774	S	S	*	*			trans	-103.2	-174.4	154.6	-62.4	-167.1	75	0	0	107.5
658	P	36.4	Very low	31.9	Very low	105 Å²	105	137.7 Å²	137.7	68%	0.682	77%	0.765	S	S	*	*			cis	-123.6	-164.2	-19.7	28.1	-6.5	0	0	0	111.1
659	T	32.3	Very low	31.6	Very low	118 Å²	118	139.6 Å²	139.6	72%	0.724	76%	0.757	S	S	*	*				138.8	125	127.6	-55.6	0	0	0	0	112.4
660	P	32.9	Very low	31.6	Very low	113 Å²	113	140.4 Å²	140.4	73%	0.734	75%	0.751	S	S	*	*			trans	-94.7	156.8	173.6	37.5	-33.6	0	0	0	112.3
661	L	29.1	Very low	31.7	Very low	159 Å²	159	141.9 Å²	141.9	83%	0.832	75%	0.747	S	S	*	*			trans	-173.8	168	147.6	-108.8	163.4	0	0	0	114
662	H	34.4	Very low	31.8	Very low	168 Å²	168	142.5 Å²	142.5	78%	0.778	75%	0.745	S	S	*	*			trans	70.3	107.3	165.7	-87.3	-72	0	0	0	122.6
663	I	32.1	Very low	31.5	Very low	143 Å²	143	139.9 Å²	139.9	73%	0.733	74%	0.738	S	S	*	*			trans	-79.7	154.8	150	-40.6	171.1	0	0	0	107.5
664	P	35.4	Very low	31.6	Very low	128 Å²	128	135.7 Å²	135.7	83%	0.831	73%	0.734	S	S	*	*				-135.6	160.7	115.4	37.8	-28.9	0	0	0	114.3
665	S	29.2	Very low	31.4	Very low	99 Å²	99	137.4 Å²	137.4	69%	0.692	73%	0.73	S	S	*	*			trans	-117.7	139.4	-170.8	54.7	0	0	0	0	113.3
666	T	34.9	Very low	31.7	Very low	126 Å²	126	139.2 Å²	139.2	77%	0.773	73%	0.727	S	S	*	*			trans	-145.5	136	157.1	44.6	0	0	0	0	107.4
667	L	30.9	Very low	31.6	Very low	139 Å²	139	135.2 Å²	135.2	73%	0.728	72%	0.717	S	S	*	*				58.9	129.6	63.1	-59.9	166.5	0	0	0	110.4
668	Q	32.7	Very low	31.9	Very low	146 Å²	146	133.8 Å²	133.8	68%	0.682	71%	0.712	S	S	*	*			cis	-148.9	146.6	9.6	-111.8	154	-39.2	0	0	109
669	Q	27.3	Very low	31.8	Very low	136 Å²	136	137.4 Å²	137.4	64%	0.636	72%	0.717	S	S	*	*				50.3	119.6	93.8	-166.8	-172.9	-11	0	0	114.1
670	Y	31.4	Very low	31.8	Very low	172 Å²	172	138.7 Å²	138.7	68%	0.675	71%	0.714	S	S	*	*				165.5	120	127.6	-106.3	-97	0	0	0	113.1
671	H	31.2	Very low	32	Very low	130 Å²	130	139.1 Å²	139.1	60%	0.602	72%	0.717	S	S	*	*			trans	55.9	164.3	138.5	-69.7	-137.8	0	0	0	119.7
672	H	34	Very low	32.1	Very low	150 Å²	150	139.5 Å²	139.5	69%	0.694	72%	0.715	S	S	*	*			cis	-143.2	134	-15	-99.5	-53.8	0	0	0	104.2
673	S	28	Very low	32.2	Very low	88 Å²	88	140.9 Å²	140.9	62%	0.615	72%	0.722	S	S	*	*				59.9	152.3	69.3	78.5	0	0	0	0	116.8
674	S	31.2	Very low	32.1	Very low	107 Å²	107	139.1 Å²	139.1	75%	0.748	72%	0.722	S	S	*	*			trans	81.2	118.1	-175	85.5	0	0	0	0	112.9
675	H	30.1	Very low	32.1	Very low	164 Å²	164	140.4 Å²	140.4	76%	0.759	72%	0.721	S	S	*	*				81.9	149.1	80.9	-80.2	-144.2	0	0	0	112.4
676	E	33.1	Very low	32.4	Very low	137 Å²	137	145.1 Å²	145.1	64%	0.64	73%	0.732	S	S	*	*			cis	-151.5	-176.1	11.5	-136.9	159.5	113.1	0	0	114.2
677	Q	30.6	Very low	32.3	Very low	146 Å²	146	143.7 Å²	143.7	68%	0.682	73%	0.727	S	S	*	*			trans	-3.4	145	149.9	-69.9	173.7	65.9	0	0	117.7
678	L	32.2	Very low	32.4	Very low	135 Å²	135	146.4 Å²	146.4	71%	0.707	73%	0.733	S	S	*	*			cis	-161.1	-170.1	25.2	-146.2	63.5	0	0	0	107.6
679	K	34.2	Very low	32.4	Very low	181 Å²	181	149.5 Å²	149.5	79%	0.787	75%	0.745	S	S	*	*			cis	-159.3	168.6	3.6	-158	177.9	-171.3	170.8	0	109.6
680	H	32	Very low	32.7	Very low	145 Å²	145	149.6 Å²	149.6	67%	0.671	75%	0.754	S	S	*	*			trans	-92	156.5	162.7	-85.3	-106.3	0	0	0	110.5
681	P	37.4	Very low	32.6	Very low	122 Å²	122	152.5 Å²	152.5	79%	0.792	76%	0.764	S	S	*	*				-117.4	160.7	61.8	9.3	13.6	0	0	0	112.9
682	E	32.7	Very low	32.6	Very low	167 Å²	167	155.3 Å²	155.3	78%	0.78	78%	0.778	S	S	*	*			cis	58.9	72	31.9	-73.3	-158.3	161.3	0	0	115.8
683	E	35.2	Very low	32.5	Very low	198 Å²	198	156.5 Å²	156.5	93%	0.925	78%	0.784	S	S	*	*			trans	-138.4	126.7	149.1	-142	166.3	-133.2	0	0	110.5
684	S	29.7	Very low	32.6	Very low	105 Å²	105	160.2 Å²	160.2	73%	0.734	79%	0.791	S	S	*	*			trans	-87	140.4	-178.9	53.8	0	0	0	0	111.1
685	L	36.3	Very low	32.6	Very low	155 Å²	155	165 Å²	165	81%	0.812	80%	0.798	S	S	*	*			trans	-157.4	120	150.1	-113.1	159.2	0	0	0	113.4	S687	L685-S687 PolarHBondContact O-N 3.16Å; L685-S687 PolarHBondContact O-OG 2.86Å
686	E	34.8	Very low	32.6	Very low	198 Å²	198	162.2 Å²	162.2	93%	0.925	78%	0.784	S	S	*	*			trans	-66.8	87.6	-170.8	-65.1	158.7	106.5	0	0	112.4
687	S	32.7	Very low	32.5	Very low	96 Å²	96	163.6 Å²	163.6	67%	0.671	79%	0.785	S	S	*	*			trans	-141.4	-14.3	-172.6	56.6	0	0	0	0	115.7	L685	L685-S687 PolarHBondContact O-N 3.16Å; L685-S687 PolarHBondContact O-OG 2.86Å
688	K	33.3	Very low	32.4	Very low	196 Å²	196	165.2 Å²	165.2	85%	0.852	79%	0.792	S	S	*	*	S	Bend	trans	-94.1	-2.2	-177.6	-74.6	-179.1	176.9	173.1	0	115	T690	K688-T690 VanDerWaalsContact C-N 3.29Å; K688-T690 PolarHBondContact O-N 3.48Å
689	F	32.5	Very low	32.5	Very low	212 Å²	212	166.5 Å²	166.5	93%	0.93	80%	0.798	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	31.5	-174.2	-121.2	-80.9	0	0	0	115
690	T	33.7	Very low	32.3	Very low	137 Å²	137	162.3 Å²	162.3	84%	0.84	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-155.2	25.6	175	-0.2	0	0	0	0	115.4	K688	K688-T690 VanDerWaalsContact C-N 3.29Å; K688-T690 PolarHBondContact O-N 3.48Å
691	R	29.1	Very low	32	Very low	234 Å²	234	166.3 Å²	166.3	88%	0.883	80%	0.8	S	S	*	*			trans	-145.5	46.1	-174.8	-134.1	175.7	-169.1	-171.1	2.4	118.1
692	Q	32.8	Very low	31.6	Very low	188 Å²	188	170.1 Å²	170.1	88%	0.879	80%	0.8	S	S	*	*			trans	-132.1	60	163	-76.7	-167.1	-21.7	0	0	112.7
693	Q	31.2	Very low	31.3	Very low	176 Å²	176	167.5 Å²	167.5	82%	0.822	80%	0.8	S	S	*	*	S	Bend	trans	-106.3	150.3	145.1	-71.5	-174.7	-10.1	0	0	107.5
694	H	29.7	Very low	31.1	Very low	166 Å²	166	161.6 Å²	161.6	77%	0.769	78%	0.781	S	S	*	*			trans	61.6	79.7	-170.8	-66.7	-102.5	0	0	0	115.1
695	F	31.6	Very low	30.9	Very low	206 Å²	206	161.6 Å²	161.6	90%	0.904	78%	0.781	S	S	*	*			trans	-114	134.2	134.7	-110.1	-91.5	0	0	0	109
696	K	30.1	Very low	30.6	Very low	107 Å²	107	162.2 Å²	162.2	47%	0.465	78%	0.777	S	S	.	*			trans	-117.2	156.7	-176.9	-173.2	178.5	177.7	-175.7	0	108.2	Y478	Y478-K696 PolarHBondContact OH-NZ 2.94Å; Y478-K696 VanDerWaalsContact OH-NZ 3.11Å
697	Y	31.1	Very low	30.3	Very low	166 Å²	166	159.9 Å²	159.9	65%	0.651	77%	0.771	S	S	*	*			trans	89	148.7	171.8	-53.6	-70.4	0	0	0	118.2
698	H	28	Very low	30.2	Very low	180 Å²	180	165.1 Å²	165.1	83%	0.833	78%	0.778	S	S	*	*			trans	59.1	81.7	170.2	-60.9	-68.2	0	0	0	119
699	I	33.2	Very low	30.2	Very low	161 Å²	161	161 Å²	161	83%	0.826	77%	0.771	S	S	*	*			trans	-113.8	136.1	136.9	-62.4	177.9	0	0	0	106.4
700	P	31	Very low	29.9	Very low	94 Å²	94	156.4 Å²	156.4	61%	0.61	77%	0.765	S	S	*	*			trans	-75.5	146.3	-171.2	-15.6	30.9	0	0	0	113.7	Y702	P700-Y702 HydrophobicContact CB-CD2 4.19Å; P700-Y702 HydrophobicContact CB-CE2 4.33Å; P700-Y702 HydrophobicContact CG-CE2 4.35Å; P700-Y702 PolarHBondContact O-N 3.48Å
701	Y	25.9	Very low	29.8	Very low	228 Å²	228	158 Å²	158	89%	0.894	77%	0.768	S	S	*	*			trans	-69	94.6	156.8	-86.4	-94.8	0	0	0	108.9	S703	Y701-S703 VanDerWaalsContact C-N 3.35Å; Y701-S703 PolarHBondContact O-N 3.07Å
702	Y	29.6	Very low	29.8	Very low	202 Å²	202	152.7 Å²	152.7	79%	0.792	77%	0.767	S	S	*	*			trans	-74.3	92.2	164.5	-95.9	-83.4	0	0	0	109.4	P700 S704	P700-Y702 HydrophobicContact CB-CD2 4.19Å; P700-Y702 HydrophobicContact CB-CE2 4.33Å; P700-Y702 HydrophobicContact CG-CE2 4.35Å; P700-Y702 PolarHBondContact O-N 3.48Å; Y702-S704 PolarHBondContact O-N 2.92Å
703	S	25.6	Very low	29.7	Very low	112 Å²	112	149.6 Å²	149.6	78%	0.783	77%	0.765	S	S	*	*			trans	-68.1	79.4	156.3	-64.6	0	0	0	0	108.3	Y701 S705	Y701-S703 VanDerWaalsContact C-N 3.35Å; Y701-S703 PolarHBondContact O-N 3.07Å; S703-S705 VanDerWaalsContact C-N 3.32Å; S703-S705 PolarHBondContact O-N 3.34Å
704	S	30.5	Very low	29.6	Very low	75 Å²	75	146.6 Å²	146.6	52%	0.524	76%	0.764	S	S	.	*			trans	-74.5	86.1	177	59.8	0	0	0	0	110	Y702 F706	Y702-S704 PolarHBondContact O-N 2.92Å; S704-F706 VanDerWaalsContact C-N 3.33Å; S704-F706 PolarHBondContact O-N 3Å
705	S	26.6	Very low	29.8	Very low	105 Å²	105	148.2 Å²	148.2	73%	0.734	77%	0.769	S	S	*	*			trans	-57.5	100.4	155.6	-67.5	0	0	0	0	107.8	S703 D707	S703-S705 VanDerWaalsContact C-N 3.32Å; S703-S705 PolarHBondContact O-N 3.34Å; S705-D707 PolarHBondContact O-N 3.15Å
706	F	29.7	Very low	29.9	Very low	167 Å²	167	145.1 Å²	145.1	73%	0.732	77%	0.767	S	S	*	*			trans	-82.3	89.7	171.2	-100.6	-83.8	0	0	0	108.8	S704 Y708	S704-F706 VanDerWaalsContact C-N 3.33Å; S704-F706 PolarHBondContact O-N 3Å; F706-Y708 PolarHBondContact O-N 2.86Å
707	D	28.6	Very low	29.8	Very low	149 Å²	149	150.4 Å²	150.4	80%	0.797	78%	0.784	S	S	*	*			trans	-61.1	104.3	166.2	-71.2	-46.7	0	0	0	108.9	S705	S705-D707 PolarHBondContact O-N 3.15Å
708	Y	29.8	Very low	29.8	Very low	206 Å²	206	148.1 Å²	148.1	81%	0.808	79%	0.79	S	S	*	*			trans	-69.1	127.9	172.4	-92.3	-95.7	0	0	0	109.4	F706 S710	F706-Y708 PolarHBondContact O-N 2.86Å; Y708-S710 PolarHBondContact O-N 2.71Å
709	P	33.9	Very low	29.8	Very low	109 Å²	109	146 Å²	146	71%	0.708	78%	0.784	S	S	*	*			trans	-64.3	125.4	179	26	-33.4	0	0	0	110.3	L711	P709-L711 PolarHBondContact O-N 2.93Å
710	S	27	Very low	29.8	Very low	117 Å²	117	146 Å²	146	82%	0.818	78%	0.784	S	S	*	*			trans	-74.2	81.3	-174.2	41.5	0	0	0	0	112.5	Y708 S712	Y708-S710 PolarHBondContact O-N 2.71Å; S710-S712 PolarHBondContact O-N 2.89Å
711	L	31.3	Very low	29.7	Very low	171 Å²	171	150 Å²	150	90%	0.895	79%	0.794	S	S	*	*			trans	-67	92.9	167.8	-88.1	165.9	0	0	0	110.5	P709 S713	P709-L711 PolarHBondContact O-N 2.93Å; L711-S713 PolarHBondContact O-N 3.42Å
712	S	27.8	Very low	29.9	Very low	122 Å²	122	145.4 Å²	145.4	85%	0.853	79%	0.792	S	S	*	*			trans	-72.7	109.1	173.4	48.4	0	0	0	0	111.3	S710	S710-S712 PolarHBondContact O-N 2.89Å
713	S	31.7	Very low	29.7	Very low	122 Å²	122	138.4 Å²	138.4	85%	0.853	78%	0.782	S	S	*	*			trans	-119.6	130.6	153.4	-171.1	0	0	0	0	108.5	L711	L711-S713 PolarHBondContact O-N 3.42Å
714	S	29.3	Very low	29.8	Very low	114 Å²	114	143.6 Å²	143.6	80%	0.797	79%	0.785	S	S	*	*			trans	-94.6	116.1	-161.2	54.9	0	0	0	0	113.3
715	K	33.5	Very low	29.8	Very low	200 Å²	200	147.3 Å²	147.3	87%	0.87	80%	0.798	S	S	*	*			trans	-154.5	104.9	147.3	-109.3	163.6	-174	-177.8	0	111.5
716	T	33.2	Very low	29.9	Very low	140 Å²	140	149.1 Å²	149.1	86%	0.859	80%	0.795	S	S	*	*			trans	37	109.6	152.5	46.5	0	0	0	0	120.8
717	R	28.1	Very low	30.1	Very low	219 Å²	219	147 Å²	147	83%	0.826	80%	0.795	S	S	*	*			trans	-42.4	164.7	153.1	-97.9	-177.2	-176	-166.2	1.3	114.8	L719	R717-L719 HydrophobicContact CG-CD1 4.27Å
718	P	31.9	Very low	30.1	Very low	118 Å²	118	149.4 Å²	149.4	77%	0.766	80%	0.795	S	S	*	*			cis	-134.3	170.8	40.1	39.9	-22.5	0	0	0	118.6
719	L	27.2	Very low	30	Very low	135 Å²	135	145.2 Å²	145.2	71%	0.707	79%	0.786	S	S	*	*			trans	-82.6	146.5	174.1	-56.8	90.1	0	0	0	110.6	R717	R717-L719 HydrophobicContact CG-CD1 4.27Å
720	I	33	Very low	29.6	Very low	162 Å²	162	149.3 Å²	149.3	83%	0.831	79%	0.793	S	S	*	*			trans	-131.8	141.2	164.3	-59.7	-179.2	0	0	0	108.1
721	H	29.3	Very low	29.8	Very low	176 Å²	176	153.9 Å²	153.9	82%	0.815	80%	0.799	S	S	*	*			trans	-68.1	142.9	177.1	-104	-109.5	0	0	0	111.3	G723	H721-G723 PolarHBondContact O-N 3.39Å
722	P	30.5	Very low	29.7	Very low	132 Å²	132	151 Å²	151	86%	0.857	79%	0.793	S	S	*	*	S	Bend	trans	-75.2	95.7	168.7	30.9	-32.3	0	0	0	109.9
723	G	25.8	Very low	29.9	Very low	56 Å²	56	151.1 Å²	151.1	58%	0.577	79%	0.791	S	S	*	*			trans	-168.1	127.4	173.2	0	0	0	0	0	110.8	H721	H721-G723 PolarHBondContact O-N 3.39Å
724	Y	26.9	Very low	29.9	Very low	221 Å²	221	153.4 Å²	153.4	87%	0.867	79%	0.792	S	S	*	*			trans	51.6	91.8	178	-64.4	-84.9	0	0	0	117.1
725	I	31	Very low	30.2	Very low	152 Å²	152	156.4 Å²	156.4	78%	0.779	79%	0.793	S	S	*	*			trans	-129.1	113	147.8	-61.8	-178.2	0	0	0	108.3	T727	I725-T727 HydrophobicContact CG2-CG2 4.25Å
726	Q	28.7	Very low	30.1	Very low	144 Å²	144	156 Å²	156	67%	0.673	79%	0.794	S	S	*	*			trans	-81.2	118.1	159.4	-68.3	175.6	-74.2	0	0	107.4	Y728	Q726-Y728 PolarHBondContact O-N 3.4Å
727	T	32.6	Very low	30.3	Very low	121 Å²	121	158.8 Å²	158.8	74%	0.742	80%	0.795	S	S	*	*			trans	-79.2	99.1	175.4	47.2	0	0	0	0	110.2	I725	I725-T727 HydrophobicContact CG2-CG2 4.25Å
728	Y	30	Very low	30.6	Very low	201 Å²	201	151.5 Å²	151.5	79%	0.788	79%	0.787	S	S	*	*			trans	-78.4	140.1	158.6	-85.4	-91.4	0	0	0	109.6	Q726 F730	Q726-Y728 PolarHBondContact O-N 3.4Å; Y728-F730 PolarHBondContact O-N 2.83Å
729	N	26.7	Very low	30.5	Very low	117 Å²	117	153.2 Å²	153.2	63%	0.626	79%	0.79	S	S	*	*			trans	-75.1	119.8	-173.8	-63.3	-10.5	0	0	0	111.9
730	F	26.2	Very low	30.8	Very low	195 Å²	195	156.4 Å²	156.4	86%	0.855	80%	0.798	S	S	*	*			trans	-156.8	101.5	157.3	-94.8	-68.9	0	0	0	111.1	Y728	Y728-F730 PolarHBondContact O-N 2.83Å
731	F	30.6	Very low	30.9	Very low	213 Å²	213	156.4 Å²	156.4	93%	0.934	80%	0.795	S	S	*	*			trans	-154.8	116.8	154.6	-92.6	-67	0	0	0	110.3
732	S	28.9	Very low	31.2	Very low	110 Å²	110	153.5 Å²	153.5	77%	0.769	79%	0.794	S	S	*	*			trans	-107.8	129.6	154.2	-62.5	0	0	0	0	106.9
733	P	31.8	Very low	31.3	Very low	125 Å²	125	155.8 Å²	155.8	81%	0.812	79%	0.794	S	S	*	*			trans	-80.3	134	178.1	31.9	-32.6	0	0	0	110.7
734	I	33.3	Very low	31.8	Very low	170 Å²	170	157.8 Å²	157.8	87%	0.872	80%	0.795	S	S	*	*			trans	-129.2	148.4	162.4	-66.1	-176.3	0	0	0	107.3
735	E	34.9	Very low	32	Very low	178 Å²	178	156.9 Å²	156.9	83%	0.832	80%	0.795	S	S	*	*			trans	-76.6	158.6	-156.3	-58.3	-179.6	129.4	0	0	115.5
736	E	32.3	Very low	32	Very low	191 Å²	191	153.4 Å²	153.4	89%	0.893	80%	0.797	S	S	*	*			trans	-71.5	120.9	168.9	175.5	178.8	-137	0	0	111.1
737	K	36	Very low	32	Very low	199 Å²	199	155.8 Å²	155.8	87%	0.865	81%	0.808	S	S	*	*			trans	-156.4	130.6	158.5	-111.2	160.4	-169.5	164	0	110
738	G	35.3	Very low	32.1	Very low	65 Å²	65	155.1 Å²	155.1	67%	0.67	81%	0.805	S	S	*	*			trans	-85.3	154.6	179.4	0	0	0	0	0	113.3
739	D	29.5	Very low	32.1	Very low	154 Å²	154	153.4 Å²	153.4	82%	0.824	81%	0.809	S	S	*	*			trans	38.5	106.7	141.9	-46.4	-20.1	0	0	0	118.4
740	F	34.2	Very low	32.4	Very low	202 Å²	202	156.7 Å²	156.7	89%	0.886	82%	0.823	S	S	*	*				-159.1	167.4	106.1	-114.1	-79	0	0	0	111.1
741	E	34.6	Very low	32.8	Very low	163 Å²	163	151.6 Å²	151.6	76%	0.762	81%	0.811	S	S	*	*			trans	-95.2	167.8	-160.2	-56	173.5	113.6	0	0	114.9
742	S	35.2	Very low	32.9	Very low	114 Å²	114	150.4 Å²	150.4	80%	0.797	81%	0.806	S	S	*	*			trans	70.7	150.3	162.5	80	0	0	0	0	117.3
743	E	33.2	Very low	33.1	Very low	181 Å²	181	154.5 Å²	154.5	85%	0.846	81%	0.81	S	S	*	*			cis	-149	179.5	-13.4	-129.5	-178.8	178.4	0	0	112.6
744	T	35.3	Very low	33.3	Very low	98 Å²	98	153.1 Å²	153.1	60%	0.601	80%	0.801	S	S	*	*			trans	-64	141.5	-162.2	48.6	0	0	0	0	120.2
745	K	32.1	Very low	33.3	Very low	201 Å²	201	153.6 Å²	153.6	87%	0.874	80%	0.8	S	S	*	*			trans	66.2	126	136	-62.6	163.3	-172.1	171.1	0	120.6
746	G	31.3	Very low	33.1	Very low	79 Å²	79	151.9 Å²	151.9	81%	0.814	80%	0.796	S	S	*	*			trans	167.4	87	157.2	0	0	0	0	0	118.4
747	H	29	Very low	33.4	Very low	194 Å²	194	149.6 Å²	149.6	90%	0.898	79%	0.79	S	S	*	*			trans	-101.1	167.9	156.7	-78.9	-58.7	0	0	0	108.7
748	P	34.8	Very low	33.5	Very low	107 Å²	107	146.8 Å²	146.8	70%	0.695	79%	0.785	S	S	*	*			cis	-145	170.5	19.9	43.7	-24.4	0	0	0	119.4
749	L	29.3	Very low	33.6	Very low	165 Å²	165	150.9 Å²	150.9	86%	0.864	79%	0.791	S	S	*	*			trans	41.5	113.5	140.3	-65	167.9	0	0	0	123.3
750	M	32.3	Very low	34	Very low	186 Å²	186	149.9 Å²	149.9	92%	0.916	79%	0.785	S	S	*	*			trans	179.2	154.7	133.5	-88.6	-115.8	165.8	0	0	109.4
751	S	34.6	Very low	33.9	Very low	88 Å²	88	148.2 Å²	148.2	62%	0.615	78%	0.777	S	S	*	*			cis	-168.2	140.4	-27.9	62	0	0	0	0	111.6
752	K	33.6	Very low	34.1	Very low	189 Å²	189	146.7 Å²	146.7	82%	0.822	77%	0.77	S	S	*	*			trans	64.4	119.1	160.7	-63	-179.4	176.8	-179.6	0	121.6
753	F	32.4	Very low	34.1	Very low	196 Å²	196	148.1 Å²	148.1	86%	0.86	76%	0.762	S	S	*	*				20.9	155.8	122.7	-59.7	-80.5	0	0	0	122.2
754	P	36.6	Very low	34.2	Very low	96 Å²	96	148 Å²	148	62%	0.623	76%	0.759	S	S	*	*			cis	-144.9	-179	-43.7	41.8	-24	0	0	0	114.6
755	E	32.6	Very low	34.2	Very low	179 Å²	179	151 Å²	151	84%	0.836	77%	0.766	S	S	*	*			trans	66.8	154.4	154.2	-76.4	165.3	174.8	0	0	121.1
756	D	31.9	Very low	34.2	Very low	142 Å²	142	150.5 Å²	150.5	76%	0.759	76%	0.764	S	S	*	*			trans	43.8	109.4	176.8	-64.5	-10.2	0	0	0	120.5
757	N	37.9	Very low	34.3	Very low	144 Å²	144	154.2 Å²	154.2	77%	0.77	76%	0.763	S	S	*	*				-177.8	132.1	112.2	-84.5	-43.4	0	0	0	112.4
758	D	37.5	Very low	34.4	Very low	140 Å²	140	154.1 Å²	154.1	75%	0.749	76%	0.756	S	S	*	*			trans	51	117.1	133.9	-54.8	-18.1	0	0	0	123.4
759	D	37.6	Very low	34.3	Very low	151 Å²	151	155.1 Å²	155.1	81%	0.807	76%	0.763	S	S	*	*				97.2	152.1	121.2	-111.3	-23.2	0	0	0	125.3
760	I	37.2	Very low	34.4	Very low	133 Å²	133	153.6 Å²	153.6	68%	0.682	76%	0.76	S	S	*	*			trans	85.4	98.6	154.2	-70.5	160.2	0	0	0	120.9
761	F	33.9	Very low	34.2	Very low	166 Å²	166	153.3 Å²	153.3	73%	0.728	76%	0.756	S	S	*	*			trans	81.9	108.9	137.9	-87	-109.7	0	0	0	124.1
762	E	37.3	Very low	34.1	Very low	132 Å²	132	156.6 Å²	156.6	62%	0.617	77%	0.765	S	S	*	*				56.2	147	123.9	-65.8	-150.5	121.4	0	0	122.1
763	K	34.9	Very low	34.1	Very low	143 Å²	143	156.4 Å²	156.4	62%	0.622	77%	0.765	S	S	*	*			cis	-159.9	154.9	15.7	-136.8	168.8	179.2	85.6	0	111.1
764	K	35.7	Very low	34.1	Very low	179 Å²	179	154.3 Å²	154.3	78%	0.778	76%	0.763	S	S	*	*			trans	67.4	146.6	163.1	-62.8	-179.2	-177.9	179.6	0	118.3
765	Q	35.1	Very low	34	Very low	162 Å²	162	155.8 Å²	155.8	76%	0.757	77%	0.765	S	S	*	*			cis	-163.4	115.2	-25.9	-167.4	162.2	3.7	0	0	108.5
766	K	31.9	Very low	34.1	Very low	189 Å²	189	156.2 Å²	156.2	82%	0.822	77%	0.767	S	S	*	*			trans	-107.6	138.2	170	-85.2	-176.4	176	176.6	0	109.8
767	I	34.1	Very low	34.1	Very low	157 Å²	157	152.8 Å²	152.8	81%	0.805	77%	0.765	S	S	*	*			trans	-99.7	118.1	177.5	-62.8	172.7	0	0	0	108.9
768	Y	30.3	Very low	33.9	Very low	193 Å²	193	153.8 Å²	153.8	76%	0.757	77%	0.77	S	S	*	*			trans	-123.2	141.9	158.7	-81.4	-83.4	0	0	0	107.9
769	P	34.1	Very low	33.7	Very low	128 Å²	128	151.6 Å²	151.6	83%	0.831	77%	0.765	S	S	*	*			trans	-72.9	130.9	177	29.9	-33.4	0	0	0	110.7
770	V	30.6	Very low	33.5	Very low	133 Å²	133	149.9 Å²	149.9	81%	0.806	76%	0.761	S	S	*	*			trans	-100.3	139.5	176.9	175.1	0	0	0	0	109.8
771	Q	29.3	Very low	33.3	Very low	179 Å²	179	150.9 Å²	150.9	84%	0.836	76%	0.762	S	S	*	*			trans	-118.7	175.3	160.4	-80.4	-167.8	-21.1	0	0	109.4
772	I	31.6	Very low	33.3	Very low	157 Å²	157	149.9 Å²	149.9	81%	0.805	76%	0.757	S	S	*	*			trans	82.2	103.6	-178.6	-49.6	164.2	0	0	0	113.8
773	K	32.7	Very low	33.1	Very low	186 Å²	186	150.4 Å²	150.4	81%	0.809	76%	0.76	S	S	*	*				-162.1	114.8	115.1	-110.4	-171.4	175.7	-163.4	0	111
774	D	32.4	Very low	33	Very low	152 Å²	152	152.4 Å²	152.4	81%	0.813	77%	0.769	S	S	*	*			trans	-87.7	151.1	157.7	-55.9	-62.5	0	0	0	108.7
775	D	35.1	Very low	32.7	Very low	127 Å²	127	148.8 Å²	148.8	68%	0.679	77%	0.765	S	S	*	*			trans	-160.8	152.2	156.7	-117.5	-42.5	0	0	0	110.9
776	H	35.7	Very low	32.4	Very low	187 Å²	187	145.2 Å²	145.2	87%	0.866	76%	0.764	S	S	*	*			trans	68.4	127.8	-177.3	-35.4	-46.1	0	0	0	116
777	G	32	Very low	32.2	Very low	71 Å²	71	141 Å²	141	73%	0.732	76%	0.758	S	S	*	*			cis	178.9	177.4	-5.4	0	0	0	0	0	113.5
778	L	32.3	Very low	32	Very low	165 Å²	165	142.4 Å²	142.4	86%	0.864	76%	0.761	S	S	*	*			trans	71.1	103.7	174.1	-88.8	71.5	0	0	0	119.6
779	S	33.2	Very low	31.9	Very low	94 Å²	94	138.7 Å²	138.7	66%	0.657	76%	0.758	S	S	*	*				38.5	139	114.9	65.4	0	0	0	0	121.2
780	T	33.5	Very low	31.6	Very low	115 Å²	115	138.2 Å²	138.2	71%	0.706	75%	0.753	S	S	*	*			cis	-172.5	152.5	1.9	14.8	0	0	0	0	110.7
781	H	34.1	Very low	31.5	Very low	154 Å²	154	136.8 Å²	136.8	71%	0.713	75%	0.745	S	S	*	*			trans	65	151.1	151.1	-74.9	-12.8	0	0	0	118.5
782	K	33.2	Very low	31.5	Very low	144 Å²	144	134.6 Å²	134.6	63%	0.626	74%	0.739	S	S	*	*			cis	-160.9	149.6	-10.5	-125.5	168.2	173.6	166.7	0	110.7
783	Q	33.1	Very low	31.6	Very low	143 Å²	143	133.9 Å²	133.9	67%	0.668	74%	0.735	S	S	*	*			trans	59.1	126.6	149.5	-76.1	164.7	-87.4	0	0	118.5
784	K	32.5	Very low	31.6	Very low	186 Å²	186	130.3 Å²	130.3	81%	0.809	73%	0.729	S	S	*	*				59.9	141.6	77.3	-69.4	-166.2	176.9	-175.1	0	113.9
785	S	29.4	Very low	31.6	Very low	102 Å²	102	130.1 Å²	130.1	71%	0.713	73%	0.728	S	S	*	*			cis	-174.7	154.3	-14.2	-96.6	0	0	0	0	109.3
786	A	29.1	Very low	31.7	Very low	87 Å²	87	127.5 Å²	127.5	72%	0.719	73%	0.731	S	S	*	*			trans	63.3	125.4	147.2	0	0	0	0	0	122
787	S	28.8	Very low	31.5	Very low	102 Å²	102	125.8 Å²	125.8	71%	0.713	73%	0.727	S	S	*	*				70.9	116	125.5	71.2	0	0	0	0	123.2
788	H	28.4	Very low	31.6	Very low	186 Å²	186	126.4 Å²	126.4	86%	0.861	72%	0.72	S	S	*	*				80.5	159.7	128.1	-109.6	-94.8	0	0	0	122
789	V	29.2	Very low	31.7	Very low	114 Å²	114	125.2 Å²	125.2	69%	0.691	71%	0.714	S	S	*	*			trans	80.7	92.9	167.1	-177.3	0	0	0	0	118.8
790	T	27.8	Very low	31.6	Very low	118 Å²	118	128.8 Å²	128.8	72%	0.724	72%	0.72	S	S	*	*				49.2	155.1	119.8	-16.2	0	0	0	0	124.2
791	T	29.2	Very low	31.3	Very low	104 Å²	104	128 Å²	128	64%	0.638	72%	0.72	S	S	*	*			trans	77.7	104.2	152.3	38.4	0	0	0	0	120.8
792	D	29	Very low	31.1	Very low	133 Å²	133	125.2 Å²	125.2	71%	0.711	72%	0.718	S	S	*	*				95.5	117.1	112.2	-69.8	7.2	0	0	0	124.8
793	I	33.1	Very low	31	Very low	142 Å²	142	126.2 Å²	126.2	73%	0.728	73%	0.725	S	S	*	*				99.5	141.7	123.8	-72.4	170.9	0	0	0	121.3
794	T	32.1	Very low	30.9	Very low	110 Å²	110	127.9 Å²	127.9	68%	0.675	73%	0.73	S	S	*	*			trans	74.8	105	167.6	36.3	0	0	0	0	122.1
795	D	32.3	Very low	30.7	Very low	148 Å²	148	128.1 Å²	128.1	79%	0.791	73%	0.73	S	S	*	*				75.4	136.8	121.3	-61.1	1.4	0	0	0	123.8
796	G	36.7	Very low	30.8	Very low	73 Å²	73	129.7 Å²	129.7	75%	0.753	73%	0.729	S	S	*	*			trans	173.6	17.8	-177	0	0	0	0	0	118.3
797	I	33.5	Very low	30.7	Very low	151 Å²	151	132.4 Å²	132.4	77%	0.774	73%	0.732	S	S	*	*			trans	17.6	128	147.6	-70.3	170.5	0	0	0	117.7
798	S	33.6	Very low	30.9	Very low	84 Å²	84	136 Å²	136	59%	0.587	74%	0.738	S	S	*	*			cis	-175.6	-168.7	6.3	56.8	0	0	0	0	113.8
799	N	34.6	Very low	30.9	Very low	139 Å²	139	132.4 Å²	132.4	74%	0.743	73%	0.733	S	S	*	*			trans	79.7	84.7	160.3	-59.5	-22.3	0	0	0	117.5
800	H	31.3	Very low	30.9	Very low	169 Å²	169	133 Å²	133	78%	0.782	74%	0.739	S	S	*	*				63.7	112.5	74.9	-79.9	-86.8	0	0	0	117.1
801	S	27.3	Very low	30.9	Very low	100 Å²	100	136.1 Å²	136.1	70%	0.699	75%	0.751	S	S	*	*				62.8	146.3	116.6	127.8	0	0	0	0	119.3
802	S	28.4	Very low	31	Very low	95 Å²	95	140.1 Å²	140.1	66%	0.664	76%	0.759	S	S	*	*			cis	-163.2	-171.6	8.9	-93.4	0	0	0	0	109.4
803	Q	31.3	Very low	31	Very low	165 Å²	165	143.6 Å²	143.6	77%	0.771	77%	0.768	S	S	*	*			trans	83.9	114.7	151.9	-61.8	-154.7	27.9	0	0	119.9
804	K	31.4	Very low	30.8	Very low	178 Å²	178	141 Å²	141	77%	0.774	76%	0.759	S	S	*	*				88.1	86.4	115.4	-164.7	179.6	-173.7	-179.9	0	119.9
805	K	28.4	Very low	30.7	Very low	190 Å²	190	143.5 Å²	143.5	83%	0.826	77%	0.766	S	S	*	*				55.7	135.8	111.5	-126.4	-174.8	-173.6	-177.8	0	120
806	I	31.5	Very low	30.6	Very low	135 Å²	135	141.7 Å²	141.7	69%	0.692	77%	0.765	S	S	*	*			trans	98	109	154.8	-57	166.9	0	0	0	116.7
807	N	27.1	Very low	30.3	Very low	145 Å²	145	143.5 Å²	143.5	78%	0.775	76%	0.764	S	S	*	*			trans	37.6	135.2	139.7	-46.7	-6.9	0	0	0	119.1
808	Q	32.1	Very low	29.9	Very low	178 Å²	178	141.5 Å²	141.5	83%	0.832	76%	0.764	S	S	*	*				-156.3	170.1	54.1	-73	179.3	-2.9	0	0	114.6
809	S	28.9	Very low	29.5	Very low	110 Å²	110	141.9 Å²	141.9	77%	0.769	77%	0.772	S	S	*	*			trans	75.3	123.6	156.4	-60.9	0	0	0	0	119.4
810	P	29.4	Very low	29.2	Very low	126 Å²	126	140.4 Å²	140.4	82%	0.818	77%	0.772	S	S	*	*			trans	-100.5	127.6	-175.1	36.4	-31.5	0	0	0	114.1
811	L	28.3	Very low	29.1	Very low	183 Å²	183	138.1 Å²	138.1	96%	0.958	77%	0.77	S	S	*	*			trans	-155.8	80.5	167	-109.9	148.2	0	0	0	110.1
812	K	30	Very low	29.2	Very low	189 Å²	189	140.3 Å²	140.3	82%	0.822	77%	0.774	S	S	*	*			trans	-121.9	102.1	-178.5	-156.5	174.8	-173.9	179.5	0	113.3	T814	K812-T814 WeakPolarHBondContact CE-OG1 3.42Å; K812-T814 PolarHBondContact O-N 3.21Å
813	K	29.1	Very low	29.3	Very low	206 Å²	206	142.9 Å²	142.9	90%	0.896	78%	0.78	S	S	*	*			trans	-70.4	112.9	158.3	-70.7	176.3	176.5	176.7	0	109
814	T	28.5	Very low	29.4	Very low	88 Å²	88	143.4 Å²	143.4	54%	0.54	79%	0.787	S	S	.	*			trans	-155.9	97.4	161	-42.7	0	0	0	0	105	K812	K812-T814 WeakPolarHBondContact CE-OG1 3.42Å; K812-T814 PolarHBondContact O-N 3.21Å
815	I	30.1	Very low	29.5	Very low	161 Å²	161	140.9 Å²	140.9	83%	0.826	78%	0.781	S	S	*	*				54.6	95.6	84.7	-56.5	175.5	0	0	0	109.9
816	S	30	Very low	29.6	Very low	110 Å²	110	137.3 Å²	137.3	77%	0.769	78%	0.776	S	S	*	*			trans	-134.5	151.5	170.3	-67	0	0	0	0	108.4
817	P	30.5	Very low	29.8	Very low	112 Å²	112	142.2 Å²	142.2	73%	0.727	79%	0.788	S	S	*	*			trans	-102.6	165.7	-152.1	40	-37.9	0	0	0	114.9
818	S	25.3	Very low	30	Very low	109 Å²	109	140.9 Å²	140.9	76%	0.762	78%	0.781	S	S	*	*			trans	38	127.5	143.6	64.4	0	0	0	0	121.3
819	A	26.2	Very low	30.1	Very low	92 Å²	92	144 Å²	144	76%	0.76	79%	0.785	S	S	*	*			trans	101.4	133.5	143.1	0	0	0	0	0	119.8
820	S	27.5	Very low	30.2	Very low	108 Å²	108	146.9 Å²	146.9	76%	0.755	78%	0.784	S	S	*	*			trans	79.7	129.7	155.1	71.6	0	0	0	0	121
821	T	30	Very low	30.5	Very low	121 Å²	121	146.3 Å²	146.3	74%	0.742	78%	0.783	S	S	*	*			trans	83.7	135.9	156.2	-10.4	0	0	0	0	118.8
822	D	28.7	Very low	30.6	Very low	146 Å²	146	147.6 Å²	147.6	78%	0.781	78%	0.781	S	S	*	*			trans	59.4	103.8	165.1	-57.7	-30.2	0	0	0	120.3
823	D	30.1	Very low	30.7	Very low	148 Å²	148	143.4 Å²	143.4	79%	0.791	77%	0.771	S	S	*	*			trans	-163.3	102.1	136.8	-109.5	-26.4	0	0	0	111	I825	D823-I825 PolarHBondContact O-N 2.91Å
824	I	33.5	Very low	30.7	Very low	176 Å²	176	139.2 Å²	139.2	90%	0.903	77%	0.768	S	S	*	*			trans	-90.9	94.6	164.1	-63.5	-177.1	0	0	0	107.5
825	I	35.1	Very low	30.8	Very low	126 Å²	126	143.1 Å²	143.1	65%	0.646	77%	0.774	S	S	*	*			trans	-57.1	133.7	-172.5	-65.6	162.3	0	0	0	111.5	D823 Y827	D823-I825 PolarHBondContact O-N 2.91Å; I825-Y827 PolarHBondContact O-N 3.45Å
826	P	30.6	Very low	30.9	Very low	114 Å²	114	144.6 Å²	144.6	74%	0.74	78%	0.775	S	S	*	*			trans	-68.1	129.2	166.6	29.6	-32.8	0	0	0	109.3	D828	P826-D828 PolarHBondContact O-N 3.48Å
827	Y	34.6	Very low	30.9	Very low	238 Å²	238	145.1 Å²	145.1	93%	0.933	77%	0.765	S	S	*	*			trans	-43.5	109.2	-176.6	-93.8	-101.8	0	0	0	113	I825	I825-Y827 PolarHBondContact O-N 3.45Å
828	D	32.3	Very low	30.7	Very low	117 Å²	117	145.8 Å²	145.8	63%	0.626	77%	0.767	S	S	*	*			trans	-72.4	141.6	173.3	-169.8	15.3	0	0	0	109.8	P826 K830	P826-D828 PolarHBondContact O-N 3.48Å; D828-K830 PolarHBondContact O-N 2.91Å
829	R	34.3	Very low	31	Very low	244 Å²	244	149.1 Å²	149.1	92%	0.921	76%	0.763	S	S	*	*	S	Bend	trans	-86.9	46.9	-163.8	-161.1	-180	-177.8	-173.1	0.4	111.5
830	K	31.2	Very low	31.3	Very low	170 Å²	170	152.1 Å²	152.1	74%	0.739	76%	0.764	S	S	*	*			trans	-145.5	52.1	-168.4	-65.4	-175.9	-177.8	169.1	0	114.7	D828	D828-K830 PolarHBondContact O-N 2.91Å
831	S	33.9	Very low	31.5	Very low	115 Å²	115	152.1 Å²	152.1	80%	0.804	76%	0.764	S	S	*	*	S	Bend	trans	-96.2	131.2	148.8	46.6	0	0	0	0	108.3	T833	S831-T833 PolarHBondContact O-N 3.08Å
832	F	30.6	Very low	31.6	Very low	210 Å²	210	155.6 Å²	155.6	92%	0.921	77%	0.772	S	S	*	*			trans	-69.2	119.7	-174.3	-114.6	-108.1	0	0	0	110.6	S834	F832-S834 PolarHBondContact O-N 3.21Å
833	T	32.9	Very low	31.8	Very low	100 Å²	100	153.1 Å²	153.1	61%	0.613	77%	0.766	S	S	*	*			trans	-66.1	115.3	156.1	34.9	0	0	0	0	108	S831 Y835	S831-T833 PolarHBondContact O-N 3.08Å; T833-Y835 HydrophobicContact CG2-CD2 4.3Å; T833-Y835 HydrophobicContact CG2-CE2 4.12Å; T833-Y835 PolarHBondContact O-N 3.49Å
834	S	28.7	Very low	31.9	Very low	119 Å²	119	155.1 Å²	155.1	83%	0.832	77%	0.771	S	S	*	*			trans	-74	64.2	165.9	-166.3	0	0	0	0	109.7	F832 K836	F832-S834 PolarHBondContact O-N 3.21Å; S834-K836 PolarHBondContact O-N 2.92Å; S834-K836 VanDerWaalsContact O-N 3.1Å
835	Y	31.8	Very low	31.6	Very low	169 Å²	169	152.1 Å²	152.1	66%	0.663	77%	0.765	S	S	*	*			trans	-68.9	102.6	158.2	-83.2	-69.1	0	0	0	106.6	T833 E837	T833-Y835 HydrophobicContact CG2-CD2 4.3Å; T833-Y835 HydrophobicContact CG2-CE2 4.12Å; T833-Y835 PolarHBondContact O-N 3.49Å; Y835-E837 PolarHBondContact O-N 2.99Å
836	K	30.9	Very low	31.5	Very low	193 Å²	193	156.4 Å²	156.4	84%	0.839	78%	0.775	S	S	*	*			trans	-71.1	70.7	163.5	-165.8	173.2	-174.3	175.8	0	107.9	S834 V838	S834-K836 PolarHBondContact O-N 2.92Å; S834-K836 VanDerWaalsContact O-N 3.1Å; K836-V838 PolarHBondContact O-N 3.19Å
837	E	29.8	Very low	31.6	Very low	121 Å²	121	159.2 Å²	159.2	57%	0.565	78%	0.778	S	S	*	*			trans	-63.4	100.1	-179.5	-167	-170.5	153.8	0	0	108.1	Y835 R839	Y835-E837 PolarHBondContact O-N 2.99Å; E837-R839 HydrophobicContact CG-CG 3.96Å; E837-R839 PolarHBondContact O-N 3.43Å; E837-R839 WeakPolarHBondContact OE1-CG 3.27Å; E837-R839 IonicContact OE1-CZ 3.48Å; E837-R839 IonicContact OE1-NE 2.73Å; E837-R839 PolarHBondContact OE1-NE 3.34Å; E837-R839 IonicContact OE1-NH2 3.36Å; E837-R839 PolarHBondContact OE1-NH2 2.99Å; E837-R839 IonicContact OE2-CZ 3.42Å; E837-R839 IonicContact OE2-NE 3.38Å; E837-R839 PolarHBondContact OE2-NE 3.26Å; E837-R839 IonicContact OE2-NH2 2.71Å; E837-R839 PolarHBondContact OE2-NH2 2.93Å
838	V	27.9	Very low	31.5	Very low	126 Å²	126	153.5 Å²	153.5	76%	0.764	77%	0.77	S	S	*	*			trans	-73.4	76	177.2	-175.7	0	0	0	0	108.2	K836 I840	K836-V838 PolarHBondContact O-N 3.19Å; V838-I840 PolarHBondContact O-N 3.48Å
839	R	29.8	Very low	31.5	Very low	179 Å²	179	156.1 Å²	156.1	68%	0.675	78%	0.784	S	S	*	*			trans	-67.9	102	170.7	-68	-170.1	-172.9	142.7	15.3	108.7	E837 S841	E837-R839 HydrophobicContact CG-CG 3.96Å; E837-R839 PolarHBondContact O-N 3.43Å; E837-R839 WeakPolarHBondContact OE1-CG 3.27Å; E837-R839 IonicContact OE1-CZ 3.48Å; E837-R839 IonicContact OE1-NE 2.73Å; E837-R839 PolarHBondContact OE1-NE 3.34Å; E837-R839 IonicContact OE1-NH2 3.36Å; E837-R839 PolarHBondContact OE1-NH2 2.99Å; E837-R839 IonicContact OE2-CZ 3.42Å; E837-R839 IonicContact OE2-NE 3.38Å; E837-R839 PolarHBondContact OE2-NE 3.26Å; E837-R839 IonicContact OE2-NH2 2.71Å; E837-R839 PolarHBondContact OE2-NH2 2.93Å; R839-S841 PolarHBondContact O-N 3.31Å; R839-S841 VanDerWaalsContact O-N 3.17Å; R839-S841 PolarHBondContact O-OG 2.87Å
840	I	33.1	Very low	31.3	Very low	154 Å²	154	147.4 Å²	147.4	79%	0.79	77%	0.77	S	S	*	*			trans	-52	122.2	160.7	-63.6	174.5	0	0	0	106.7	V838 E842	V838-I840 PolarHBondContact O-N 3.48Å; I840-E842 VanDerWaalsContact C-N 3.27Å; I840-E842 PolarHBondContact O-N 3.15Å
841	S	32.7	Very low	31.4	Very low	108 Å²	108	147.1 Å²	147.1	76%	0.755	78%	0.775	S	S	*	*			trans	-83.7	70.4	-168	-59.7	0	0	0	0	110.9	R839 S843	R839-S841 PolarHBondContact O-N 3.31Å; R839-S841 VanDerWaalsContact O-N 3.17Å; R839-S841 PolarHBondContact O-OG 2.87Å; S841-S843 VanDerWaalsContact C-N 3.34Å; S841-S843 PolarHBondContact O-N 3.47Å
842	E	30.8	Very low	31.3	Very low	194 Å²	194	150.8 Å²	150.8	91%	0.907	78%	0.777	S	S	*	*			trans	-80	83.2	176.9	-165.3	165.2	-122.3	0	0	110.1	I840	I840-E842 VanDerWaalsContact C-N 3.27Å; I840-E842 PolarHBondContact O-N 3.15Å
843	S	33.2	Very low	31.5	Very low	95 Å²	95	151 Å²	151	66%	0.664	78%	0.777	S	S	*	*			trans	-136.6	81	-174.9	63.9	0	0	0	0	113.1	S841	S841-S843 VanDerWaalsContact C-N 3.34Å; S841-S843 PolarHBondContact O-N 3.47Å
844	Q	32.9	Very low	31.4	Very low	189 Å²	189	151.2 Å²	151.2	88%	0.883	78%	0.783	S	S	*	*			trans	-172.9	116.3	139	-105.8	166	19.2	0	0	111.4
845	S	26.6	Very low	31.6	Very low	113 Å²	113	152.3 Å²	152.3	79%	0.79	78%	0.784	S	S	*	*			trans	-96.5	117.1	165.6	56.5	0	0	0	0	109.7
846	Y	33.8	Very low	31.6	Very low	216 Å²	216	149.6 Å²	149.6	85%	0.847	79%	0.785	S	S	*	*			trans	-139.3	163.2	162.2	-99.8	-76.4	0	0	0	111
847	E	32.9	Very low	31.8	Very low	174 Å²	174	148.4 Å²	148.4	81%	0.813	79%	0.787	S	S	*	*			trans	-74.1	150.8	-150.6	-65.2	-169.1	109.9	0	0	116.5
848	P	30.7	Very low	31.9	Very low	117 Å²	117	147 Å²	147	76%	0.76	79%	0.79	S	S	*	*			trans	-85.7	131.2	172.7	34	-32.5	0	0	0	112.2
849	N	32.7	Very low	32.3	Very low	172 Å²	172	147 Å²	147	92%	0.92	79%	0.786	S	S	*	*			trans	-155.8	146.7	162.5	-114.7	-40	0	0	0	112.4
850	G	31.2	Very low	32.7	Very low	61 Å²	61	144.4 Å²	144.4	63%	0.629	79%	0.786	S	S	*	*			trans	112.4	77.8	157.2	0	0	0	0	0	120
851	I	33.3	Very low	32.9	Very low	164 Å²	164	143.9 Å²	143.9	84%	0.841	78%	0.783	S	S	*	*			trans	63	94.2	131.2	-54.9	157.7	0	0	0	119.2
852	K	30.9	Very low	33	Very low	193 Å²	193	145.5 Å²	145.5	84%	0.839	78%	0.784	S	S	*	*				10.9	136.3	129.2	-55.2	170.5	-178.8	173.9	0	119
853	K	34.2	Very low	33.3	Very low	214 Å²	214	144.1 Å²	144.1	93%	0.93	78%	0.78	S	S	*	*				-159.2	166.9	113.2	-108.5	161.6	-173.4	177	0	112.5
854	S	32.2	Very low	33.3	Very low	104 Å²	104	147.5 Å²	147.5	73%	0.727	79%	0.786	S	S	*	*			trans	-122.2	165.3	-167.2	53.1	0	0	0	0	111.7
855	V	33.2	Very low	33.4	Very low	142 Å²	142	147.6 Å²	147.6	86%	0.861	79%	0.786	S	S	*	*				-161.8	153.1	125.2	133	0	0	0	0	110.8
856	T	31	Very low	33.6	Very low	113 Å²	113	147.9 Å²	147.9	69%	0.693	79%	0.788	S	S	*	*			trans	-105.5	161.2	-176.4	-23.9	0	0	0	0	110.6
857	L	34.5	Very low	33.8	Very low	167 Å²	167	143 Å²	143	87%	0.874	78%	0.783	S	S	*	*				-169	170.8	123.8	-103.5	160.2	0	0	0	112.2
858	S	32.5	Very low	33.9	Very low	91 Å²	91	144.3 Å²	144.3	64%	0.636	79%	0.789	S	S	*	*			trans	-131.4	169.7	-162.7	-60	0	0	0	0	111.2
859	N	36.9	Very low	33.9	Very low	127 Å²	127	146.2 Å²	146.2	68%	0.679	79%	0.792	S	S	*	*				167.9	126.2	116.4	-89.1	26.6	0	0	0	115.6
860	D	37.7	Very low	34	Very low	125 Å²	125	144.6 Å²	144.6	67%	0.668	79%	0.788	S	S	*	*				80.7	149.3	121.7	-54.9	-11.8	0	0	0	126.5
861	I	37.8	Very low	34.1	Very low	143 Å²	143	147 Å²	147	73%	0.733	79%	0.79	S	S	*	*			trans	83.7	81.3	158.3	-60	135.3	0	0	0	118.9
862	N	33.4	Very low	34.1	Very low	142 Å²	142	150.6 Å²	150.6	76%	0.759	79%	0.793	S	S	*	*				23.9	138.7	112.6	-49.9	-19.9	0	0	0	120.2
863	I	36.9	Very low	34.2	Very low	164 Å²	164	149.5 Å²	149.5	84%	0.841	79%	0.791	S	S	*	*				-169.2	159.8	101.8	-95.7	162.1	0	0	0	110.9
864	E	33.9	Very low	34.2	Very low	166 Å²	166	145.8 Å²	145.8	78%	0.776	79%	0.786	S	S	*	*			trans	-80.4	159.9	-169.6	-47.9	163.9	115.1	0	0	114.4
865	Q	35.2	Very low	34.2	Very low	192 Å²	192	146.7 Å²	146.7	90%	0.897	79%	0.788	S	S	*	*				-176.4	168.4	103.8	-96	-178.9	15.3	0	0	113.9
866	S	30.2	Very low	34.3	Very low	118 Å²	118	146.2 Å²	146.2	83%	0.825	79%	0.785	S	S	*	*			trans	-96.1	161	-163	-138.5	0	0	0	0	113.7
867	P	37.3	Very low	34.6	Very low	115 Å²	115	147 Å²	147	75%	0.747	79%	0.79	S	S	*	*			trans	-91.5	153.3	-166.9	35.7	-34.7	0	0	0	115
868	Q	36.1	Very low	34.6	Very low	201 Å²	201	144.8 Å²	144.8	94%	0.939	79%	0.785	S	S	*	*			trans	-137	160.3	159	-82.1	-158.3	-3.9	0	0	112.8
869	I	30.2	Very low	34.7	Very low	157 Å²	157	145.4 Å²	145.4	81%	0.805	79%	0.789	S	S	*	*			trans	-92	137.7	-168.6	-61.1	158.3	0	0	0	110.9
870	T	35.7	Very low	34.4	Very low	137 Å²	137	144.7 Å²	144.7	84%	0.84	80%	0.795	S	S	*	*			trans	-157.4	130.5	146.6	-76.1	0	0	0	0	110.3
871	T	32	Very low	34.2	Very low	111 Å²	111	142 Å²	142	68%	0.681	80%	0.796	S	S	*	*			trans	-90	141.2	-179.7	22.9	0	0	0	0	113
872	R	33.2	Very low	34.1	Very low	241 Å²	241	143.1 Å²	143.1	91%	0.909	80%	0.802	S	S	*	*			trans	-136.1	112.4	154.3	-81.1	-171.7	171.6	172.1	-1.3	109.8
873	H	33.6	Very low	34	Very low	170 Å²	170	143.7 Å²	143.7	79%	0.787	80%	0.804	S	S	*	*			trans	-78	143.5	169.2	-75.6	-88.7	0	0	0	110.5
874	T	34.7	Very low	33.7	Very low	135 Å²	135	144.8 Å²	144.8	83%	0.828	80%	0.803	S	S	*	*			trans	-142.4	124	157.7	-61.6	0	0	0	0	107.5
875	T	32.5	Very low	33.5	Very low	124 Å²	124	141 Å²	141	76%	0.761	79%	0.791	S	S	*	*			trans	-91.1	122.8	-165.8	-50.3	0	0	0	0	111.7
876	T	34.8	Very low	33.4	Very low	131 Å²	131	135.9 Å²	135.9	80%	0.804	78%	0.776	S	S	*	*			trans	-109.7	129.2	165.1	47.9	0	0	0	0	110.2
877	V	37.4	Very low	33.7	Very low	130 Å²	130	133.7 Å²	133.7	79%	0.788	76%	0.757	S	S	*	*			trans	-84.8	128.2	-174.7	-177.5	0	0	0	0	110.3	S879	V877-S879 PolarHBondContact O-N 2.87Å
878	P	33.8	Very low	33.5	Very low	120 Å²	120	136.2 Å²	136.2	78%	0.779	76%	0.759	S	S	*	*			trans	-74.3	115.7	178.5	29.1	-33.6	0	0	0	111.3	S880	P878-S880 PolarHBondContact O-N 2.97Å
879	S	35.2	Very low	33.9	Very low	104 Å²	104	130.3 Å²	130.3	73%	0.727	73%	0.733	S	S	*	*			trans	-76.4	111.2	178	54.1	0	0	0	0	112.2	V877 G881	V877-S879 PolarHBondContact O-N 2.87Å; S879-G881 PolarHBondContact O-N 3.49Å
880	S	31.4	Very low	34.4	Very low	113 Å²	113	124.3 Å²	124.3	79%	0.79	71%	0.71	S	S	*	*			trans	44.6	47.8	149.2	58.9	0	0	0	0	117.5	P878 I882	P878-S880 PolarHBondContact O-N 2.97Å; S880-I882 PolarHBondContact O-N 3.43Å
881	G	33.2	Very low	35.4	Very low	68 Å²	68	126 Å²	126	70%	0.701	71%	0.709	S	S	*	*			trans	-68.9	115	172.3	0	0	0	0	0	112	S879 L883	S879-G881 PolarHBondContact O-N 3.49Å; G881-L883 PolarHBondContact O-N 2.97Å
882	I	34.8	Very low	36.1	Very low	166 Å²	166	124.6 Å²	124.6	85%	0.851	70%	0.704	S	S	*	*			trans	-69.6	98.8	170.2	-63.1	174.9	0	0	0	107.8	S880 K884	S880-I882 PolarHBondContact O-N 3.43Å; I882-K884 VanDerWaalsContact C-N 3.3Å; I882-K884 PolarHBondContact O-N 3.29Å
883	L	31.1	Very low	36.9	Very low	154 Å²	154	117.5 Å²	117.5	81%	0.806	68%	0.681	S	S	*	*			trans	-66.9	85.8	-179.4	-106	164.9	0	0	0	111.2	G881 V885	G881-L883 PolarHBondContact O-N 2.97Å; L883-V885 HydrophobicContact CB-CG2 4.27Å; L883-V885 HydrophobicContact CD2-CG2 3.96Å; L883-V885 PolarHBondContact O-N 2.84Å
884	K	30.3	Very low	37.9	Very low	188 Å²	188	113.6 Å²	113.6	82%	0.817	67%	0.665	S	S	*	*			trans	-72.1	68	174.4	-171	-173.8	177.6	-172.3	0	109.8	I882 S886	I882-K884 VanDerWaalsContact C-N 3.3Å; I882-K884 PolarHBondContact O-N 3.29Å; K884-S886 VanDerWaalsContact C-N 3.26Å; K884-S886 PolarHBondContact O-N 3.45Å
885	V	31.4	Very low	38.7	Very low	87 Å²	87	113.1 Å²	113.1	53%	0.527	65%	0.653	S	S	.	*			trans	-72.3	81.4	179.5	-174.2	0	0	0	0	110	L883 V887	L883-V885 HydrophobicContact CB-CG2 4.27Å; L883-V885 HydrophobicContact CD2-CG2 3.96Å; L883-V885 PolarHBondContact O-N 2.84Å; V885-V887 HydrophobicContact CG1-CG2 4.09Å; V885-V887 PolarHBondContact O-N 3Å; V885-V887 VanDerWaalsContact O-N 3.08Å
886	S	32.9	Very low	39.7	Very low	84 Å²	84	114.3 Å²	114.3	59%	0.587	65%	0.65	S	S	*	*			trans	-67	96	165.4	46.1	0	0	0	0	109.3	K884 H888	K884-S886 VanDerWaalsContact C-N 3.26Å; K884-S886 PolarHBondContact O-N 3.45Å; S886-H888 PolarHBondContact O-N 3.48Å; S886-H888 VanDerWaalsContact O-N 3.15Å
887	V	37.1	Very low	40.7	Very low	71 Å²	71	113.3 Å²	113.3	43%	0.43	64%	0.635	S	S	.	*			trans	-76.6	96.6	165.6	-172.9	0	0	0	0	106.7	V885 L889	V885-V887 HydrophobicContact CG1-CG2 4.09Å; V885-V887 PolarHBondContact O-N 3Å; V885-V887 VanDerWaalsContact O-N 3.08Å; V887-L889 HydrophobicContact CG1-CD1 3.98Å; V887-L889 PolarHBondContact O-N 3.14Å
888	H	32	Very low	41.5	Very low	169 Å²	169	108.1 Å²	108.1	78%	0.782	61%	0.606	S	S	*	*			trans	-66.5	109.2	160	-80.1	-91.5	0	0	0	107.1	S886	S886-H888 PolarHBondContact O-N 3.48Å; S886-H888 VanDerWaalsContact O-N 3.15Å
889	L	44.9	Very low	42.6	Very low	76 Å²	76	109.3 Å²	109.3	40%	0.398	60%	0.601	S	S	.	*			trans	-75.1	142.4	157.3	-76.8	84.2	0	0	0	107.4	V887 E893 I894 F897	V887-L889 HydrophobicContact CG1-CD1 3.98Å; V887-L889 PolarHBondContact O-N 3.14Å; L889-E893 WeakPolarHBondContact CA-OE2 3.27Å; L889-E893 WeakPolarHBondContact CB-OE2 3.26Å; L889-I894 HydrophobicContact CB-CD1 4.47Å; L889-I894 HydrophobicContact CB-CG1 4.21Å; L889-F897 HydrophobicContact CD2-CD2 4.44Å; L889-F897 HydrophobicContact CD2-CE2 4.09Å
890	G	40.8	Very low	43.7	Very low	31 Å²	31	109.6 Å²	109.6	32%	0.32	59%	0.587	S	S	.	*			trans	-68.6	151.3	175.5	0	0	0	0	0	111.4	S892 E893 I894	G890-S892 PolarHBondContact O-N 3.36Å; G890-E893 PolarHBondContact N-OE2 3.41Å; G890-E893 WeakPolarHBondContact O-CB 3.35Å; G890-E893 PolarHBondContact O-N 3.35Å; G890-I894 WeakPolarHBondContact O-CG1 3.48Å; G890-I894 PolarHBondContact O-N 3.2Å
891	E	56.9	Low	45.1	Very low	172 Å²	172	106 Å²	106	80%	0.804	56%	0.556	S	S	*	*	H	α-helix	trans	-57.8	-34.2	173	-63.5	-177.8	152	0	0	111.3	I894 Q895	E891-I894 PolarHBondContact O-N 3.32Å; E891-Q895 WeakPolarHBondContact O-CB 3.48Å; E891-Q895 PolarHBondContact O-N 2.81Å
892	S	45.1	Very low	46.5	Very low	83 Å²	83	106.6 Å²	106.6	58%	0.58	54%	0.543	S	S	*	.	H	α-helix	trans	-60.8	-44.6	170.8	50.5	0	0	0	0	113.5	G890 Q895 E896	G890-S892 PolarHBondContact O-N 3.36Å; S892-Q895 PolarHBondContact O-N 3.19Å; S892-E896 PolarHBondContact O-N 2.94Å
893	E	51.2	Low	48	Very low	91 Å²	91	102.9 Å²	102.9	43%	0.425	52%	0.522	S	S	.	.	H	α-helix	trans	-63.8	-43.3	175.5	-62.5	-176.2	130.1	0	0	110.6	L889 G890 Q895 E896 F897	L889-E893 WeakPolarHBondContact CA-OE2 3.27Å; L889-E893 WeakPolarHBondContact CB-OE2 3.26Å; G890-E893 PolarHBondContact N-OE2 3.41Å; G890-E893 WeakPolarHBondContact O-CB 3.35Å; G890-E893 PolarHBondContact O-N 3.35Å; E893-Q895 PolarHBondContact O-N 3.27Å; E893-E896 PolarHBondContact O-N 3.21Å; E893-F897 WeakPolarHBondContact O-CB 3.24Å; E893-F897 WeakPolarHBondContact O-CD2 3.3Å; E893-F897 PolarHBondContact O-N 2.96Å
894	I	55	Low	50	Low	89 Å²	89	100.1 Å²	100.1	46%	0.456	52%	0.515	S	S	.	.	H	α-helix	trans	-61.1	-36.8	176.9	-64.3	169.5	0	0	0	110.5	L889 G890 E891 A898	L889-I894 HydrophobicContact CB-CD1 4.47Å; L889-I894 HydrophobicContact CB-CG1 4.21Å; G890-I894 WeakPolarHBondContact O-CG1 3.48Å; G890-I894 PolarHBondContact O-N 3.2Å; E891-I894 PolarHBondContact O-N 3.32Å; I894-A898 WeakPolarHBondContact O-CB 3.43Å; I894-A898 PolarHBondContact O-N 3.04Å
895	Q	51.5	Low	51.9	Low	124 Å²	124	95.1 Å²	95.1	58%	0.579	50%	0.497	S	S	*	.	H	α-helix	trans	-75.3	-38.6	178.3	-166.6	165.5	13.8	0	0	113.2	E891 S892 E893 F897 A898 E899	E891-Q895 WeakPolarHBondContact O-CB 3.48Å; E891-Q895 PolarHBondContact O-N 2.81Å; S892-Q895 PolarHBondContact O-N 3.19Å; E893-Q895 PolarHBondContact O-N 3.27Å; Q895-F897 VanDerWaalsContact C-N 3.35Å; Q895-A898 WeakPolarHBondContact O-CB 3.47Å; Q895-A898 PolarHBondContact O-N 2.97Å; Q895-E899 PolarHBondContact O-N 2.87Å
896	E	52.3	Low	54.1	Low	149 Å²	149	92.1 Å²	92.1	70%	0.696	48%	0.477	S	S	*	.	H	α-helix	trans	-63.3	-40.8	170	-74.5	-168.6	171.1	0	0	111.5	S892 E893 A898 E899 Y900	S892-E896 PolarHBondContact O-N 2.94Å; E893-E896 PolarHBondContact O-N 3.21Å; E896-A898 VanDerWaalsContact C-N 3.34Å; E896-E899 PolarHBondContact O-N 3.5Å; E896-Y900 PolarHBondContact O-N 2.87Å; E896-Y900 VanDerWaalsContact O-N 3.1Å
897	F	55.9	Low	56.3	Low	110 Å²	110	89.7 Å²	89.7	48%	0.482	46%	0.46	S	S	.	.	H	α-helix	trans	-62.7	-40.2	171.5	-79.2	-59	0	0	0	111.7	L889 E893 Q895 Y900 W901	L889-F897 HydrophobicContact CD2-CD2 4.44Å; L889-F897 HydrophobicContact CD2-CE2 4.09Å; E893-F897 WeakPolarHBondContact O-CB 3.24Å; E893-F897 WeakPolarHBondContact O-CD2 3.3Å; E893-F897 PolarHBondContact O-N 2.96Å; Q895-F897 VanDerWaalsContact C-N 3.35Å; F897-Y900 PolarHBondContact O-N 3.41Å; F897-W901 WeakPolarHBondContact O-CB 3.47Å; F897-W901 PolarHBondContact O-N 3.37Å
898	A	55.5	Low	58.6	Low	22 Å²	22	87.7 Å²	87.7	18%	0.182	45%	0.454	C	S	.	.	H	α-helix	trans	-60	-48.8	176.1	0	0	0	0	0	111.9	I894 Q895 E896 Y900 W901 D902 L1002	I894-A898 WeakPolarHBondContact O-CB 3.43Å; I894-A898 PolarHBondContact O-N 3.04Å; Q895-A898 WeakPolarHBondContact O-CB 3.47Å; Q895-A898 PolarHBondContact O-N 2.97Å; E896-A898 VanDerWaalsContact C-N 3.34Å; A898-Y900 VanDerWaalsContact C-N 3.28Å; A898-Y900 PolarHBondContact O-N 3Å; A898-W901 PolarHBondContact O-N 3.44Å; A898-W901 VanDerWaalsContact O-N 3.09Å; A898-D902 PolarHBondContact O-N 3.05Å; A898-L1002 HydrophobicContact CB-CD1 3.53Å
899	E	57	Low	61.2	Low	144 Å²	144	80.4 Å²	80.4	67%	0.673	42%	0.423	S	S	*	.	H	α-helix	trans	-62.5	-35.8	179.3	-171.4	172.3	-177.2	0	0	112	Q895 E896 H903	Q895-E899 PolarHBondContact O-N 2.87Å; E896-E899 PolarHBondContact O-N 3.5Å; E899-H903 PolarHBondContact O-CE1 3.27Å; E899-H903 PolarHBondContact O-N 3.36Å; E899-H903 PolarHBondContact O-ND1 3.5Å
900	Y	57.7	Low	63.3	Low	111 Å²	111	77 Å²	77	44%	0.435	40%	0.404	S	S	.	.	H	α-helix	trans	-66.3	-42.3	171.3	-177	-94.7	0	0	0	112.9	E896 F897 A898 H903 F906	E896-Y900 PolarHBondContact O-N 2.87Å; E896-Y900 VanDerWaalsContact O-N 3.1Å; F897-Y900 PolarHBondContact O-N 3.41Å; A898-Y900 VanDerWaalsContact C-N 3.28Å; A898-Y900 PolarHBondContact O-N 3Å; Y900-H903 WeakPolarHBondContact O-CB 3.46Å; Y900-H903 PolarHBondContact O-N 2.87Å; Y900-F906 HydrophobicContact CD1-CE2 4.37Å; Y900-F906 AromaticContact CE1-CE2 3.78Å; Y900-F906 HydrophobicContact CE1-CE2 3.78Å; Y900-F906 HydrophobicContact CE1-CZ 4.05Å; Y900-F906 AromaticContact CZ-CE2 3.92Å
901	W	60.2	Low	65.6	Low	36 Å²	36	79.4 Å²	79.4	14%	0.136	41%	0.409	C	S	.	.	H	α-helix	trans	-73.4	-33.4	-177.1	-78.6	125.4	0	0	0	114.2	F897 A898 H903 L1002 D1070	F897-W901 WeakPolarHBondContact O-CB 3.47Å; F897-W901 PolarHBondContact O-N 3.37Å; A898-W901 PolarHBondContact O-N 3.44Å; A898-W901 VanDerWaalsContact O-N 3.09Å; W901-H903 VanDerWaalsContact C-N 3.3Å; W901-L1002 HydrophobicContact CB-CD2 4.48Å; W901-D1070 HydrophobicContact CH2-CB 3.71Å; W901-D1070 HydrophobicContact CZ3-CB 3.66Å; W901-D1070 VanDerWaalsContact CZ3-CG 3.44Å; W901-D1070 WeakPolarHBondContact CZ3-OD1 3.38Å
902	D	62.3	Low	67.3	Low	82 Å²	82	74.6 Å²	74.6	44%	0.439	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	10	176.6	-77.2	-47.8	0	0	0	113.5	A898 S904 R1005	A898-D902 PolarHBondContact O-N 3.05Å; D902-S904 PolarHBondContact O-N 2.83Å; D902-R1005 IonicContact OD1-CZ 3.65Å; D902-R1005 IonicContact OD1-NH1 2.74Å; D902-R1005 PolarHBondContact OD1-NH1 3.36Å; D902-R1005 IonicContact OD1-NH2 2.68Å; D902-R1005 IonicContact OD2-NH1 3.67Å
903	H	67.5	Low	69.6	Low	87 Å²	87	70.6 Å²	70.6	40%	0.403	36%	0.364	S	S	.	.			trans	-49.8	129.1	163	-83.9	14.6	0	0	0	110.7	E899 Y900 W901 I905 F906 S907	E899-H903 PolarHBondContact O-CE1 3.27Å; E899-H903 PolarHBondContact O-N 3.36Å; E899-H903 PolarHBondContact O-ND1 3.5Å; Y900-H903 WeakPolarHBondContact O-CB 3.46Å; Y900-H903 PolarHBondContact O-N 2.87Å; W901-H903 VanDerWaalsContact C-N 3.3Å; H903-I905 PolarHBondContact O-N 3.06Å; H903-F906 HydrophobicContact CB-CD2 4.16Å; H903-F906 PolarHBondContact O-N 3.42Å; H903-S907 PolarHBondContact O-N 3.42Å
904	S	71.5	Confident	71.6	Confident	96 Å²	96	67.5 Å²	67.5	67%	0.671	35%	0.351	S	S	*	.	H	α-helix	trans	-59.8	-14	-170.8	57.9	0	0	0	0	115.6	D902 G908	D902-S904 PolarHBondContact O-N 2.83Å; S904-G908 WeakPolarHBondContact O-CA 3.36Å; S904-G908 PolarHBondContact O-N 3.25Å
905	I	71.3	Confident	73.5	Confident	83 Å²	83	67 Å²	67	43%	0.426	35%	0.354	S	S	.	.	H	α-helix	trans	-77	-38.9	172.8	-64.5	86.3	0	0	0	111.6	H903 A909 Y1097	H903-I905 PolarHBondContact O-N 3.06Å; I905-A909 WeakPolarHBondContact O-CB 3.29Å; I905-A909 PolarHBondContact O-N 3.36Å; I905-Y1097 WeakPolarHBondContact CD1-OH 3.44Å; I905-Y1097 HydrophobicContact CG1-CE2 4.48Å; I905-Y1097 VanDerWaalsContact CG1-OH 3.28Å; I905-Y1097 WeakPolarHBondContact CG1-OH 3.45Å; I905-Y1097 HydrophobicContact CG2-CE2 4.44Å
906	F	76.4	Confident	75.6	Confident	25 Å²	25	63.3 Å²	63.3	11%	0.11	34%	0.338	C	S	.	.	H	α-helix	trans	-72.6	-46.4	175.1	-71.8	-68.3	0	0	0	111.1	Y900 H903 G908 A909 R910 D1070 I1073	Y900-F906 HydrophobicContact CD1-CE2 4.37Å; Y900-F906 AromaticContact CE1-CE2 3.78Å; Y900-F906 HydrophobicContact CE1-CE2 3.78Å; Y900-F906 HydrophobicContact CE1-CZ 4.05Å; Y900-F906 AromaticContact CZ-CE2 3.92Å; H903-F906 HydrophobicContact CB-CD2 4.16Å; H903-F906 PolarHBondContact O-N 3.42Å; F906-G908 VanDerWaalsContact C-N 3.33Å; F906-G908 PolarHBondContact O-N 3.42Å; F906-A909 PolarHBondContact O-N 3.09Å; F906-R910 WeakPolarHBondContact O-CG 3.2Å; F906-R910 PolarHBondContact O-N 3.12Å; F906-D1070 WeakPolarHBondContact CD1-OD1 3.25Å; F906-I1073 HydrophobicContact CE1-CD1 3.84Å; F906-I1073 HydrophobicContact CZ-CD1 4.19Å
907	S	79.9	Confident	77.7	Confident	32 Å²	32	56.2 Å²	56.2	22%	0.224	31%	0.305	C	S	.	.	H	α-helix	trans	-57.9	-46.1	173.2	-172.3	0	0	0	0	111.3	H903 A909 R910 I911	H903-S907 PolarHBondContact O-N 3.42Å; S907-A909 PolarHBondContact O-N 2.93Å; S907-R910 PolarHBondContact O-N 3.47Å; S907-I911 VanDerWaalsContact O-CG1 3.28Å; S907-I911 WeakPolarHBondContact O-CG1 3.34Å; S907-I911 PolarHBondContact O-N 3.31Å
908	G	84.6	Confident	79.5	Confident	30 Å²	30	51.9 Å²	51.9	31%	0.309	29%	0.291	S	S	.	.	H	α-helix	trans	-61.8	-40	174.6	0	0	0	0	0	114.1	S904 F906 I911 T912	S904-G908 WeakPolarHBondContact O-CA 3.36Å; S904-G908 PolarHBondContact O-N 3.25Å; F906-G908 VanDerWaalsContact C-N 3.33Å; F906-G908 PolarHBondContact O-N 3.42Å; G908-I911 PolarHBondContact O-N 2.86Å; G908-T912 WeakPolarHBondContact O-CG2 3.36Å; G908-T912 PolarHBondContact O-N 3Å; G908-T912 PolarHBondContact O-OG1 2.8Å
909	A	86.8	Confident	81.5	Confident	15 Å²	15	54.4 Å²	54.4	12%	0.124	30%	0.304	C	S	.	.	H	α-helix	trans	-68	-38.5	177.7	0	0	0	0	0	112.8	I905 F906 S907 T912 A913 L1069	I905-A909 WeakPolarHBondContact O-CB 3.29Å; I905-A909 PolarHBondContact O-N 3.36Å; F906-A909 PolarHBondContact O-N 3.09Å; S907-A909 PolarHBondContact O-N 2.93Å; A909-T912 WeakPolarHBondContact CA-OG1 3.47Å; A909-T912 PolarHBondContact O-N 3.34Å; A909-T912 PolarHBondContact O-OG1 3.14Å; A909-T912 VanDerWaalsContact O-OG1 3.08Å; A909-A913 WeakPolarHBondContact O-CB 3.42Å; A909-A913 PolarHBondContact O-N 3.01Å; A909-L1069 HydrophobicContact CB-CD1 4.2Å
910	R	89.1	Confident	83.3	Confident	5 Å²	5	47.5 Å²	47.5	2%	0.019	27%	0.272	C	S	.	.	H	α-helix	trans	-66.7	-43.1	174.2	-67.3	170	-177.1	157.1	-1.6	111.1	F906 S907 A913 V914 F1009 D1070	F906-R910 WeakPolarHBondContact O-CG 3.2Å; F906-R910 PolarHBondContact O-N 3.12Å; S907-R910 PolarHBondContact O-N 3.47Å; R910-A913 WeakPolarHBondContact O-CB 3.33Å; R910-A913 PolarHBondContact O-N 2.97Å; R910-V914 WeakPolarHBondContact O-CG2 3.35Å; R910-V914 PolarHBondContact O-N 3.12Å; R910-F1009 HydrophobicContact CB-CE1 4.24Å; R910-F1009 HydrophobicContact CB-CZ 4.38Å; R910-F1009 HydrophobicContact CG-CE1 4.45Å; R910-F1009 HydrophobicContact CG-CZ 4.5Å; R910-D1070 IonicContact CZ-OD2 2.68Å; R910-D1070 IonicContact NE-OD2 3.87Å; R910-D1070 PolarHBondContact NE-OD2 3.34Å; R910-D1070 VanDerWaalsContact NE-OD2 3.17Å; R910-D1070 IonicContact NH2-OD1 3.18Å; R910-D1070 IonicContact NH2-OD2 2.88Å; R910-D1070 PolarHBondContact NH2-OD2 2.98Å
911	I	90.5	Very high	85.1	Confident	82 Å²	82	42.3 Å²	42.3	42%	0.421	25%	0.252	S	S	.	.	H	α-helix	trans	-61	-46.2	174	-66.7	165.9	0	0	0	111	S907 G908 A913 V914 C915	S907-I911 VanDerWaalsContact O-CG1 3.28Å; S907-I911 WeakPolarHBondContact O-CG1 3.34Å; S907-I911 PolarHBondContact O-N 3.31Å; G908-I911 PolarHBondContact O-N 2.86Å; I911-A913 VanDerWaalsContact C-N 3.29Å; I911-A913 PolarHBondContact O-N 3.33Å; I911-V914 PolarHBondContact O-N 2.71Å; I911-C915 PolarHBondContact O-N 3.43Å; I911-C915 PolarHBondContact O-SG 3.33Å; I911-C915 VanDerWaalsContact O-SG 3.33Å
912	T	92.4	Very high	86.8	Confident	70 Å²	70	44.7 Å²	44.7	43%	0.429	27%	0.271	S	S	.	.	H	α-helix	trans	-66.6	-31.3	176.6	55.5	0	0	0	0	112.4	G908 A909 C915 L916	G908-T912 WeakPolarHBondContact O-CG2 3.36Å; G908-T912 PolarHBondContact O-N 3Å; G908-T912 PolarHBondContact O-OG1 2.8Å; A909-T912 WeakPolarHBondContact CA-OG1 3.47Å; A909-T912 PolarHBondContact O-N 3.34Å; A909-T912 PolarHBondContact O-OG1 3.14Å; A909-T912 VanDerWaalsContact O-OG1 3.08Å; T912-C915 PolarHBondContact O-N 3.03Å; T912-L916 WeakPolarHBondContact O-CB 3.28Å; T912-L916 WeakPolarHBondContact O-CD1 3.42Å; T912-L916 WeakPolarHBondContact O-CG 3.35Å; T912-L916 PolarHBondContact O-N 2.91Å
913	A	93.3	Very high	88.4	Confident	0 Å²	0	42 Å²	42	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-63.5	-47.3	172.3	0	0	0	0	0	112.3	A909 R910 I911 C915 L916 A917 A1063 L1066 L1067	A909-A913 WeakPolarHBondContact O-CB 3.42Å; A909-A913 PolarHBondContact O-N 3.01Å; R910-A913 WeakPolarHBondContact O-CB 3.33Å; R910-A913 PolarHBondContact O-N 2.97Å; I911-A913 VanDerWaalsContact C-N 3.29Å; I911-A913 PolarHBondContact O-N 3.33Å; A913-C915 VanDerWaalsContact C-N 3.34Å; A913-C915 PolarHBondContact O-N 2.9Å; A913-L916 PolarHBondContact O-N 3.37Å; A913-A917 WeakPolarHBondContact O-CB 3.37Å; A913-A917 PolarHBondContact O-N 3.42Å; A913-A1063 WeakPolarHBondContact O-CB 3.41Å; A913-L1066 HydrophobicContact CB-CB 3.58Å; A913-L1066 HydrophobicContact CB-CD1 4.28Å; A913-L1067 HydrophobicContact CB-CD1 4.49Å; A913-L1067 HydrophobicContact CB-CD2 4Å; A913-L1067 HydrophobicContact CB-CG 3.76Å
914	V	93.8	Very high	89.6	Confident	25 Å²	25	37.9 Å²	37.9	15%	0.152	24%	0.239	C	C	.	.	H	α-helix	trans	-59	-44.4	175.3	171.5	0	0	0	0	110.9	R910 I911 A917 G918 L990 V994	R910-V914 WeakPolarHBondContact O-CG2 3.35Å; R910-V914 PolarHBondContact O-N 3.12Å; I911-V914 PolarHBondContact O-N 2.71Å; V914-A917 PolarHBondContact O-N 2.89Å; V914-G918 PolarHBondContact O-N 3.42Å; V914-L990 HydrophobicContact CG1-CD1 3.98Å; V914-V994 HydrophobicContact CG1-CG2 4.06Å
915	C	94.8	Very high	90.8	Very high	78 Å²	78	36 Å²	36	53%	0.527	22%	0.223	S	C	.	.	H	α-helix	trans	-62.5	-43.2	175.2	-67.5	0	0	0	0	112.7	I911 T912 A913 G918 V919	I911-C915 PolarHBondContact O-N 3.43Å; I911-C915 PolarHBondContact O-SG 3.33Å; I911-C915 VanDerWaalsContact O-SG 3.33Å; T912-C915 PolarHBondContact O-N 3.03Å; A913-C915 VanDerWaalsContact C-N 3.34Å; A913-C915 PolarHBondContact O-N 2.9Å; C915-G918 PolarHBondContact O-N 3.49Å; C915-V919 WeakPolarHBondContact O-CG2 3.16Å; C915-V919 PolarHBondContact O-N 3.42Å
916	L	95.4	Very high	91.9	Very high	47 Å²	47	35.5 Å²	35.5	25%	0.246	23%	0.226	C	C	.	.	H	α-helix	trans	-67	-38.5	177.9	-71.9	162.8	0	0	0	111.9	T912 A913 V919 A920 L1059 L1062 A1063 L1066	T912-L916 WeakPolarHBondContact O-CB 3.28Å; T912-L916 WeakPolarHBondContact O-CD1 3.42Å; T912-L916 WeakPolarHBondContact O-CG 3.35Å; T912-L916 PolarHBondContact O-N 2.91Å; A913-L916 PolarHBondContact O-N 3.37Å; L916-V919 PolarHBondContact O-N 3.19Å; L916-A920 VanDerWaalsContact O-CB 3.29Å; L916-A920 WeakPolarHBondContact O-CB 3.49Å; L916-A920 PolarHBondContact O-N 2.92Å; L916-L1059 HydrophobicContact CD2-CD2 3.89Å; L916-L1062 HydrophobicContact CD1-CD2 4.05Å; L916-L1062 HydrophobicContact CD1-CG 4.22Å; L916-A1063 HydrophobicContact CB-CB 4.22Å; L916-L1066 HydrophobicContact CD1-CD1 3.6Å
917	A	94.6	Very high	92.7	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-65.9	-39.6	173.7	0	0	0	0	0	112.6	A913 V914 A920 S921 L990 H1016 A1063	A913-A917 WeakPolarHBondContact O-CB 3.37Å; A913-A917 PolarHBondContact O-N 3.42Å; V914-A917 PolarHBondContact O-N 2.89Å; A917-A920 PolarHBondContact O-N 3.35Å; A917-S921 WeakPolarHBondContact O-CB 3.47Å; A917-S921 PolarHBondContact O-N 3.09Å; A917-S921 PolarHBondContact O-OG 3.34Å; A917-L990 HydrophobicContact CB-CD1 4.06Å; A917-H1016 VanDerWaalsContact CB-NE2 3.34Å; A917-H1016 WeakPolarHBondContact CB-NE2 3.41Å; A917-A1063 HydrophobicContact CB-CB 3.96Å
918	G	95.2	Very high	93.2	Very high	19 Å²	19	33.2 Å²	33.2	20%	0.196	21%	0.213	C	C	.	.	H	α-helix	trans	-61.5	-49.8	172.9	0	0	0	0	0	111.9	V914 C915 A920 S921 V922	V914-G918 PolarHBondContact O-N 3.42Å; C915-G918 PolarHBondContact O-N 3.49Å; G918-A920 VanDerWaalsContact C-N 3.34Å; G918-A920 PolarHBondContact O-N 2.87Å; G918-S921 PolarHBondContact O-N 3.28Å; G918-V922 WeakPolarHBondContact O-CG2 3.39Å; G918-V922 PolarHBondContact O-N 3.26Å
919	V	96.6	Very high	93.5	Very high	75 Å²	75	36 Å²	36	46%	0.455	23%	0.227	S	C	.	.	H	α-helix	trans	-60.1	-43.3	175.3	173.5	0	0	0	0	111.3	C915 L916 S921 V922 C923 L1059	C915-V919 WeakPolarHBondContact O-CG2 3.16Å; C915-V919 PolarHBondContact O-N 3.42Å; L916-V919 PolarHBondContact O-N 3.19Å; V919-S921 PolarHBondContact O-N 2.91Å; V919-V922 PolarHBondContact O-N 3.19Å; V919-C923 WeakPolarHBondContact O-CB 3.37Å; V919-C923 PolarHBondContact O-N 2.85Å; V919-C923 PolarHBondContact O-SG 3.29Å; V919-L1059 HydrophobicContact CB-CD1 4.44Å; V919-L1059 HydrophobicContact CG1-CD1 3.8Å
920	A	95.7	Very high	93.6	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-59.6	-47.2	177	0	0	0	0	0	112.2	L916 A917 G918 V922 C923 L924 L1059 H1060	L916-A920 VanDerWaalsContact O-CB 3.29Å; L916-A920 WeakPolarHBondContact O-CB 3.49Å; L916-A920 PolarHBondContact O-N 2.92Å; A917-A920 PolarHBondContact O-N 3.35Å; G918-A920 VanDerWaalsContact C-N 3.34Å; G918-A920 PolarHBondContact O-N 2.87Å; A920-V922 PolarHBondContact O-N 3.39Å; A920-C923 WeakPolarHBondContact O-CB 3.37Å; A920-C923 PolarHBondContact O-N 3.45Å; A920-L924 PolarHBondContact O-N 3.17Å; A920-L1059 HydrophobicContact CB-CB 3.62Å; A920-L1059 HydrophobicContact CB-CD1 4.36Å; A920-H1060 WeakPolarHBondContact CB-NE2 3.43Å
921	S	94.9	Very high	93.5	Very high	1 Å²	1	38 Å²	38	1%	0.007	24%	0.242	C	C	.	.	H	α-helix	trans	-62.7	-43.6	179.7	-51.8	0	0	0	0	111.4	A917 G918 V919 L924 V925	A917-S921 WeakPolarHBondContact O-CB 3.47Å; A917-S921 PolarHBondContact O-N 3.09Å; A917-S921 PolarHBondContact O-OG 3.34Å; G918-S921 PolarHBondContact O-N 3.28Å; V919-S921 PolarHBondContact O-N 2.91Å; S921-L924 PolarHBondContact O-N 3.1Å; S921-V925 WeakPolarHBondContact O-CG2 3.42Å; S921-V925 PolarHBondContact O-N 2.93Å
922	V	95.6	Very high	93.4	Very high	87 Å²	87	35.3 Å²	35.3	53%	0.527	23%	0.23	S	C	.	.	H	α-helix	trans	-63	-42.4	173.8	172.4	0	0	0	0	111.2	G918 V919 A920 L924 V925 C926	G918-V922 WeakPolarHBondContact O-CG2 3.39Å; G918-V922 PolarHBondContact O-N 3.26Å; V919-V922 PolarHBondContact O-N 3.19Å; A920-V922 PolarHBondContact O-N 3.39Å; V922-L924 VanDerWaalsContact C-N 3.33Å; V922-L924 PolarHBondContact O-N 3.07Å; V922-V925 PolarHBondContact O-N 3.28Å; V922-C926 WeakPolarHBondContact O-CB 3.37Å; V922-C926 PolarHBondContact O-N 2.92Å; V922-C926 PolarHBondContact O-SG 3.48Å
923	C	95.6	Very high	93.3	Very high	26 Å²	26	32 Å²	32	18%	0.176	21%	0.209	C	C	.	.	H	α-helix	trans	-61.4	-37.4	175.1	-76.2	0	0	0	0	112.8	V919 A920 S927 I1052 A1056	V919-C923 WeakPolarHBondContact O-CB 3.37Å; V919-C923 PolarHBondContact O-N 2.85Å; V919-C923 PolarHBondContact O-SG 3.29Å; A920-C923 WeakPolarHBondContact O-CB 3.37Å; A920-C923 PolarHBondContact O-N 3.45Å; C923-S927 WeakPolarHBondContact O-CB 3.22Å; C923-S927 PolarHBondContact O-N 3.41Å; C923-I1052 HydrophobicContact CB-CG2 3.9Å; C923-I1052 WeakPolarHBondContact O-CG2 3.35Å; C923-A1056 HydrophobicContact CB-CB 3.8Å
924	L	94.5	Very high	93.2	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-66.2	-46.9	174.2	-68.1	-178	0	0	0	112	A920 S921 V922 C926 S927 V928 L979 I983 T1023 A1056	A920-L924 PolarHBondContact O-N 3.17Å; S921-L924 PolarHBondContact O-N 3.1Å; V922-L924 VanDerWaalsContact C-N 3.33Å; V922-L924 PolarHBondContact O-N 3.07Å; L924-C926 VanDerWaalsContact C-N 3.35Å; L924-C926 PolarHBondContact O-N 3.31Å; L924-S927 PolarHBondContact O-N 2.75Å; L924-S927 VanDerWaalsContact O-N 3.11Å; L924-S927 PolarHBondContact O-OG 3.11Å; L924-V928 PolarHBondContact O-N 3.45Å; L924-L979 HydrophobicContact CD2-CD1 4.23Å; L924-I983 HydrophobicContact CB-CD1 4Å; L924-I983 HydrophobicContact CB-CG1 3.56Å; L924-I983 HydrophobicContact CD1-CG1 4.07Å; L924-I983 HydrophobicContact CG-CG1 4.46Å; L924-T1023 HydrophobicContact CD2-CG2 3.69Å; L924-A1056 HydrophobicContact CD2-CB 3.52Å; L924-A1056 HydrophobicContact CG-CB 3.77Å
925	V	95.4	Very high	92.8	Very high	56 Å²	56	33.3 Å²	33.3	34%	0.339	21%	0.212	S	C	.	.	H	α-helix	trans	-58.6	-46.9	176.3	173.2	0	0	0	0	110.8	S921 V922 S927 V928 C929 I983 F987	S921-V925 WeakPolarHBondContact O-CG2 3.42Å; S921-V925 PolarHBondContact O-N 2.93Å; V922-V925 PolarHBondContact O-N 3.28Å; V925-S927 VanDerWaalsContact C-N 3.33Å; V925-S927 PolarHBondContact O-N 2.99Å; V925-V928 PolarHBondContact O-N 3.18Å; V925-C929 PolarHBondContact O-N 3.42Å; V925-C929 PolarHBondContact O-SG 2.87Å; V925-C929 VanDerWaalsContact O-SG 3.39Å; V925-I983 HydrophobicContact CG2-CD1 4.3Å; V925-I983 HydrophobicContact CG2-CG2 3.93Å; V925-F987 HydrophobicContact CG2-CE2 4.04Å; V925-F987 HydrophobicContact CG2-CZ 4.22Å
926	C	93.8	Very high	92.3	Very high	72 Å²	72	31.3 Å²	31.3	49%	0.486	20%	0.195	S	C	.	.	H	α-helix	trans	-61	-38.2	174.7	-69.9	0	0	0	0	112.7	V922 L924 A930	V922-C926 WeakPolarHBondContact O-CB 3.37Å; V922-C926 PolarHBondContact O-N 2.92Å; V922-C926 PolarHBondContact O-SG 3.48Å; L924-C926 VanDerWaalsContact C-N 3.35Å; L924-C926 PolarHBondContact O-N 3.31Å; C926-A930 WeakPolarHBondContact O-CB 3.44Å; C926-A930 PolarHBondContact O-N 3.31Å; C926-A930 VanDerWaalsContact O-N 3.17Å
927	S	93.1	Very high	91.5	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-66	-41.5	176	77.3	0	0	0	0	111.9	C923 L924 V925 C929 A930 W933	C923-S927 WeakPolarHBondContact O-CB 3.22Å; C923-S927 PolarHBondContact O-N 3.41Å; L924-S927 PolarHBondContact O-N 2.75Å; L924-S927 VanDerWaalsContact O-N 3.11Å; L924-S927 PolarHBondContact O-OG 3.11Å; V925-S927 VanDerWaalsContact C-N 3.33Å; V925-S927 PolarHBondContact O-N 2.99Å; S927-C929 PolarHBondContact O-N 3.49Å; S927-A930 PolarHBondContact O-N 3.31Å; S927-W933 PolarHBondContact O-NE1 3.32Å
928	V	92.3	Very high	90.4	Very high	10 Å²	10	37.2 Å²	37.2	6%	0.061	22%	0.222	C	C	.	.	H	α-helix	trans	-63.6	-41.8	177.5	165.7	0	0	0	0	111.5	L924 V925 A930 W948 F976 L979 I983	L924-V928 PolarHBondContact O-N 3.45Å; V925-V928 PolarHBondContact O-N 3.18Å; V928-A930 VanDerWaalsContact C-N 3.3Å; V928-A930 PolarHBondContact O-N 3.44Å; V928-W948 HydrophobicContact CG1-CZ2 4.42Å; V928-W948 PolarHBondContact O-NE1 3.32Å; V928-W948 VanDerWaalsContact O-NE1 3.1Å; V928-F976 HydrophobicContact CG1-CD2 4.43Å; V928-F976 HydrophobicContact CG1-CE2 3.8Å; V928-L979 HydrophobicContact CG2-CD2 3.49Å; V928-L979 VanDerWaalsContact CG2-CD2 3.49Å; V928-L979 HydrophobicContact CG2-CG 3.69Å; V928-I983 HydrophobicContact CB-CD1 4.32Å; V928-I983 HydrophobicContact CG2-CD1 3.62Å
929	C	89.9	Confident	89	Confident	89 Å²	89	40.5 Å²	40.5	60%	0.601	25%	0.247	S	C	*	.	H	α-helix	trans	-73.8	-15.8	179.3	-65.9	0	0	0	0	114.2	V925 S927	V925-C929 PolarHBondContact O-N 3.42Å; V925-C929 PolarHBondContact O-SG 2.87Å; V925-C929 VanDerWaalsContact O-SG 3.39Å; S927-C929 PolarHBondContact O-N 3.49Å
930	A	90	Very high	87.8	Confident	25 Å²	25	43.2 Å²	43.2	21%	0.207	26%	0.259	C	S	.	.			trans	-81.2	139.4	-175.1	0	0	0	0	0	113.6	C926 S927 V928 T932 A1049	C926-A930 WeakPolarHBondContact O-CB 3.44Å; C926-A930 PolarHBondContact O-N 3.31Å; C926-A930 VanDerWaalsContact O-N 3.17Å; S927-A930 PolarHBondContact O-N 3.31Å; V928-A930 VanDerWaalsContact C-N 3.3Å; V928-A930 PolarHBondContact O-N 3.44Å; A930-T932 PolarHBondContact O-N 2.86Å; A930-A1049 HydrophobicContact CB-CB 3.86Å
931	S	85.4	Confident	86.9	Confident	37 Å²	37	46.9 Å²	46.9	26%	0.259	28%	0.279	S	S	.	.	S	Bend	trans	-79.2	11.6	172.3	52.9	0	0	0	0	113.9	H944 S945 G946	S931-H944 CarbonylContact O-C 3.58Å; S931-H944 VanDerWaalsContact O-C 3.22Å; S931-S945 CarbonylContact O-C 3.57Å; S931-S945 PolarHBondContact O-N 2.88Å; S931-G946 PolarHBondContact O-N 2.96Å
932	T	89.6	Confident	86.3	Confident	25 Å²	25	49.6 Å²	49.6	15%	0.153	29%	0.293	C	S	.	.			trans	-114	43	-167.2	58.8	0	0	0	0	113.5	A930 Y935 G1047 E1048 A1049	A930-T932 PolarHBondContact O-N 2.86Å; T932-Y935 WeakPolarHBondContact CB-OH 3.32Å; T932-Y935 HydrophobicContact CG2-CE1 3.95Å; T932-G1047 CarbonylContact O-C 3.54Å; T932-G1047 WeakPolarHBondContact O-CA 3.32Å; T932-E1048 PolarHBondContact O-N 3.49Å; T932-A1049 WeakPolarHBondContact O-CB 3.45Å; T932-A1049 PolarHBondContact O-N 2.89Å; T932-A1049 PolarHBondContact OG1-N 3.43Å
933	W	90.8	Very high	85.7	Confident	1 Å²	1	46.7 Å²	46.7	0%	0.004	28%	0.275	C	S	.	.	S	Bend	trans	-83.8	-39.8	174.4	-78.5	75.3	0	0	0	112.9	S927 S945 F947 L979 V1027 Y1030 G1047 A1049 Y1050	S927-W933 PolarHBondContact O-NE1 3.32Å; W933-S945 WeakPolarHBondContact CB-O 3.28Å; W933-S945 PolarHBondContact N-O 2.88Å; W933-F947 AromaticContact CD2-CE2 3.85Å; W933-F947 HydrophobicContact CD2-CE2 3.85Å; W933-F947 HydrophobicContact CD2-CZ 4.14Å; W933-F947 AromaticContact CE2-CE2 3.37Å; W933-F947 HydrophobicContact CE3-CE2 4.38Å; W933-F947 HydrophobicContact CE3-CZ 4.29Å; W933-F947 HydrophobicContact CG-CE2 4.37Å; W933-F947 HydrophobicContact CH2-CE2 4.16Å; W933-F947 HydrophobicContact CH2-CZ 4.4Å; W933-F947 AromaticContact CZ2-CE2 3.59Å; W933-F947 HydrophobicContact CZ2-CE2 3.59Å; W933-F947 HydrophobicContact CZ2-CZ 4.25Å; W933-F947 HydrophobicContact CZ3-CZ 4.41Å; W933-F947 AromaticContact NE1-CD2 3.78Å; W933-F947 AromaticContact NE1-CE2 3.56Å; W933-L979 HydrophobicContact CH2-CD2 3.61Å; W933-L979 HydrophobicContact CZ2-CD2 3.62Å; W933-V1027 HydrophobicContact CH2-CG2 4.29Å; W933-V1027 HydrophobicContact CZ3-CG2 4.37Å; W933-Y1030 HydrophobicContact CB-CE1 3.97Å; W933-Y1030 VanDerWaalsContact CB-OH 3.28Å; W933-Y1030 WeakPolarHBondContact CB-OH 3.37Å; W933-Y1030 HydrophobicContact CD2-CE1 4.42Å; W933-Y1030 AromaticContact CE3-CD1 3.81Å; W933-Y1030 HydrophobicContact CE3-CD1 3.81Å; W933-Y1030 AromaticContact CE3-CE1 3.69Å; W933-Y1030 HydrophobicContact CE3-CE1 3.69Å; W933-Y1030 HydrophobicContact CE3-CE2 4.43Å; W933-Y1030 HydrophobicContact CE3-CG 4.24Å; W933-Y1030 HydrophobicContact CZ3-CD1 4.32Å; W933-Y1030 HydrophobicContact CZ3-CG 4.5Å; W933-G1047 PolarHBondContact O-N 2.95Å; W933-A1049 VanDerWaalsContact CD1-CB 3.49Å; W933-A1049 HydrophobicContact CD2-CB 4.18Å; W933-A1049 HydrophobicContact CG-CB 3.94Å; W933-Y1050 HydrophobicContact CE3-CD2 4.39Å; W933-Y1050 HydrophobicContact CZ3-CD2 4.32Å
934	L	89.2	Confident	85.3	Confident	7 Å²	7	47.6 Å²	47.6	4%	0.037	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	131.1	178.9	-177.4	68.2	0	0	0	110.1	Q936 S945 I1034 L1038 M1044	L934-Q936 HydrophobicContact CD2-CB 4.43Å; L934-Q936 HydrophobicContact CG-CB 4.43Å; L934-S945 PolarHBondContact N-O 3.45Å; L934-S945 PolarHBondContact O-N 3.44Å; L934-I1034 HydrophobicContact CD1-CD1 4.33Å; L934-I1034 HydrophobicContact CD1-CG2 4.28Å; L934-I1034 HydrophobicContact CD2-CD1 4.2Å; L934-L1038 HydrophobicContact CD2-CD2 4.26Å; L934-M1044 HydrophobicContact CD1-CB 4.22Å; L934-M1044 HydrophobicContact CD1-SD 4.49Å; L934-M1044 HydrophobicContact CD2-SD 4.41Å
935	Y	87.3	Confident	84.9	Confident	45 Å²	45	47.8 Å²	47.8	18%	0.176	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	115.8	166.8	-54.1	-31.9	0	0	0	108.3	T932 T943 H944 M1044 N1045 E1048	T932-Y935 WeakPolarHBondContact CB-OH 3.32Å; T932-Y935 HydrophobicContact CG2-CE1 3.95Å; Y935-T943 WeakPolarHBondContact CA-O 3.46Å; Y935-H944 HydrophobicContact CD1-CB 4.44Å; Y935-H944 AromaticContact CD1-CE1 3.87Å; Y935-H944 AromaticContact CD1-CG 3.87Å; Y935-H944 AromaticContact CD1-ND1 3.63Å; Y935-H944 AromaticContact CE1-CE1 3.62Å; Y935-H944 AromaticContact CE1-CG 3.96Å; Y935-H944 AromaticContact CE1-ND1 3.28Å; Y935-H944 VanDerWaalsContact CE1-ND1 3.28Å; Y935-H944 WeakPolarHBondContact CE1-ND1 3.41Å; Y935-M1044 WeakPolarHBondContact O-CA 3.36Å; Y935-N1045 PolarHBondContact N-O 2.73Å; Y935-N1045 PolarHBondContact O-N 3.16Å; Y935-E1048 PolarHBondContact OH-N 2.88Å
936	Q	84.3	Confident	84.4	Confident	35 Å²	35	45.1 Å²	45.1	16%	0.164	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	125.7	-176.2	-179.9	-179.3	25.1	0	0	110	L934 T943 T1040 M1044	L934-Q936 HydrophobicContact CD2-CB 4.43Å; L934-Q936 HydrophobicContact CG-CB 4.43Å; Q936-T943 PolarHBondContact N-O 2.94Å; Q936-T943 PolarHBondContact O-N 3.04Å; Q936-T943 PolarHBondContact O-OG1 3.3Å; Q936-T1040 PolarHBondContact NE2-OG1 3.48Å; Q936-T1040 VanDerWaalsContact NE2-OG1 3.1Å; Q936-M1044 HydrophobicContact CB-CG 4.42Å; Q936-M1044 HydrophobicContact CG-CG 4.09Å
937	G	77.2	Confident	84	Confident	23 Å²	23	42 Å²	42	24%	0.237	24%	0.24	C	C	.	.	S	Bend	trans	132.1	167.8	173.3	0	0	0	0	0	114.5	N941 P1043	G937-N941 WeakPolarHBondContact CA-O 3.23Å; G937-P1043 PolarHBondContact N-O 2.91Å
938	Y	71.3	Confident	83.6	Confident	148 Å²	148	46.8 Å²	46.8	58%	0.58	26%	0.258	S	S	*	.			trans	-81.1	165.4	178.2	-68.8	-85.1	0	0	0	111.6	N940 N941 E1041 P1043	Y938-N940 PolarHBondContact O-N 2.86Å; Y938-N941 CarbonylContact O-C 3.34Å; Y938-N941 PolarHBondContact O-N 2.98Å; Y938-E1041 PolarHBondContact OH-O 2.99Å; Y938-E1041 VanDerWaalsContact OH-O 3.09Å; Y938-P1043 HydrophobicContact CD1-CG 4.08Å; Y938-P1043 VanDerWaalsContact CE1-CD 3.47Å; Y938-P1043 HydrophobicContact CE1-CG 4.18Å
939	A	66.9	Low	83.3	Confident	88 Å²	88	50.9 Å²	50.9	73%	0.727	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.3	-28.9	-164.1	0	0	0	0	0	117.1
940	N	71.4	Confident	83.1	Confident	132 Å²	132	50.4 Å²	50.4	71%	0.706	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-19.1	-178.6	-60.5	8.9	0	0	0	113.5	Y938 F954	Y938-N940 PolarHBondContact O-N 2.86Å; N940-F954 WeakPolarHBondContact O-CB 3.31Å; N940-F954 WeakPolarHBondContact O-CD2 3.46Å
941	N	77.2	Confident	82.9	Confident	78 Å²	78	50.3 Å²	50.3	42%	0.417	26%	0.259	S	S	.	.	S	Bend	trans	-133.4	73.6	-173.7	-176.3	9.6	0	0	0	109.1	G937 Y938 N952 F954	G937-N941 WeakPolarHBondContact CA-O 3.23Å; Y938-N941 CarbonylContact O-C 3.34Å; Y938-N941 PolarHBondContact O-N 2.98Å; N941-N952 PolarHBondContact OD1-ND2 3.45Å; N941-N952 PolarHBondContact OD1-OD1 3.39Å; N941-N952 VanDerWaalsContact OD1-OD1 3.1Å; N941-F954 HydrophobicContact CB-CB 4.45Å
942	I	81.6	Confident	82.8	Confident	58 Å²	58	49.7 Å²	49.7	30%	0.297	25%	0.252	S	S	.	.			trans	-94.7	121.2	-179.9	-54.8	177.8	0	0	0	108.5	Y953	I942-Y953 WeakPolarHBondContact O-CB 3.28Å; I942-Y953 PolarHBondContact O-N 3.04Å
943	T	84	Confident	82.3	Confident	25 Å²	25	57.3 Å²	57.3	15%	0.153	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	127.3	173.3	61.8	0	0	0	0	110.1	Y935 Q936 C951 N952	Y935-T943 WeakPolarHBondContact CA-O 3.46Å; Q936-T943 PolarHBondContact N-O 2.94Å; Q936-T943 PolarHBondContact O-N 3.04Å; Q936-T943 PolarHBondContact O-OG1 3.3Å; T943-C951 WeakPolarHBondContact CA-O 3.4Å; T943-N952 HydrophobicContact CG2-CB 4.14Å
944	H	86.9	Confident	81.6	Confident	46 Å²	46	63.8 Å²	63.8	21%	0.213	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	108.9	176.2	-70.3	-128.1	0	0	0	107.6	S931 Y935 R950 C951	S931-H944 CarbonylContact O-C 3.58Å; S931-H944 VanDerWaalsContact O-C 3.22Å; Y935-H944 HydrophobicContact CD1-CB 4.44Å; Y935-H944 AromaticContact CD1-CE1 3.87Å; Y935-H944 AromaticContact CD1-CG 3.87Å; Y935-H944 AromaticContact CD1-ND1 3.63Å; Y935-H944 AromaticContact CE1-CE1 3.62Å; Y935-H944 AromaticContact CE1-CG 3.96Å; Y935-H944 AromaticContact CE1-ND1 3.28Å; Y935-H944 VanDerWaalsContact CE1-ND1 3.28Å; Y935-H944 WeakPolarHBondContact CE1-ND1 3.41Å; H944-R950 CarbonylContact O-C 3.56Å; H944-R950 WeakPolarHBondContact O-CA 3.45Å; H944-C951 PolarHBondContact N-O 3.11Å; H944-C951 PolarHBondContact O-N 2.91Å
945	S	84.9	Confident	81	Confident	4 Å²	4	67.8 Å²	67.8	3%	0.028	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	128.4	178.9	-57.4	0	0	0	0	111	S931 W933 L934 R950	S931-S945 CarbonylContact O-C 3.57Å; S931-S945 PolarHBondContact O-N 2.88Å; W933-S945 WeakPolarHBondContact CB-O 3.28Å; W933-S945 PolarHBondContact N-O 2.88Å; L934-S945 PolarHBondContact N-O 3.45Å; L934-S945 PolarHBondContact O-N 3.44Å; S945-R950 PolarHBondContact OG-NE 2.94Å; S945-R950 PolarHBondContact OG-NH2 3.13Å
946	G	86.4	Confident	80.5	Confident	0 Å²	0	74 Å²	74	0%	0	36%	0.36	C	S	.	.			trans	-118.7	-156.9	163.2	0	0	0	0	0	111.5	S931 K949 Q972	S931-G946 PolarHBondContact O-N 2.96Å; G946-K949 PolarHBondContact N-O 2.88Å; G946-Q972 PolarHBondContact O-NE2 2.86Å
947	F	85.1	Confident	80.4	Confident	5 Å²	5	75 Å²	75	2%	0.022	37%	0.369	C	S	.	.	S	Bend	trans	-78	-45.9	174	-61.6	-66.9	0	0	0	112.5	W933 Q972 F976 L979 Y1030	W933-F947 AromaticContact CD2-CE2 3.85Å; W933-F947 HydrophobicContact CD2-CE2 3.85Å; W933-F947 HydrophobicContact CD2-CZ 4.14Å; W933-F947 AromaticContact CE2-CE2 3.37Å; W933-F947 HydrophobicContact CE3-CE2 4.38Å; W933-F947 HydrophobicContact CE3-CZ 4.29Å; W933-F947 HydrophobicContact CG-CE2 4.37Å; W933-F947 HydrophobicContact CH2-CE2 4.16Å; W933-F947 HydrophobicContact CH2-CZ 4.4Å; W933-F947 AromaticContact CZ2-CE2 3.59Å; W933-F947 HydrophobicContact CZ2-CE2 3.59Å; W933-F947 HydrophobicContact CZ2-CZ 4.25Å; W933-F947 HydrophobicContact CZ3-CZ 4.41Å; W933-F947 AromaticContact NE1-CD2 3.78Å; W933-F947 AromaticContact NE1-CE2 3.56Å; F947-Q972 HydrophobicContact CD1-CG 4.1Å; F947-Q972 HydrophobicContact CE1-CG 4.28Å; F947-F976 HydrophobicContact CB-CD2 3.91Å; F947-F976 HydrophobicContact CB-CE2 4.45Å; F947-F976 HydrophobicContact CD1-CB 3.78Å; F947-F976 HydrophobicContact CD1-CD2 4.13Å; F947-F976 HydrophobicContact CD1-CG 4.37Å; F947-F976 HydrophobicContact CD2-CD2 4.03Å; F947-F976 HydrophobicContact CE1-CB 3.89Å; F947-F976 HydrophobicContact CG-CB 4.3Å; F947-F976 AromaticContact CG-CD2 3.77Å; F947-F976 HydrophobicContact CG-CD2 3.77Å; F947-F976 HydrophobicContact CG-CG 4.44Å; F947-F976 HydrophobicContact CZ-CB 4.5Å; F947-L979 HydrophobicContact CE2-CD2 3.83Å; F947-L979 HydrophobicContact CZ-CD2 4.25Å; F947-Y1030 HydrophobicContact CE1-CD2 4.12Å; F947-Y1030 AromaticContact CE1-CE2 3.92Å; F947-Y1030 HydrophobicContact CE1-CE2 3.92Å; F947-Y1030 HydrophobicContact CZ-CD2 4.24Å; F947-Y1030 HydrophobicContact CZ-CE2 4.21Å
948	W	85	Confident	80.7	Confident	101 Å²	101	77.3 Å²	77.3	38%	0.383	38%	0.38	S	S	.	.	S	Bend	trans	-92.8	-22.1	-171.2	-53.6	100.5	0	0	0	115.4	V928 I960 M961 P963 F976	V928-W948 HydrophobicContact CG1-CZ2 4.42Å; V928-W948 PolarHBondContact O-NE1 3.32Å; V928-W948 VanDerWaalsContact O-NE1 3.1Å; W948-I960 WeakPolarHBondContact O-CG2 3.38Å; W948-M961 CarbonylContact C-O 3.54Å; W948-M961 VanDerWaalsContact C-O 3.27Å; W948-M961 VanDerWaalsContact CA-O 3.23Å; W948-M961 WeakPolarHBondContact CA-O 3.27Å; W948-M961 PolarHBondContact O-N 2.92Å; W948-P963 HydrophobicContact CE3-CG 3.84Å; W948-P963 HydrophobicContact CH2-CG 4.07Å; W948-P963 HydrophobicContact CZ3-CG 3.56Å; W948-F976 AromaticContact CE2-CE2 3.85Å; W948-F976 HydrophobicContact CH2-CE2 4.14Å; W948-F976 AromaticContact CH2-CZ 3.63Å; W948-F976 HydrophobicContact CH2-CZ 3.63Å; W948-F976 AromaticContact CZ2-CE2 3.47Å; W948-F976 HydrophobicContact CZ2-CE2 3.47Å; W948-F976 VanDerWaalsContact CZ2-CE2 3.47Å; W948-F976 AromaticContact CZ2-CZ 3.38Å; W948-F976 HydrophobicContact CZ2-CZ 3.38Å
949	K	85.8	Confident	81.2	Confident	97 Å²	97	75 Å²	75	42%	0.422	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.9	142	-173.7	-62.7	-169.1	-179.9	-171.6	0	111.1	G946 E959 I960	G946-K949 PolarHBondContact N-O 2.88Å; K949-E959 CarbonylContact C-O 3.09Å; K949-E959 VanDerWaalsContact CA-O 3.27Å; K949-E959 WeakPolarHBondContact CA-O 3.44Å; K949-I960 HydrophobicContact CG-CG1 4.43Å
950	R	84.4	Confident	81.9	Confident	79 Å²	79	75.7 Å²	75.7	30%	0.298	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	114.9	167.3	169.8	173.9	-78.3	157.3	-5.6	108.4	H944 S945 C958 E959 M961	H944-R950 CarbonylContact O-C 3.56Å; H944-R950 WeakPolarHBondContact O-CA 3.45Å; S945-R950 PolarHBondContact OG-NE 2.94Å; S945-R950 PolarHBondContact OG-NH2 3.13Å; R950-C958 CarbonylContact O-C 3.09Å; R950-C958 WeakPolarHBondContact O-CA 3.29Å; R950-E959 PolarHBondContact N-O 2.94Å; R950-E959 PolarHBondContact O-N 3.45Å; R950-M961 HydrophobicContact CB-CG 4.28Å; R950-M961 HydrophobicContact CB-SD 3.77Å
951	C	85.5	Confident	81.9	Confident	23 Å²	23	70.8 Å²	70.8	16%	0.155	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	124.3	-179.8	-63.8	0	0	0	0	110.6	T943 H944 T957 C958	T943-C951 WeakPolarHBondContact CA-O 3.4Å; H944-C951 PolarHBondContact N-O 3.11Å; H944-C951 PolarHBondContact O-N 2.91Å; C951-T957 WeakPolarHBondContact CA-O 3.38Å; C951-C958 HydrophobicContact CB-CB 4.16Å; C951-C958 WeakPolarHBondContact CB-SG 3.45Å; C951-C958 WeakPolarHBondContact SG-CB 3.42Å; C951-C958 CovalentContact SG-SG 2.05Å; C951-C958 PolarHBondContact SG-SG 3.44Å
952	N	84.2	Confident	81.6	Confident	24 Å²	24	70.8 Å²	70.8	13%	0.128	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	119.1	168.8	-173.4	-27.8	0	0	0	109.3	N941 T943 F954 N955 Q956 T957	N941-N952 PolarHBondContact OD1-ND2 3.45Å; N941-N952 PolarHBondContact OD1-OD1 3.39Å; N941-N952 VanDerWaalsContact OD1-OD1 3.1Å; T943-N952 HydrophobicContact CG2-CB 4.14Å; N952-F954 VanDerWaalsContact C-N 3.31Å; N952-F954 PolarHBondContact O-N 3.35Å; N952-F954 WeakPolarHBondContact OD1-CB 3.37Å; N952-F954 PolarHBondContact OD1-N 2.83Å; N952-N955 HydrophobicContact CB-CB 4.37Å; N952-Q956 WeakPolarHBondContact O-CA 3.36Å; N952-Q956 PolarHBondContact O-N 3.28Å; N952-T957 PolarHBondContact N-O 3.43Å
953	Y	79.2	Confident	80.7	Confident	185 Å²	185	68.7 Å²	68.7	73%	0.725	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-29.2	-178.9	-165.9	-89.4	0	0	0	113.3	I942	I942-Y953 WeakPolarHBondContact O-CB 3.28Å; I942-Y953 PolarHBondContact O-N 3.04Å
954	F	75.7	Confident	79.8	Confident	136 Å²	136	73.7 Å²	73.7	60%	0.596	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-46.6	-179	-171.2	-108.4	0	0	0	112.3	N940 N941 N952 Q956	N940-F954 WeakPolarHBondContact O-CB 3.31Å; N940-F954 WeakPolarHBondContact O-CD2 3.46Å; N941-F954 HydrophobicContact CB-CB 4.45Å; N952-F954 VanDerWaalsContact C-N 3.31Å; N952-F954 PolarHBondContact O-N 3.35Å; N952-F954 WeakPolarHBondContact OD1-CB 3.37Å; N952-F954 PolarHBondContact OD1-N 2.83Å; F954-Q956 VanDerWaalsContact C-N 3.33Å
955	N	76.3	Confident	78.7	Confident	92 Å²	92	77.9 Å²	77.9	49%	0.492	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.7	-9.3	179.7	-69.1	1	0	0	0	113.1	N952 T957	N952-N955 HydrophobicContact CB-CB 4.37Å; N955-T957 HydrophobicContact CB-CG2 4.06Å; N955-T957 WeakPolarHBondContact CB-OG1 3.38Å; N955-T957 PolarHBondContact O-N 2.78Å
956	Q	78.2	Confident	77.6	Confident	175 Å²	175	80 Å²	80	82%	0.818	38%	0.384	S	S	*	.			trans	55.9	7.6	-167.9	-56.8	-173.1	1.6	0	0	115.2	N952 F954	N952-Q956 WeakPolarHBondContact O-CA 3.36Å; N952-Q956 PolarHBondContact O-N 3.28Å; F954-Q956 VanDerWaalsContact C-N 3.33Å
957	T	81.9	Confident	76.3	Confident	56 Å²	56	90.5 Å²	90.5	34%	0.344	43%	0.429	S	S	.	.			trans	-78.4	121.6	179.5	51	0	0	0	0	111.5	C951 N952 N955	C951-T957 WeakPolarHBondContact CA-O 3.38Å; N952-T957 PolarHBondContact N-O 3.43Å; N955-T957 HydrophobicContact CB-CG2 4.06Å; N955-T957 WeakPolarHBondContact CB-OG1 3.38Å; N955-T957 PolarHBondContact O-N 2.78Å
958	C	83.2	Confident	75.2	Confident	71 Å²	71	91.5 Å²	91.5	48%	0.48	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	100.9	168.1	-72.9	0	0	0	0	110.8	R950 C951	R950-C958 CarbonylContact O-C 3.09Å; R950-C958 WeakPolarHBondContact O-CA 3.29Å; C951-C958 HydrophobicContact CB-CB 4.16Å; C951-C958 WeakPolarHBondContact CB-SG 3.45Å; C951-C958 WeakPolarHBondContact SG-CB 3.42Å; C951-C958 CovalentContact SG-SG 2.05Å; C951-C958 PolarHBondContact SG-SG 3.44Å
959	E	81.8	Confident	74.4	Confident	100 Å²	100	91.8 Å²	91.8	47%	0.467	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	129.1	169.7	-67	170.2	-179.4	0	0	109.3	K949 R950	K949-E959 CarbonylContact C-O 3.09Å; K949-E959 VanDerWaalsContact CA-O 3.27Å; K949-E959 WeakPolarHBondContact CA-O 3.44Å; R950-E959 PolarHBondContact N-O 2.94Å; R950-E959 PolarHBondContact O-N 3.45Å
960	I	80.5	Confident	74.1	Confident	103 Å²	103	89.9 Å²	89.9	53%	0.528	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	120.5	171.7	-51.5	-176	0	0	0	107.6	W948 K949 L962	W948-I960 WeakPolarHBondContact O-CG2 3.38Å; K949-I960 HydrophobicContact CG-CG1 4.43Å; I960-L962 HydrophobicContact CB-CD1 4.42Å; I960-L962 HydrophobicContact CG2-CD1 3.77Å; I960-L962 HydrophobicContact CG2-CG 4.48Å
961	M	73.1	Confident	74	Confident	28 Å²	28	88.4 Å²	88.4	14%	0.138	44%	0.442	C	S	.	.			trans	-102.8	112.4	174.9	-53.8	-168.2	82.4	0	0	106.9	W948 R950 P963	W948-M961 CarbonylContact C-O 3.54Å; W948-M961 VanDerWaalsContact C-O 3.27Å; W948-M961 VanDerWaalsContact CA-O 3.23Å; W948-M961 WeakPolarHBondContact CA-O 3.27Å; W948-M961 PolarHBondContact O-N 2.92Å; R950-M961 HydrophobicContact CB-CG 4.28Å; R950-M961 HydrophobicContact CB-SD 3.77Å; M961-P963 WeakPolarHBondContact O-CD 3.25Å
962	L	70.3	Confident	74	Confident	79 Å²	79	88.4 Å²	88.4	41%	0.414	44%	0.439	S	S	.	.			trans	-90.4	110.8	178.2	-76.1	86.8	0	0	0	107.9	I960 I965 T966	I960-L962 HydrophobicContact CB-CD1 4.42Å; I960-L962 HydrophobicContact CG2-CD1 3.77Å; I960-L962 HydrophobicContact CG2-CG 4.48Å; L962-I965 HydrophobicContact CB-CB 3.93Å; L962-I965 HydrophobicContact CB-CD1 4.32Å; L962-I965 HydrophobicContact CB-CG1 4.49Å; L962-I965 HydrophobicContact CD2-CD1 4.03Å; L962-I965 PolarHBondContact O-N 3.32Å; L962-T966 PolarHBondContact N-OG1 2.88Å; L962-T966 PolarHBondContact O-N 2.91Å; L962-T966 PolarHBondContact O-OG1 3.27Å
963	P	62	Low	74	Confident	13 Å²	13	88.3 Å²	88.3	8%	0.084	44%	0.439	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	146.9	177.7	23.6	-33.2	0	0	0	110.3	W948 M961 I965 D973 F976	W948-P963 HydrophobicContact CE3-CG 3.84Å; W948-P963 HydrophobicContact CH2-CG 4.07Å; W948-P963 HydrophobicContact CZ3-CG 3.56Å; M961-P963 WeakPolarHBondContact O-CD 3.25Å; P963-I965 PolarHBondContact O-N 3.13Å; P963-D973 VanDerWaalsContact CA-OD1 3.32Å; P963-D973 WeakPolarHBondContact CA-OD1 3.46Å; P963-D973 WeakPolarHBondContact CB-OD1 3.48Å; P963-F976 HydrophobicContact CB-CD1 4.22Å; P963-F976 HydrophobicContact CB-CE1 4.34Å; P963-F976 HydrophobicContact CG-CD1 4.43Å; P963-F976 HydrophobicContact CG-CE1 4.11Å; P963-F976 HydrophobicContact CG-CZ 4.25Å
964	F	65.2	Low	74.4	Confident	130 Å²	130	80.9 Å²	80.9	57%	0.57	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.2	-16	-170.6	-37.6	-75.6	0	0	0	117.2	D973 F976 F977	F964-D973 HydrophobicContact CD1-CB 3.83Å; F964-D973 HydrophobicContact CE1-CB 3.76Å; F964-D973 PolarHBondContact N-OD1 3.35Å; F964-F976 HydrophobicContact CE2-CD1 4.08Å; F964-F976 AromaticContact CE2-CE1 3.88Å; F964-F976 HydrophobicContact CE2-CE1 3.88Å; F964-F976 AromaticContact CZ-CD1 3.94Å; F964-F976 HydrophobicContact CZ-CD1 3.94Å; F964-F976 HydrophobicContact CZ-CE1 4.14Å; F964-F977 HydrophobicContact CZ-CB 4.47Å
965	I	63.7	Low	75	Confident	135 Å²	135	74.5 Å²	74.5	69%	0.692	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.6	-48.6	-177.5	-60.1	176.4	0	0	0	111.4	L962 P963	L962-I965 HydrophobicContact CB-CB 3.93Å; L962-I965 HydrophobicContact CB-CD1 4.32Å; L962-I965 HydrophobicContact CB-CG1 4.49Å; L962-I965 HydrophobicContact CD2-CD1 4.03Å; L962-I965 PolarHBondContact O-N 3.32Å; P963-I965 PolarHBondContact O-N 3.13Å
966	T	61.2	Low	75.7	Confident	49 Å²	49	70.9 Å²	70.9	30%	0.301	37%	0.371	S	S	.	.	S	Bend	trans	-73.1	151.8	171.1	37.8	0	0	0	0	110.7	L962 H968	L962-T966 PolarHBondContact N-OG1 2.88Å; L962-T966 PolarHBondContact O-N 2.91Å; L962-T966 PolarHBondContact O-OG1 3.27Å; T966-H968 PolarHBondContact O-CD2 3.49Å; T966-H968 PolarHBondContact O-N 3.33Å; T966-H968 PolarHBondContact OG1-CD2 2.98Å; T966-H968 PolarHBondContact OG1-NE2 3.04Å
967	K	60	Low	76.4	Confident	219 Å²	219	67.9 Å²	67.9	95%	0.952	36%	0.355	S	S	*	.			trans	-73	69	-173.3	-168.8	-177.1	177.9	-179.6	0	112.4
968	H	62.4	Low	76.9	Confident	27 Å²	27	67.1 Å²	67.1	13%	0.125	35%	0.349	C	S	.	.			trans	-72.5	157.7	176	-72.9	-83.9	0	0	0	112.1	T966 G970 Q972 D973	T966-H968 PolarHBondContact O-CD2 3.49Å; T966-H968 PolarHBondContact O-N 3.33Å; T966-H968 PolarHBondContact OG1-CD2 2.98Å; T966-H968 PolarHBondContact OG1-NE2 3.04Å; H968-G970 PolarHBondContact O-N 3.48Å; H968-Q972 PolarHBondContact ND1-OE1 3.2Å; H968-D973 IonicContact CD2-OD1 2.69Å
969	E	68.8	Low	77.4	Confident	107 Å²	107	63.8 Å²	63.8	50%	0.5	33%	0.326	S	S	.	.			trans	-70.3	114	156.7	-60.2	-176.3	172.2	0	0	107.1	W971 Q972	E969-W971 VanDerWaalsContact CB-NE1 3.33Å; E969-W971 PolarHBondContact O-N 3.29Å; E969-W971 PolarHBondContact OE2-NE1 2.87Å; E969-Q972 WeakPolarHBondContact O-CB 3.19Å; E969-Q972 PolarHBondContact O-N 3.05Å
970	G	77.7	Confident	78	Confident	56 Å²	56	61.3 Å²	61.3	58%	0.577	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-7.1	-165.6	0	0	0	0	0	116.9	H968 Q972 G974	H968-G970 PolarHBondContact O-N 3.48Å; G970-Q972 VanDerWaalsContact C-N 3.29Å; G970-G974 PolarHBondContact O-N 2.93Å; G970-G974 VanDerWaalsContact O-N 3.13Å
971	W	82.8	Confident	78.7	Confident	49 Å²	49	59.8 Å²	59.8	19%	0.186	31%	0.31	C	S	.	.	H	α-helix	trans	-67.7	-28.2	167.1	68.1	-103	0	0	0	112.5	E969 G974 A975 Y1030 T1033 I1034 H1037 L1038	E969-W971 VanDerWaalsContact CB-NE1 3.33Å; E969-W971 PolarHBondContact O-N 3.29Å; E969-W971 PolarHBondContact OE2-NE1 2.87Å; W971-G974 PolarHBondContact O-N 2.76Å; W971-A975 WeakPolarHBondContact O-CB 3.47Å; W971-A975 PolarHBondContact O-N 3.43Å; W971-Y1030 HydrophobicContact CH2-CD2 4.47Å; W971-Y1030 HydrophobicContact CH2-CE2 4.38Å; W971-Y1030 AromaticContact CZ3-CD2 3.73Å; W971-Y1030 HydrophobicContact CZ3-CD2 3.73Å; W971-Y1030 HydrophobicContact CZ3-CE2 4.01Å; W971-Y1030 HydrophobicContact CZ3-CG 4.42Å; W971-T1033 HydrophobicContact CB-CG2 4Å; W971-T1033 VanDerWaalsContact CD2-CB 3.5Å; W971-T1033 HydrophobicContact CD2-CG2 3.81Å; W971-T1033 HydrophobicContact CE3-CG2 3.89Å; W971-T1033 HydrophobicContact CG-CG2 3.85Å; W971-T1033 WeakPolarHBondContact CZ3-OG1 3.06Å; W971-I1034 HydrophobicContact CH2-CD1 4.37Å; W971-I1034 HydrophobicContact CH2-CG1 3.7Å; W971-I1034 HydrophobicContact CZ2-CG1 4.39Å; W971-I1034 HydrophobicContact CZ3-CG1 4.43Å; W971-H1037 AromaticContact CD1-CD2 3.65Å; W971-H1037 AromaticContact CD1-NE2 3.95Å; W971-H1037 AromaticContact NE1-CD2 3.49Å; W971-H1037 PolarHBondContact NE1-CD2 3.45Å; W971-L1038 HydrophobicContact CZ2-CD1 4.47Å
972	Q	85.4	Confident	79.8	Confident	23 Å²	23	58.4 Å²	58.4	11%	0.107	30%	0.303	C	S	.	.	H	α-helix	trans	-70.3	-46.7	178.9	-174.8	177.5	1.4	0	0	110.5	G946 F947 H968 E969 G970 G974 A975 F976	G946-Q972 PolarHBondContact O-NE2 2.86Å; F947-Q972 HydrophobicContact CD1-CG 4.1Å; F947-Q972 HydrophobicContact CE1-CG 4.28Å; H968-Q972 PolarHBondContact ND1-OE1 3.2Å; E969-Q972 WeakPolarHBondContact O-CB 3.19Å; E969-Q972 PolarHBondContact O-N 3.05Å; G970-Q972 VanDerWaalsContact C-N 3.29Å; Q972-G974 VanDerWaalsContact C-N 3.32Å; Q972-G974 PolarHBondContact O-N 2.89Å; Q972-A975 PolarHBondContact O-N 2.94Å; Q972-F976 WeakPolarHBondContact O-CB 3.36Å; Q972-F976 PolarHBondContact O-N 3.03Å
973	D	84.7	Confident	80.9	Confident	22 Å²	22	55.5 Å²	55.5	12%	0.118	29%	0.288	C	S	.	.	H	α-helix	trans	-60.4	-41.2	172.7	-68.3	-41.3	0	0	0	111.4	P963 F964 H968 F976 F977	P963-D973 VanDerWaalsContact CA-OD1 3.32Å; P963-D973 WeakPolarHBondContact CA-OD1 3.46Å; P963-D973 WeakPolarHBondContact CB-OD1 3.48Å; F964-D973 HydrophobicContact CD1-CB 3.83Å; F964-D973 HydrophobicContact CE1-CB 3.76Å; F964-D973 PolarHBondContact N-OD1 3.35Å; H968-D973 IonicContact CD2-OD1 2.69Å; D973-F976 PolarHBondContact O-N 3.41Å; D973-F977 WeakPolarHBondContact O-CB 3.45Å; D973-F977 PolarHBondContact O-N 2.93Å
974	G	87.8	Confident	82.6	Confident	29 Å²	29	59.9 Å²	59.9	30%	0.299	31%	0.31	S	S	.	.	H	α-helix	trans	-62.3	-46.4	174.4	0	0	0	0	0	113.3	G970 W971 Q972 F976 F977 I978	G970-G974 PolarHBondContact O-N 2.93Å; G970-G974 VanDerWaalsContact O-N 3.13Å; W971-G974 PolarHBondContact O-N 2.76Å; Q972-G974 VanDerWaalsContact C-N 3.32Å; Q972-G974 PolarHBondContact O-N 2.89Å; G974-F976 VanDerWaalsContact C-N 3.35Å; G974-F976 PolarHBondContact O-N 2.94Å; G974-F977 PolarHBondContact O-N 3.18Å; G974-I978 WeakPolarHBondContact O-CD1 3.45Å; G974-I978 VanDerWaalsContact O-CG1 3.23Å; G974-I978 WeakPolarHBondContact O-CG1 3.42Å; G974-I978 PolarHBondContact O-N 2.95Å
975	A	89.1	Confident	84	Confident	2 Å²	2	56.1 Å²	56.1	2%	0.017	30%	0.296	C	S	.	.	H	α-helix	trans	-64.2	-39.7	176.6	0	0	0	0	0	112	W971 Q972 L979 S1026 I1029 Y1030	W971-A975 WeakPolarHBondContact O-CB 3.47Å; W971-A975 PolarHBondContact O-N 3.43Å; Q972-A975 PolarHBondContact O-N 2.94Å; A975-L979 WeakPolarHBondContact O-CB 3.47Å; A975-L979 PolarHBondContact O-N 2.87Å; A975-L979 VanDerWaalsContact O-N 3.09Å; A975-S1026 WeakPolarHBondContact O-CB 3.35Å; A975-I1029 HydrophobicContact CB-CG2 4.41Å; A975-Y1030 HydrophobicContact CB-CD2 4.44Å
976	F	90.8	Very high	85.5	Confident	15 Å²	15	49.7 Å²	49.7	7%	0.066	26%	0.263	C	S	.	.	H	α-helix	trans	-60.7	-49.2	172.9	168.9	-98.6	0	0	0	111.9	V928 F947 W948 P963 F964 Q972 D973 G974 I978 L979 V980	V928-F976 HydrophobicContact CG1-CD2 4.43Å; V928-F976 HydrophobicContact CG1-CE2 3.8Å; F947-F976 HydrophobicContact CB-CD2 3.91Å; F947-F976 HydrophobicContact CB-CE2 4.45Å; F947-F976 HydrophobicContact CD1-CB 3.78Å; F947-F976 HydrophobicContact CD1-CD2 4.13Å; F947-F976 HydrophobicContact CD1-CG 4.37Å; F947-F976 HydrophobicContact CD2-CD2 4.03Å; F947-F976 HydrophobicContact CE1-CB 3.89Å; F947-F976 HydrophobicContact CG-CB 4.3Å; F947-F976 AromaticContact CG-CD2 3.77Å; F947-F976 HydrophobicContact CG-CD2 3.77Å; F947-F976 HydrophobicContact CG-CG 4.44Å; F947-F976 HydrophobicContact CZ-CB 4.5Å; W948-F976 AromaticContact CE2-CE2 3.85Å; W948-F976 HydrophobicContact CH2-CE2 4.14Å; W948-F976 AromaticContact CH2-CZ 3.63Å; W948-F976 HydrophobicContact CH2-CZ 3.63Å; W948-F976 AromaticContact CZ2-CE2 3.47Å; W948-F976 HydrophobicContact CZ2-CE2 3.47Å; W948-F976 VanDerWaalsContact CZ2-CE2 3.47Å; W948-F976 AromaticContact CZ2-CZ 3.38Å; W948-F976 HydrophobicContact CZ2-CZ 3.38Å; P963-F976 HydrophobicContact CB-CD1 4.22Å; P963-F976 HydrophobicContact CB-CE1 4.34Å; P963-F976 HydrophobicContact CG-CD1 4.43Å; P963-F976 HydrophobicContact CG-CE1 4.11Å; P963-F976 HydrophobicContact CG-CZ 4.25Å; F964-F976 HydrophobicContact CE2-CD1 4.08Å; F964-F976 AromaticContact CE2-CE1 3.88Å; F964-F976 HydrophobicContact CE2-CE1 3.88Å; F964-F976 AromaticContact CZ-CD1 3.94Å; F964-F976 HydrophobicContact CZ-CD1 3.94Å; F964-F976 HydrophobicContact CZ-CE1 4.14Å; Q972-F976 WeakPolarHBondContact O-CB 3.36Å; Q972-F976 PolarHBondContact O-N 3.03Å; D973-F976 PolarHBondContact O-N 3.41Å; G974-F976 VanDerWaalsContact C-N 3.35Å; G974-F976 PolarHBondContact O-N 2.94Å; F976-I978 PolarHBondContact O-N 2.97Å; F976-L979 WeakPolarHBondContact O-CB 3.46Å; F976-L979 PolarHBondContact O-N 2.75Å; F976-L979 VanDerWaalsContact O-N 3.12Å; F976-V980 HydrophobicContact CD1-CG2 4.46Å; F976-V980 HydrophobicContact CD2-CG2 4.39Å; F976-V980 HydrophobicContact CE1-CG2 3.98Å; F976-V980 HydrophobicContact CE2-CG2 3.93Å; F976-V980 HydrophobicContact CZ-CG2 3.69Å; F976-V980 WeakPolarHBondContact O-CG2 3.38Å; F976-V980 PolarHBondContact O-N 3.47Å
977	F	91.5	Very high	87.2	Confident	113 Å²	113	51.6 Å²	51.6	50%	0.496	27%	0.267	S	S	.	.	H	α-helix	trans	-59.8	-44.3	179.4	179.1	-105.7	0	0	0	112.4	F964 D973 G974 L979 V980 L981	F964-F977 HydrophobicContact CZ-CB 4.47Å; D973-F977 WeakPolarHBondContact O-CB 3.45Å; D973-F977 PolarHBondContact O-N 2.93Å; G974-F977 PolarHBondContact O-N 3.18Å; F977-L979 VanDerWaalsContact C-N 3.3Å; F977-L979 PolarHBondContact O-N 3.43Å; F977-V980 PolarHBondContact O-N 3.45Å; F977-L981 HydrophobicContact CD1-CD1 4.08Å; F977-L981 HydrophobicContact CE1-CD1 3.59Å; F977-L981 HydrophobicContact CE1-CG 4.24Å; F977-L981 HydrophobicContact CZ-CD1 4Å; F977-L981 HydrophobicContact CZ-CD2 4.39Å; F977-L981 HydrophobicContact CZ-CG 4.28Å; F977-L981 WeakPolarHBondContact O-CG 3.29Å; F977-L981 PolarHBondContact O-N 3.49Å
978	I	93.8	Very high	88.9	Confident	40 Å²	40	45.6 Å²	45.6	21%	0.205	25%	0.245	C	C	.	.	H	α-helix	trans	-62.2	-39	176	-63.4	165	0	0	0	110.8	G974 F976 L981 A982 V1022 L1025 I1029	G974-I978 WeakPolarHBondContact O-CD1 3.45Å; G974-I978 VanDerWaalsContact O-CG1 3.23Å; G974-I978 WeakPolarHBondContact O-CG1 3.42Å; G974-I978 PolarHBondContact O-N 2.95Å; F976-I978 PolarHBondContact O-N 2.97Å; I978-L981 PolarHBondContact O-N 2.93Å; I978-A982 PolarHBondContact O-N 2.84Å; I978-V1022 HydrophobicContact CG2-CG1 3.53Å; I978-V1022 VanDerWaalsContact O-CG1 3.31Å; I978-V1022 WeakPolarHBondContact O-CG1 3.33Å; I978-L1025 HydrophobicContact CD1-CD2 4.06Å; I978-L1025 HydrophobicContact CG2-CD2 3.92Å; I978-I1029 HydrophobicContact CD1-CD1 4.03Å
979	L	93.2	Very high	90.4	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-68.7	-35.6	176.8	-175.5	58.2	0	0	0	112.6	L924 V928 W933 F947 A975 F976 F977 A982 I983 T1023	L924-L979 HydrophobicContact CD2-CD1 4.23Å; V928-L979 HydrophobicContact CG2-CD2 3.49Å; V928-L979 VanDerWaalsContact CG2-CD2 3.49Å; V928-L979 HydrophobicContact CG2-CG 3.69Å; W933-L979 HydrophobicContact CH2-CD2 3.61Å; W933-L979 HydrophobicContact CZ2-CD2 3.62Å; F947-L979 HydrophobicContact CE2-CD2 3.83Å; F947-L979 HydrophobicContact CZ-CD2 4.25Å; A975-L979 WeakPolarHBondContact O-CB 3.47Å; A975-L979 PolarHBondContact O-N 2.87Å; A975-L979 VanDerWaalsContact O-N 3.09Å; F976-L979 WeakPolarHBondContact O-CB 3.46Å; F976-L979 PolarHBondContact O-N 2.75Å; F976-L979 VanDerWaalsContact O-N 3.12Å; F977-L979 VanDerWaalsContact C-N 3.3Å; F977-L979 PolarHBondContact O-N 3.43Å; L979-A982 WeakPolarHBondContact O-CB 3.43Å; L979-A982 PolarHBondContact O-N 3.17Å; L979-I983 WeakPolarHBondContact O-CG1 3.39Å; L979-I983 PolarHBondContact O-N 2.84Å; L979-T1023 HydrophobicContact CD1-CG2 4.34Å
980	V	94.3	Very high	91.6	Very high	47 Å²	47	40.7 Å²	40.7	29%	0.285	22%	0.223	S	C	.	.	H	α-helix	trans	-65.2	-41.3	171.6	172.7	0	0	0	0	111.1	F976 F977 A982 I983 L984	F976-V980 HydrophobicContact CD1-CG2 4.46Å; F976-V980 HydrophobicContact CD2-CG2 4.39Å; F976-V980 HydrophobicContact CE1-CG2 3.98Å; F976-V980 HydrophobicContact CE2-CG2 3.93Å; F976-V980 HydrophobicContact CZ-CG2 3.69Å; F976-V980 WeakPolarHBondContact O-CG2 3.38Å; F976-V980 PolarHBondContact O-N 3.47Å; F977-V980 PolarHBondContact O-N 3.45Å; V980-A982 VanDerWaalsContact C-N 3.32Å; V980-A982 PolarHBondContact O-N 2.95Å; V980-I983 WeakPolarHBondContact O-CB 3.44Å; V980-I983 PolarHBondContact O-N 3.25Å; V980-L984 HydrophobicContact CG1-CD1 4.41Å; V980-L984 WeakPolarHBondContact O-CG 3.4Å; V980-L984 PolarHBondContact O-N 3.29Å
981	L	94.7	Very high	92.4	Very high	71 Å²	71	41.7 Å²	41.7	37%	0.372	22%	0.221	S	C	.	.	H	α-helix	trans	-61	-39.4	172.6	-69.8	177	0	0	0	112.1	F977 I978 I983 L984 L985	F977-L981 HydrophobicContact CD1-CD1 4.08Å; F977-L981 HydrophobicContact CE1-CD1 3.59Å; F977-L981 HydrophobicContact CE1-CG 4.24Å; F977-L981 HydrophobicContact CZ-CD1 4Å; F977-L981 HydrophobicContact CZ-CD2 4.39Å; F977-L981 HydrophobicContact CZ-CG 4.28Å; F977-L981 WeakPolarHBondContact O-CG 3.29Å; F977-L981 PolarHBondContact O-N 3.49Å; I978-L981 PolarHBondContact O-N 2.93Å; L981-I983 VanDerWaalsContact C-N 3.33Å; L981-I983 PolarHBondContact O-N 3.49Å; L981-L984 PolarHBondContact O-N 2.9Å; L981-L985 WeakPolarHBondContact O-CG 3.32Å; L981-L985 PolarHBondContact O-N 3.4Å
982	A	95.4	Very high	92.9	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-61.9	-39.5	174.4	0	0	0	0	0	112.5	I978 L979 V980 L985 G986 V1022 T1023	I978-A982 PolarHBondContact O-N 2.84Å; L979-A982 WeakPolarHBondContact O-CB 3.43Å; L979-A982 PolarHBondContact O-N 3.17Å; V980-A982 VanDerWaalsContact C-N 3.32Å; V980-A982 PolarHBondContact O-N 2.95Å; A982-L985 PolarHBondContact O-N 2.69Å; A982-G986 PolarHBondContact O-N 2.94Å; A982-V1022 HydrophobicContact CB-CB 4.07Å; A982-V1022 HydrophobicContact CB-CG1 3.86Å; A982-T1023 WeakPolarHBondContact CB-OG1 3.37Å
983	I	95.5	Very high	93.2	Very high	17 Å²	17	40 Å²	40	9%	0.087	22%	0.216	C	C	.	.	H	α-helix	trans	-63.2	-45.8	174.8	-72.4	167.8	0	0	0	111.1	L924 V925 V928 L979 V980 L981 L985 G986 F987	L924-I983 HydrophobicContact CB-CD1 4Å; L924-I983 HydrophobicContact CB-CG1 3.56Å; L924-I983 HydrophobicContact CD1-CG1 4.07Å; L924-I983 HydrophobicContact CG-CG1 4.46Å; V925-I983 HydrophobicContact CG2-CD1 4.3Å; V925-I983 HydrophobicContact CG2-CG2 3.93Å; V928-I983 HydrophobicContact CB-CD1 4.32Å; V928-I983 HydrophobicContact CG2-CD1 3.62Å; L979-I983 WeakPolarHBondContact O-CG1 3.39Å; L979-I983 PolarHBondContact O-N 2.84Å; V980-I983 WeakPolarHBondContact O-CB 3.44Å; V980-I983 PolarHBondContact O-N 3.25Å; L981-I983 VanDerWaalsContact C-N 3.33Å; L981-I983 PolarHBondContact O-N 3.49Å; I983-L985 PolarHBondContact O-N 2.7Å; I983-G986 WeakPolarHBondContact O-CA 3.45Å; I983-G986 PolarHBondContact O-N 2.9Å; I983-G986 VanDerWaalsContact O-N 3.16Å; I983-F987 HydrophobicContact CG2-CD2 3.69Å; I983-F987 HydrophobicContact CG2-CE2 3.53Å; I983-F987 VanDerWaalsContact O-CD2 3.3Å; I983-F987 WeakPolarHBondContact O-CD2 3.4Å; I983-F987 PolarHBondContact O-N 3.12Å
984	L	96.4	Very high	93.6	Very high	105 Å²	105	42 Å²	42	55%	0.55	23%	0.229	S	C	.	.	H	α-helix	trans	-62.9	-41.2	178.2	-67.9	173.1	0	0	0	112.1	V980 L981 G986 F987 L988	V980-L984 HydrophobicContact CG1-CD1 4.41Å; V980-L984 WeakPolarHBondContact O-CG 3.4Å; V980-L984 PolarHBondContact O-N 3.29Å; L981-L984 PolarHBondContact O-N 2.9Å; L984-G986 VanDerWaalsContact C-N 3.34Å; L984-F987 PolarHBondContact O-N 3.49Å; L984-L988 WeakPolarHBondContact O-CB 3.41Å; L984-L988 PolarHBondContact O-N 2.98Å
985	L	95.6	Very high	93.7	Very high	52 Å²	52	41.9 Å²	41.9	27%	0.272	23%	0.225	S	C	.	.	H	α-helix	trans	-66.9	-34.3	173.2	-69	168.9	0	0	0	112.4	L981 A982 I983 L988 G989 V1018 A1019 V1022	L981-L985 WeakPolarHBondContact O-CG 3.32Å; L981-L985 PolarHBondContact O-N 3.4Å; A982-L985 PolarHBondContact O-N 2.69Å; I983-L985 PolarHBondContact O-N 2.7Å; L985-L988 HydrophobicContact CD2-CD2 4.48Å; L985-L988 PolarHBondContact O-N 2.91Å; L985-G989 PolarHBondContact O-N 3.4Å; L985-V1018 HydrophobicContact CD1-CG1 3.95Å; L985-A1019 HydrophobicContact CB-CB 3.89Å; L985-V1022 HydrophobicContact CD1-CG2 4.24Å
986	G	95.1	Very high	93.6	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-61.4	-48.6	171.8	0	0	0	0	0	112.1	A982 I983 L984 G989 L990 H1016	A982-G986 PolarHBondContact O-N 2.94Å; I983-G986 WeakPolarHBondContact O-CA 3.45Å; I983-G986 PolarHBondContact O-N 2.9Å; I983-G986 VanDerWaalsContact O-N 3.16Å; L984-G986 VanDerWaalsContact C-N 3.34Å; G986-G989 PolarHBondContact O-N 2.95Å; G986-L990 WeakPolarHBondContact O-CB 3.47Å; G986-L990 PolarHBondContact O-N 2.83Å; G986-H1016 PolarHBondContact O-CE1 3.26Å
987	F	95.8	Very high	93.4	Very high	89 Å²	89	44 Å²	44	39%	0.39	24%	0.235	S	C	.	.	H	α-helix	trans	-64.5	-40.3	174.3	-77.9	-63.4	0	0	0	112.5	V925 I983 L984 G989 L990 S991	V925-F987 HydrophobicContact CG2-CE2 4.04Å; V925-F987 HydrophobicContact CG2-CZ 4.22Å; I983-F987 HydrophobicContact CG2-CD2 3.69Å; I983-F987 HydrophobicContact CG2-CE2 3.53Å; I983-F987 VanDerWaalsContact O-CD2 3.3Å; I983-F987 WeakPolarHBondContact O-CD2 3.4Å; I983-F987 PolarHBondContact O-N 3.12Å; L984-F987 PolarHBondContact O-N 3.49Å; F987-G989 PolarHBondContact O-N 2.82Å; F987-L990 HydrophobicContact CD1-CD2 4.42Å; F987-L990 WeakPolarHBondContact O-CB 3.31Å; F987-L990 PolarHBondContact O-N 3.05Å; F987-S991 WeakPolarHBondContact O-CB 3.34Å; F987-S991 PolarHBondContact O-N 2.98Å; F987-S991 PolarHBondContact O-OG 3.32Å
988	L	95.5	Very high	93.2	Very high	93 Å²	93	44.7 Å²	44.7	49%	0.487	24%	0.243	S	C	.	.	H	α-helix	trans	-60.1	-47.2	175.6	-177.2	66.6	0	0	0	111.8	L984 L985 L990 S991 L992	L984-L988 WeakPolarHBondContact O-CB 3.41Å; L984-L988 PolarHBondContact O-N 2.98Å; L985-L988 HydrophobicContact CD2-CD2 4.48Å; L985-L988 PolarHBondContact O-N 2.91Å; L988-L990 VanDerWaalsContact C-N 3.31Å; L988-L990 PolarHBondContact O-N 3.25Å; L988-S991 PolarHBondContact O-N 3.35Å; L988-L992 HydrophobicContact CG-CD1 4.2Å; L988-L992 VanDerWaalsContact O-CG 3.31Å; L988-L992 WeakPolarHBondContact O-CG 3.31Å; L988-L992 PolarHBondContact O-N 3.08Å
989	G	94.3	Very high	92.8	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-62	-37.3	175.7	0	0	0	0	0	113	L985 G986 F987 S993 H1016	L985-G989 PolarHBondContact O-N 3.4Å; G986-G989 PolarHBondContact O-N 2.95Å; F987-G989 PolarHBondContact O-N 2.82Å; G989-S993 WeakPolarHBondContact O-CB 3.44Å; G989-S993 PolarHBondContact O-N 2.74Å; G989-S993 PolarHBondContact O-OG 3.12Å; G989-H1016 VanDerWaalsContact C-NE2 3.27Å
990	L	94.4	Very high	91.8	Very high	31 Å²	31	54.8 Å²	54.8	16%	0.162	28%	0.284	C	S	.	.	H	α-helix	trans	-66.3	-47	175.4	-176.1	65	0	0	0	111.3	V914 A917 G986 F987 L988 S993 V994 H1016	V914-L990 HydrophobicContact CG1-CD1 3.98Å; A917-L990 HydrophobicContact CB-CD1 4.06Å; G986-L990 WeakPolarHBondContact O-CB 3.47Å; G986-L990 PolarHBondContact O-N 2.83Å; F987-L990 HydrophobicContact CD1-CD2 4.42Å; F987-L990 WeakPolarHBondContact O-CB 3.31Å; F987-L990 PolarHBondContact O-N 3.05Å; L988-L990 VanDerWaalsContact C-N 3.31Å; L988-L990 PolarHBondContact O-N 3.25Å; L990-S993 PolarHBondContact O-N 3.21Å; L990-V994 WeakPolarHBondContact O-CG2 3.45Å; L990-V994 PolarHBondContact O-N 2.85Å; L990-H1016 PolarHBondContact N-CE1 3.02Å; L990-H1016 PolarHBondContact N-NE2 3.48Å
991	S	94.6	Very high	90.9	Very high	77 Å²	77	54.7 Å²	54.7	54%	0.538	29%	0.288	S	S	.	.	H	α-helix	trans	-61	-43.8	176.9	-66.8	0	0	0	0	112.4	F987 L988 V994 A995	F987-S991 WeakPolarHBondContact O-CB 3.34Å; F987-S991 PolarHBondContact O-N 2.98Å; F987-S991 PolarHBondContact O-OG 3.32Å; L988-S991 PolarHBondContact O-N 3.35Å; S991-V994 PolarHBondContact O-N 3.43Å; S991-A995 WeakPolarHBondContact O-CB 3.33Å; S991-A995 PolarHBondContact O-N 3.18Å
992	L	93.5	Very high	89.9	Confident	37 Å²	37	53.7 Å²	53.7	19%	0.194	28%	0.283	C	S	.	.	H	α-helix	trans	-62.2	-43.2	174.1	-70.2	168	0	0	0	111.5	L988 V994 A995 G996 Y1008	L988-L992 HydrophobicContact CG-CD1 4.2Å; L988-L992 VanDerWaalsContact O-CG 3.31Å; L988-L992 WeakPolarHBondContact O-CG 3.31Å; L988-L992 PolarHBondContact O-N 3.08Å; L992-V994 VanDerWaalsContact C-N 3.35Å; L992-V994 PolarHBondContact O-N 3.33Å; L992-A995 PolarHBondContact O-N 2.84Å; L992-G996 PolarHBondContact O-N 3.05Å; L992-Y1008 HydrophobicContact CD2-CD1 3.89Å; L992-Y1008 HydrophobicContact CD2-CE1 4.13Å
993	S	91.4	Very high	89	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-65.8	-36.4	178.2	-56.4	0	0	0	0	112.4	G989 L990 G996 H997 F1009 L1067	G989-S993 WeakPolarHBondContact O-CB 3.44Å; G989-S993 PolarHBondContact O-N 2.74Å; G989-S993 PolarHBondContact O-OG 3.12Å; L990-S993 PolarHBondContact O-N 3.21Å; S993-G996 PolarHBondContact O-N 3.2Å; S993-H997 PolarHBondContact O-CD2 3.32Å; S993-H997 PolarHBondContact O-N 2.98Å; S993-F1009 VanDerWaalsContact O-CE1 3.29Å; S993-F1009 WeakPolarHBondContact O-CE1 3.48Å; S993-L1067 WeakPolarHBondContact OG-CD1 3.41Å
994	V	92.7	Very high	88.3	Confident	63 Å²	63	59 Å²	59	38%	0.382	31%	0.313	S	S	.	.	H	α-helix	trans	-69	-41	173.1	171	0	0	0	0	111.3	V914 L990 S991 L992 G996 H997 L998	V914-V994 HydrophobicContact CG1-CG2 4.06Å; L990-V994 WeakPolarHBondContact O-CG2 3.45Å; L990-V994 PolarHBondContact O-N 2.85Å; S991-V994 PolarHBondContact O-N 3.43Å; L992-V994 VanDerWaalsContact C-N 3.35Å; L992-V994 PolarHBondContact O-N 3.33Å; V994-G996 PolarHBondContact O-N 3.37Å; V994-H997 WeakPolarHBondContact O-CA 3.34Å; V994-H997 WeakPolarHBondContact O-CB 3.26Å; V994-H997 PolarHBondContact O-N 3.31Å; V994-L998 PolarHBondContact O-N 3.03Å
995	A	90.8	Very high	87.7	Confident	26 Å²	26	55.4 Å²	55.4	22%	0.215	29%	0.292	C	S	.	.	H	α-helix	trans	-59.2	-36.5	172.9	0	0	0	0	0	112.1	S991 L992 H997 L998 V999 Y1008	S991-A995 WeakPolarHBondContact O-CB 3.33Å; S991-A995 PolarHBondContact O-N 3.18Å; L992-A995 PolarHBondContact O-N 2.84Å; A995-H997 PolarHBondContact O-N 2.72Å; A995-L998 PolarHBondContact O-N 3.42Å; A995-V999 WeakPolarHBondContact O-CG2 3.39Å; A995-V999 PolarHBondContact O-N 3.35Å; A995-Y1008 HydrophobicContact CB-CD1 4.11Å; A995-Y1008 HydrophobicContact CB-CE1 4.29Å; A995-Y1008 HydrophobicContact CB-CG 4.35Å
996	G	87	Confident	87.1	Confident	0 Å²	0	54.9 Å²	54.9	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-61.4	-20.8	170.4	0	0	0	0	0	114.8	L992 S993 V994 R1005 F1009	L992-G996 PolarHBondContact O-N 3.05Å; S993-G996 PolarHBondContact O-N 3.2Å; V994-G996 PolarHBondContact O-N 3.37Å; G996-R1005 VanDerWaalsContact O-CG 3.28Å; G996-R1005 WeakPolarHBondContact O-CG 3.42Å; G996-R1005 PolarHBondContact O-NE 3.48Å; G996-F1009 VanDerWaalsContact O-CE2 3.28Å; G996-F1009 WeakPolarHBondContact O-CE2 3.47Å; G996-F1009 WeakPolarHBondContact O-CZ 3.36Å
997	H	86.4	Confident	86.7	Confident	62 Å²	62	60.6 Å²	60.6	29%	0.287	31%	0.312	S	S	.	.	H	α-helix	trans	-86	-22.2	170.8	-81.2	-77.9	0	0	0	113.8	S993 V994 A995 F1009	S993-H997 PolarHBondContact O-CD2 3.32Å; S993-H997 PolarHBondContact O-N 2.98Å; V994-H997 WeakPolarHBondContact O-CA 3.34Å; V994-H997 WeakPolarHBondContact O-CB 3.26Å; V994-H997 PolarHBondContact O-N 3.31Å; A995-H997 PolarHBondContact O-N 2.72Å; H997-F1009 AromaticContact CD2-CE1 3.53Å; H997-F1009 AromaticContact CD2-CZ 3.68Å; H997-F1009 AromaticContact CE1-CZ 3.96Å; H997-F1009 AromaticContact NE2-CE1 3.55Å; H997-F1009 AromaticContact NE2-CZ 3.65Å
998	L	87.4	Confident	86.5	Confident	128 Å²	128	59.8 Å²	59.8	67%	0.67	31%	0.307	S	S	*	.	H	α-helix	trans	-87.8	-34.3	-179.8	-61.8	175.3	0	0	0	113	V994 A995 Y1000	V994-L998 PolarHBondContact O-N 3.03Å; A995-L998 PolarHBondContact O-N 3.42Å; L998-Y1000 PolarHBondContact O-N 3.32Å
999	V	83.9	Confident	86.2	Confident	39 Å²	39	55.4 Å²	55.4	24%	0.236	28%	0.284	C	S	.	.			trans	-81.4	115	-172.6	175.6	0	0	0	0	112.1	A995 A1001 K1004 R1005 Y1008	A995-V999 WeakPolarHBondContact O-CG2 3.39Å; A995-V999 PolarHBondContact O-N 3.35Å; V999-A1001 HydrophobicContact CG1-CB 4.33Å; V999-A1001 PolarHBondContact O-N 2.99Å; V999-K1004 HydrophobicContact CG1-CB 3.57Å; V999-K1004 HydrophobicContact CG1-CD 4.14Å; V999-K1004 HydrophobicContact CG1-CG 4.45Å; V999-R1005 WeakPolarHBondContact O-CD 3.35Å; V999-Y1008 HydrophobicContact CB-CD2 4.49Å; V999-Y1008 HydrophobicContact CG2-CD2 4.22Å; V999-Y1008 HydrophobicContact CG2-CE2 3.88Å
1000	Y	72.5	Confident	86	Confident	214 Å²	214	57 Å²	57	84%	0.839	29%	0.291	S	S	*	.			trans	-63.1	-34.3	179.4	-64.5	-79.7	0	0	0	114.5	L998 L1002	L998-Y1000 PolarHBondContact O-N 3.32Å; Y1000-L1002 PolarHBondContact O-N 2.94Å; Y1000-L1002 VanDerWaalsContact O-N 3.1Å
1001	A	76.6	Confident	85.9	Confident	45 Å²	45	56.9 Å²	56.9	37%	0.372	29%	0.293	S	S	.	.			trans	-72.1	105.6	-173.8	0	0	0	0	0	112.2	V999 P1003 K1004 R1005	V999-A1001 HydrophobicContact CG1-CB 4.33Å; V999-A1001 PolarHBondContact O-N 2.99Å; A1001-P1003 VanDerWaalsContact C-CD 3.46Å; A1001-P1003 VanDerWaalsContact O-N 3.11Å; A1001-K1004 HydrophobicContact CB-CB 4.24Å; A1001-K1004 HydrophobicContact CB-CD 4.31Å; A1001-K1004 HydrophobicContact CB-CG 4.34Å; A1001-K1004 WeakPolarHBondContact O-CA 3.46Å; A1001-K1004 WeakPolarHBondContact O-CB 3.47Å; A1001-K1004 PolarHBondContact O-N 3.01Å; A1001-R1005 WeakPolarHBondContact O-CB 3.43Å; A1001-R1005 PolarHBondContact O-N 3.05Å
1002	L	72.4	Confident	85.8	Confident	50 Å²	50	53.2 Å²	53.2	26%	0.262	27%	0.267	S	S	.	.	H	α-helix	trans	-39.1	-47	-179.1	-73.9	165.1	0	0	0	116.4	A898 W901 Y1000 R1005 L1006	A898-L1002 HydrophobicContact CB-CD1 3.53Å; W901-L1002 HydrophobicContact CB-CD2 4.48Å; Y1000-L1002 PolarHBondContact O-N 2.94Å; Y1000-L1002 VanDerWaalsContact O-N 3.1Å; L1002-R1005 WeakPolarHBondContact O-CB 3.44Å; L1002-R1005 PolarHBondContact O-N 3.34Å; L1002-L1006 WeakPolarHBondContact O-CB 3.19Å; L1002-L1006 PolarHBondContact O-N 3.32Å
1003	P	76.7	Confident	85.8	Confident	77 Å²	77	51.5 Å²	51.5	50%	0.5	26%	0.258	S	S	.	.	H	α-helix	trans	-71.2	-38.2	177.8	26.5	-34.2	0	0	0	113.6	A1001 Y1007	A1001-P1003 VanDerWaalsContact C-CD 3.46Å; A1001-P1003 VanDerWaalsContact O-N 3.11Å; P1003-Y1007 WeakPolarHBondContact O-CB 3.46Å; P1003-Y1007 PolarHBondContact O-N 3.48Å
1004	K	81.7	Confident	85.9	Confident	51 Å²	51	56.3 Å²	56.3	22%	0.222	28%	0.281	C	S	.	.	H	α-helix	trans	-62.1	-47.5	171.5	-73.5	-176.4	176.8	-177	0	109	A17 D22 V999 A1001 L1006 Y1007 Y1008	A17-K1004 HydrophobicContact CB-CD 4.48Å; A17-K1004 HydrophobicContact CB-CG 3.71Å; A17-K1004 WeakPolarHBondContact O-CE 3.16Å; D22-K1004 IonicContact OD1-NZ 3.08Å; D22-K1004 PolarHBondContact OD1-NZ 3.38Å; D22-K1004 VanDerWaalsContact OD1-NZ 3.08Å; V999-K1004 HydrophobicContact CG1-CB 3.57Å; V999-K1004 HydrophobicContact CG1-CD 4.14Å; V999-K1004 HydrophobicContact CG1-CG 4.45Å; A1001-K1004 HydrophobicContact CB-CB 4.24Å; A1001-K1004 HydrophobicContact CB-CD 4.31Å; A1001-K1004 HydrophobicContact CB-CG 4.34Å; A1001-K1004 WeakPolarHBondContact O-CA 3.46Å; A1001-K1004 WeakPolarHBondContact O-CB 3.47Å; A1001-K1004 PolarHBondContact O-N 3.01Å; K1004-L1006 PolarHBondContact O-N 3.46Å; K1004-Y1007 WeakPolarHBondContact O-CB 3.42Å; K1004-Y1007 PolarHBondContact O-N 2.84Å; K1004-Y1008 HydrophobicContact CB-CE2 4.41Å; K1004-Y1008 WeakPolarHBondContact O-CD2 3.32Å; K1004-Y1008 PolarHBondContact O-N 3.03Å
1005	R	83.4	Confident	86.1	Confident	30 Å²	30	54 Å²	54	11%	0.113	27%	0.268	C	S	.	.	H	α-helix	trans	-55.9	-49.1	178.5	177	159.9	-167.8	-134.2	3.8	113.6	D902 G996 V999 A1001 L1002 Y1008 F1009	D902-R1005 IonicContact OD1-CZ 3.65Å; D902-R1005 IonicContact OD1-NH1 2.74Å; D902-R1005 PolarHBondContact OD1-NH1 3.36Å; D902-R1005 IonicContact OD1-NH2 2.68Å; D902-R1005 IonicContact OD2-NH1 3.67Å; G996-R1005 VanDerWaalsContact O-CG 3.28Å; G996-R1005 WeakPolarHBondContact O-CG 3.42Å; G996-R1005 PolarHBondContact O-NE 3.48Å; V999-R1005 WeakPolarHBondContact O-CD 3.35Å; A1001-R1005 WeakPolarHBondContact O-CB 3.43Å; A1001-R1005 PolarHBondContact O-N 3.05Å; L1002-R1005 WeakPolarHBondContact O-CB 3.44Å; L1002-R1005 PolarHBondContact O-N 3.34Å; R1005-Y1008 PolarHBondContact O-N 2.84Å; R1005-F1009 HydrophobicContact CG-CD2 4.07Å; R1005-F1009 HydrophobicContact CG-CE2 3.59Å; R1005-F1009 WeakPolarHBondContact O-CD2 3.17Å; R1005-F1009 PolarHBondContact O-N 3.26Å
1006	L	82.6	Confident	86.3	Confident	40 Å²	40	52.7 Å²	52.7	21%	0.209	26%	0.258	C	S	.	.	H	α-helix	trans	-66.7	-36.6	178.5	-173.1	65.7	0	0	0	112.1	W10 L1002 K1004 F1009 H1010 D1070	W10-L1006 HydrophobicContact CH2-CD2 3.84Å; W10-L1006 HydrophobicContact CH2-CG 4.08Å; L1002-L1006 WeakPolarHBondContact O-CB 3.19Å; L1002-L1006 PolarHBondContact O-N 3.32Å; K1004-L1006 PolarHBondContact O-N 3.46Å; L1006-F1009 PolarHBondContact O-N 2.05Å; L1006-H1010 WeakPolarHBondContact O-CB 3.43Å; L1006-H1010 PolarHBondContact O-N 2.85Å; L1006-D1070 HydrophobicContact CD1-CB 4.08Å
1007	Y	87.4	Confident	86.7	Confident	120 Å²	120	56.2 Å²	56.2	47%	0.471	28%	0.279	S	S	.	.	H	α-helix	trans	-62.4	-43.7	174.2	175.3	-99.4	0	0	0	112.1	P1003 K1004 F1009 H1010 S1011	P1003-Y1007 WeakPolarHBondContact O-CB 3.46Å; P1003-Y1007 PolarHBondContact O-N 3.48Å; K1004-Y1007 WeakPolarHBondContact O-CB 3.42Å; K1004-Y1007 PolarHBondContact O-N 2.84Å; Y1007-F1009 PolarHBondContact O-N 3.38Å; Y1007-H1010 PolarHBondContact O-N 2.81Å; Y1007-S1011 WeakPolarHBondContact O-CB 3.23Å; Y1007-S1011 PolarHBondContact O-N 3.1Å
1008	Y	90.7	Very high	87.2	Confident	73 Å²	73	56.7 Å²	56.7	29%	0.286	29%	0.286	S	S	.	.	H	α-helix	trans	-61.2	-43.3	175.9	-78.5	-62.1	0	0	0	113	L992 A995 V999 K1004 R1005 G1012	L992-Y1008 HydrophobicContact CD2-CD1 3.89Å; L992-Y1008 HydrophobicContact CD2-CE1 4.13Å; A995-Y1008 HydrophobicContact CB-CD1 4.11Å; A995-Y1008 HydrophobicContact CB-CE1 4.29Å; A995-Y1008 HydrophobicContact CB-CG 4.35Å; V999-Y1008 HydrophobicContact CB-CD2 4.49Å; V999-Y1008 HydrophobicContact CG2-CD2 4.22Å; V999-Y1008 HydrophobicContact CG2-CE2 3.88Å; K1004-Y1008 HydrophobicContact CB-CE2 4.41Å; K1004-Y1008 WeakPolarHBondContact O-CD2 3.32Å; K1004-Y1008 PolarHBondContact O-N 3.03Å; R1005-Y1008 PolarHBondContact O-N 2.84Å; Y1008-G1012 PolarHBondContact O-N 2.87Å
1009	F	89.6	Confident	87.6	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-67.6	-38.9	175.6	-68.6	-54.2	0	0	0	113.1	R910 S993 G996 H997 R1005 L1006 Y1007 G1013 L1067	R910-F1009 HydrophobicContact CB-CE1 4.24Å; R910-F1009 HydrophobicContact CB-CZ 4.38Å; R910-F1009 HydrophobicContact CG-CE1 4.45Å; R910-F1009 HydrophobicContact CG-CZ 4.5Å; S993-F1009 VanDerWaalsContact O-CE1 3.29Å; S993-F1009 WeakPolarHBondContact O-CE1 3.48Å; G996-F1009 VanDerWaalsContact O-CE2 3.28Å; G996-F1009 WeakPolarHBondContact O-CE2 3.47Å; G996-F1009 WeakPolarHBondContact O-CZ 3.36Å; H997-F1009 AromaticContact CD2-CE1 3.53Å; H997-F1009 AromaticContact CD2-CZ 3.68Å; H997-F1009 AromaticContact CE1-CZ 3.96Å; H997-F1009 AromaticContact NE2-CE1 3.55Å; H997-F1009 AromaticContact NE2-CZ 3.65Å; R1005-F1009 HydrophobicContact CG-CD2 4.07Å; R1005-F1009 HydrophobicContact CG-CE2 3.59Å; R1005-F1009 WeakPolarHBondContact O-CD2 3.17Å; R1005-F1009 PolarHBondContact O-N 3.26Å; L1006-F1009 PolarHBondContact O-N 2.05Å; Y1007-F1009 PolarHBondContact O-N 3.38Å; F1009-G1013 PolarHBondContact O-N 2.79Å; F1009-L1067 HydrophobicContact CB-CD2 4.43Å; F1009-L1067 HydrophobicContact CD1-CD2 3.75Å; F1009-L1067 HydrophobicContact CG-CD2 4.48Å
1010	H	90.2	Very high	88.2	Confident	35 Å²	35	48.9 Å²	48.9	16%	0.162	24%	0.244	C	C	.	.	H	α-helix	trans	-63.3	-51	176.2	179	44.8	0	0	0	111.2	L1006 Y1007 G1013 E1014 L1068 E1071	L1006-H1010 WeakPolarHBondContact O-CB 3.43Å; L1006-H1010 PolarHBondContact O-N 2.85Å; Y1007-H1010 PolarHBondContact O-N 2.81Å; H1010-G1013 WeakPolarHBondContact O-CA 3.41Å; H1010-G1013 PolarHBondContact O-N 3.35Å; H1010-E1014 IonicContact CE1-OE1 2.69Å; H1010-E1014 PolarHBondContact O-N 3.32Å; H1010-L1068 WeakPolarHBondContact ND1-CD2 3.3Å; H1010-E1071 IonicContact CE1-OE2 2.7Å; H1010-E1071 PolarHBondContact CE1-OE2 3.29Å; H1010-E1071 VanDerWaalsContact CE1-OE2 3.31Å; H1010-E1071 IonicContact ND1-OE2 3.17Å
1011	S	92.6	Very high	89.3	Confident	28 Å²	28	45.2 Å²	45.2	20%	0.196	23%	0.232	C	C	.	.	H	α-helix	trans	-66.3	-38.5	179.2	-174.6	0	0	0	0	112.7	Y1007 G1013 E1014 A1015	Y1007-S1011 WeakPolarHBondContact O-CB 3.23Å; Y1007-S1011 PolarHBondContact O-N 3.1Å; S1011-G1013 VanDerWaalsContact C-N 3.33Å; S1011-G1013 PolarHBondContact O-N 3.44Å; S1011-E1014 PolarHBondContact O-N 2.92Å; S1011-A1015 WeakPolarHBondContact O-CB 3.43Å; S1011-A1015 PolarHBondContact O-N 2.68Å
1012	G	93	Very high	90.3	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-63.1	-38.1	171.2	0	0	0	0	0	112.7	Y1008 A1015 H1016	Y1008-G1012 PolarHBondContact O-N 2.87Å; G1012-A1015 PolarHBondContact O-N 2.88Å; G1012-H1016 PolarHBondContact O-CD2 3.23Å; G1012-H1016 PolarHBondContact O-N 3.39Å
1013	G	93.2	Very high	91.4	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.8	-49.7	172.1	0	0	0	0	0	112.6	F1009 H1010 S1011 H1016 V1017 A1064	F1009-G1013 PolarHBondContact O-N 2.79Å; H1010-G1013 WeakPolarHBondContact O-CA 3.41Å; H1010-G1013 PolarHBondContact O-N 3.35Å; S1011-G1013 VanDerWaalsContact C-N 3.33Å; S1011-G1013 PolarHBondContact O-N 3.44Å; G1013-H1016 PolarHBondContact O-N 3.1Å; G1013-V1017 PolarHBondContact O-N 2.82Å; G1013-A1064 WeakPolarHBondContact O-CB 3.39Å
1014	E	93.8	Very high	92.3	Very high	102 Å²	102	39.4 Å²	39.4	48%	0.477	20%	0.196	S	C	.	.	H	α-helix	trans	-58.9	-46.2	174.9	-70.2	-173.3	135.3	0	0	112	H1010 S1011 H1016 V1017 V1018	H1010-E1014 IonicContact CE1-OE1 2.69Å; H1010-E1014 PolarHBondContact O-N 3.32Å; S1011-E1014 PolarHBondContact O-N 2.92Å; E1014-H1016 VanDerWaalsContact C-N 3.26Å; E1014-H1016 PolarHBondContact O-N 3.49Å; E1014-V1017 WeakPolarHBondContact O-CB 3.36Å; E1014-V1017 PolarHBondContact O-N 3.26Å; E1014-V1018 PolarHBondContact O-N 3.33Å
1015	A	95.4	Very high	92.9	Very high	13 Å²	13	40.2 Å²	40.2	11%	0.107	20%	0.202	C	C	.	.	H	α-helix	trans	-57.6	-38.3	176.6	0	0	0	0	0	112.2	S1011 G1012 V1018 A1019	S1011-A1015 WeakPolarHBondContact O-CB 3.43Å; S1011-A1015 PolarHBondContact O-N 2.68Å; G1012-A1015 PolarHBondContact O-N 2.88Å; A1015-V1018 PolarHBondContact O-N 3.13Å; A1015-A1019 WeakPolarHBondContact O-CB 3.31Å; A1015-A1019 PolarHBondContact O-N 2.92Å
1016	H	95.7	Very high	93.4	Very high	0 Å²	0	39 Å²	39	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-72	-29.7	173.7	-72.9	-47.5	0	0	0	114.2	A917 G986 G989 L990 G1012 G1013 E1014 A1020 H1060 A1064	A917-H1016 VanDerWaalsContact CB-NE2 3.34Å; A917-H1016 WeakPolarHBondContact CB-NE2 3.41Å; G986-H1016 PolarHBondContact O-CE1 3.26Å; G989-H1016 VanDerWaalsContact C-NE2 3.27Å; L990-H1016 PolarHBondContact N-CE1 3.02Å; L990-H1016 PolarHBondContact N-NE2 3.48Å; G1012-H1016 PolarHBondContact O-CD2 3.23Å; G1012-H1016 PolarHBondContact O-N 3.39Å; G1013-H1016 PolarHBondContact O-N 3.1Å; E1014-H1016 VanDerWaalsContact C-N 3.26Å; E1014-H1016 PolarHBondContact O-N 3.49Å; H1016-A1020 WeakPolarHBondContact O-CB 3.43Å; H1016-A1020 PolarHBondContact O-N 2.69Å; H1016-H1060 AromaticContact CE1-ND1 3.97Å; H1016-H1060 AromaticContact ND1-CE1 3.86Å; H1016-H1060 AromaticContact ND1-ND1 3.34Å; H1016-H1060 PolarHBondContact ND1-ND1 3.44Å; H1016-A1064 HydrophobicContact CB-CB 3.9Å
1017	V	95.7	Very high	93.9	Very high	73 Å²	73	37.1 Å²	37.1	44%	0.442	19%	0.188	S	C	.	.	H	α-helix	trans	-63.2	-46	168.7	-179.4	0	0	0	0	110.2	G1013 E1014 A1020 F1021 A1064 L1068	G1013-V1017 PolarHBondContact O-N 2.82Å; E1014-V1017 WeakPolarHBondContact O-CB 3.36Å; E1014-V1017 PolarHBondContact O-N 3.26Å; V1017-A1020 PolarHBondContact O-N 2.83Å; V1017-F1021 PolarHBondContact O-N 3.46Å; V1017-A1064 HydrophobicContact CG2-CB 3.64Å; V1017-L1068 HydrophobicContact CG2-CD1 4.07Å
1018	V	96.4	Very high	94.2	Very high	73 Å²	73	35.6 Å²	35.6	44%	0.442	19%	0.188	S	C	.	.	H	α-helix	trans	-66.2	-45.8	179	-175.3	0	0	0	0	110.7	L985 E1014 A1015 A1020 F1021 V1022	L985-V1018 HydrophobicContact CD1-CG1 3.95Å; E1014-V1018 PolarHBondContact O-N 3.33Å; A1015-V1018 PolarHBondContact O-N 3.13Å; V1018-A1020 VanDerWaalsContact C-N 3.3Å; V1018-A1020 PolarHBondContact O-N 3.38Å; V1018-F1021 PolarHBondContact O-N 2.93Å; V1018-F1021 VanDerWaalsContact O-N 3.12Å; V1018-V1022 HydrophobicContact CG1-CG2 4.07Å; V1018-V1022 VanDerWaalsContact O-CG2 3.28Å; V1018-V1022 WeakPolarHBondContact O-CG2 3.05Å; V1018-V1022 PolarHBondContact O-N 2.83Å
1019	A	96.1	Very high	94.3	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-56.7	-42.7	175.9	0	0	0	0	0	112.2	L985 A1015 T1023	L985-A1019 HydrophobicContact CB-CB 3.89Å; A1015-A1019 WeakPolarHBondContact O-CB 3.31Å; A1015-A1019 PolarHBondContact O-N 2.92Å; A1019-T1023 WeakPolarHBondContact O-CB 3.39Å; A1019-T1023 PolarHBondContact O-N 3.18Å; A1019-T1023 PolarHBondContact O-OG1 2.84Å
1020	A	96.3	Very high	94.3	Very high	2 Å²	2	35.4 Å²	35.4	2%	0.017	19%	0.19	C	C	.	.	H	α-helix	trans	-64.5	-43.9	174.3	0	0	0	0	0	112.7	H1016 V1017 V1018 T1023 A1024 C1057 H1060 I1061	H1016-A1020 WeakPolarHBondContact O-CB 3.43Å; H1016-A1020 PolarHBondContact O-N 2.69Å; V1017-A1020 PolarHBondContact O-N 2.83Å; V1018-A1020 VanDerWaalsContact C-N 3.3Å; V1018-A1020 PolarHBondContact O-N 3.38Å; A1020-T1023 WeakPolarHBondContact O-CB 3.45Å; A1020-T1023 PolarHBondContact O-N 3.18Å; A1020-A1024 WeakPolarHBondContact O-CB 3.45Å; A1020-A1024 PolarHBondContact O-N 3.38Å; A1020-C1057 PolarHBondContact O-SG 3.21Å; A1020-H1060 HydrophobicContact CB-CB 3.86Å; A1020-I1061 HydrophobicContact CB-CD1 4.3Å; A1020-I1061 HydrophobicContact CB-CG1 3.58Å
1021	F	96.3	Very high	94.3	Very high	137 Å²	137	35.5 Å²	35.5	60%	0.601	19%	0.191	S	C	*	.	H	α-helix	trans	-62.7	-44.5	178	179.2	-97.9	0	0	0	112	V1017 V1018 A1024 L1025	V1017-F1021 PolarHBondContact O-N 3.46Å; V1018-F1021 PolarHBondContact O-N 2.93Å; V1018-F1021 VanDerWaalsContact O-N 3.12Å; F1021-A1024 PolarHBondContact O-N 3.2Å; F1021-L1025 HydrophobicContact CE1-CD1 4.14Å; F1021-L1025 HydrophobicContact CZ-CD1 4.29Å; F1021-L1025 WeakPolarHBondContact O-CB 3.45Å; F1021-L1025 PolarHBondContact O-N 2.96Å
1022	V	96.3	Very high	94.2	Very high	26 Å²	26	38 Å²	38	16%	0.158	20%	0.201	C	C	.	.	H	α-helix	trans	-66	-39.1	177.4	179.8	0	0	0	0	110.8	I978 A982 L985 V1018 L1025 S1026	I978-V1022 HydrophobicContact CG2-CG1 3.53Å; I978-V1022 VanDerWaalsContact O-CG1 3.31Å; I978-V1022 WeakPolarHBondContact O-CG1 3.33Å; A982-V1022 HydrophobicContact CB-CB 4.07Å; A982-V1022 HydrophobicContact CB-CG1 3.86Å; L985-V1022 HydrophobicContact CD1-CG2 4.24Å; V1018-V1022 HydrophobicContact CG1-CG2 4.07Å; V1018-V1022 VanDerWaalsContact O-CG2 3.28Å; V1018-V1022 WeakPolarHBondContact O-CG2 3.05Å; V1018-V1022 PolarHBondContact O-N 2.83Å; V1022-L1025 PolarHBondContact O-N 2.98Å; V1022-S1026 PolarHBondContact O-N 3.03Å; V1022-S1026 PolarHBondContact O-OG 2.93Å
1023	T	96.2	Very high	94	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-58.8	-53	170.6	-56.2	0	0	0	0	111.2	L924 L979 A982 A1019 A1020 L1025 S1026 V1027 C1057	L924-T1023 HydrophobicContact CD2-CG2 3.69Å; L979-T1023 HydrophobicContact CD1-CG2 4.34Å; A982-T1023 WeakPolarHBondContact CB-OG1 3.37Å; A1019-T1023 WeakPolarHBondContact O-CB 3.39Å; A1019-T1023 PolarHBondContact O-N 3.18Å; A1019-T1023 PolarHBondContact O-OG1 2.84Å; A1020-T1023 WeakPolarHBondContact O-CB 3.45Å; A1020-T1023 PolarHBondContact O-N 3.18Å; T1023-L1025 PolarHBondContact O-N 2.91Å; T1023-S1026 PolarHBondContact O-N 2.98Å; T1023-S1026 PolarHBondContact O-OG 2.94Å; T1023-V1027 HydrophobicContact CG2-CG2 4.27Å; T1023-V1027 WeakPolarHBondContact O-CB 3.43Å; T1023-V1027 WeakPolarHBondContact O-CG2 3.29Å; T1023-V1027 PolarHBondContact O-N 3.45Å; T1023-C1057 HydrophobicContact CG2-CB 3.9Å
1024	A	96	Very high	93.6	Very high	25 Å²	25	38.8 Å²	38.8	21%	0.207	21%	0.206	C	C	.	.	H	α-helix	trans	-58.9	-37.2	-179.9	0	0	0	0	0	111.5	A1020 F1021 L1028 W1054	A1020-A1024 WeakPolarHBondContact O-CB 3.45Å; A1020-A1024 PolarHBondContact O-N 3.38Å; F1021-A1024 PolarHBondContact O-N 3.2Å; A1024-L1028 WeakPolarHBondContact O-CB 3.48Å; A1024-L1028 PolarHBondContact O-N 3.03Å; A1024-W1054 HydrophobicContact CB-CZ3 4.41Å
1025	L	94.9	Very high	93.2	Very high	68 Å²	68	40.2 Å²	40.2	36%	0.356	21%	0.211	S	C	.	.	H	α-helix	trans	-68.6	-45.8	177.9	-174.1	140.7	0	0	0	112.4	I978 F1021 V1022 T1023 V1027 L1028 I1029	I978-L1025 HydrophobicContact CD1-CD2 4.06Å; I978-L1025 HydrophobicContact CG2-CD2 3.92Å; F1021-L1025 HydrophobicContact CE1-CD1 4.14Å; F1021-L1025 HydrophobicContact CZ-CD1 4.29Å; F1021-L1025 WeakPolarHBondContact O-CB 3.45Å; F1021-L1025 PolarHBondContact O-N 2.96Å; V1022-L1025 PolarHBondContact O-N 2.98Å; T1023-L1025 PolarHBondContact O-N 2.91Å; L1025-V1027 VanDerWaalsContact C-N 3.34Å; L1025-V1027 PolarHBondContact O-N 3.42Å; L1025-L1028 PolarHBondContact O-N 3.49Å; L1025-I1029 HydrophobicContact CD2-CD1 3.57Å; L1025-I1029 HydrophobicContact CG-CD1 4.18Å; L1025-I1029 WeakPolarHBondContact O-CB 3.08Å; L1025-I1029 VanDerWaalsContact O-CG1 3.26Å; L1025-I1029 WeakPolarHBondContact O-CG1 3.45Å; L1025-I1029 PolarHBondContact O-N 3.15Å
1026	S	93.6	Very high	92.6	Very high	3 Å²	3	45.3 Å²	45.3	2%	0.021	24%	0.235	C	C	.	.	H	α-helix	trans	-61.8	-42.5	175.6	60.7	0	0	0	0	112.1	A975 V1022 T1023 I1029 Y1030	A975-S1026 WeakPolarHBondContact O-CB 3.35Å; V1022-S1026 PolarHBondContact O-N 3.03Å; V1022-S1026 PolarHBondContact O-OG 2.93Å; T1023-S1026 PolarHBondContact O-N 2.98Å; T1023-S1026 PolarHBondContact O-OG 2.94Å; S1026-I1029 PolarHBondContact O-N 3.41Å; S1026-Y1030 WeakPolarHBondContact O-CB 3.46Å; S1026-Y1030 PolarHBondContact O-N 3.45Å
1027	V	93.5	Very high	91.5	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.006	26%	0.259	C	S	.	.	H	α-helix	trans	-71.2	-37.2	-178.5	178.8	0	0	0	0	111.5	W933 T1023 L1025 H1031 Y1050 S1053 W1054	W933-V1027 HydrophobicContact CH2-CG2 4.29Å; W933-V1027 HydrophobicContact CZ3-CG2 4.37Å; T1023-V1027 HydrophobicContact CG2-CG2 4.27Å; T1023-V1027 WeakPolarHBondContact O-CB 3.43Å; T1023-V1027 WeakPolarHBondContact O-CG2 3.29Å; T1023-V1027 PolarHBondContact O-N 3.45Å; L1025-V1027 VanDerWaalsContact C-N 3.34Å; L1025-V1027 PolarHBondContact O-N 3.42Å; V1027-H1031 WeakPolarHBondContact O-CB 3.01Å; V1027-H1031 PolarHBondContact O-N 3.11Å; V1027-Y1050 HydrophobicContact CG1-CD2 3.81Å; V1027-Y1050 HydrophobicContact CG1-CE2 3.36Å; V1027-S1053 WeakPolarHBondContact CG2-OG 3.42Å; V1027-W1054 HydrophobicContact CG1-CD2 4.35Å; V1027-W1054 HydrophobicContact CG1-CG 4.34Å; V1027-W1054 HydrophobicContact CG1-CZ2 4.15Å
1028	L	93.3	Very high	90.3	Very high	89 Å²	89	48.6 Å²	48.6	47%	0.466	25%	0.247	S	C	.	.	H	α-helix	trans	-67.9	-42.1	174.2	-178.1	64	0	0	0	111.8	A1024 L1025 H1031 I1032	A1024-L1028 WeakPolarHBondContact O-CB 3.48Å; A1024-L1028 PolarHBondContact O-N 3.03Å; L1025-L1028 PolarHBondContact O-N 3.49Å; L1028-H1031 PolarHBondContact O-N 2.93Å; L1028-I1032 HydrophobicContact CD1-CD1 3.85Å; L1028-I1032 HydrophobicContact CD1-CG1 4.27Å; L1028-I1032 HydrophobicContact CG-CD1 3.83Å; L1028-I1032 WeakPolarHBondContact O-CB 3.28Å; L1028-I1032 VanDerWaalsContact O-CG1 3.29Å; L1028-I1032 WeakPolarHBondContact O-CG1 3.47Å; L1028-I1032 PolarHBondContact O-N 3.29Å
1029	I	91.9	Very high	88.6	Confident	62 Å²	62	56.5 Å²	56.5	32%	0.318	27%	0.269	S	S	.	.	H	α-helix	trans	-57.3	-53.9	172.6	-72.3	168.8	0	0	0	109.3	A975 I978 L1025 S1026 H1031 I1032 T1033	A975-I1029 HydrophobicContact CB-CG2 4.41Å; I978-I1029 HydrophobicContact CD1-CD1 4.03Å; L1025-I1029 HydrophobicContact CD2-CD1 3.57Å; L1025-I1029 HydrophobicContact CG-CD1 4.18Å; L1025-I1029 WeakPolarHBondContact O-CB 3.08Å; L1025-I1029 VanDerWaalsContact O-CG1 3.26Å; L1025-I1029 WeakPolarHBondContact O-CG1 3.45Å; L1025-I1029 PolarHBondContact O-N 3.15Å; S1026-I1029 PolarHBondContact O-N 3.41Å; I1029-H1031 VanDerWaalsContact C-N 3.28Å; I1029-H1031 PolarHBondContact O-N 3.41Å; I1029-I1032 PolarHBondContact O-N 2.99Å; I1029-T1033 HydrophobicContact CG2-CG2 4Å; I1029-T1033 WeakPolarHBondContact O-CG2 3.49Å; I1029-T1033 PolarHBondContact O-N 2.94Å; I1029-T1033 PolarHBondContact O-OG1 2.88Å
1030	Y	90	Very high	86.9	Confident	6 Å²	6	59.3 Å²	59.3	2%	0.024	29%	0.286	C	S	.	.	H	α-helix	trans	-55.5	-39.4	179.3	-169.6	-90.2	0	0	0	113	W933 F947 W971 A975 S1026 T1033 I1034 Y1050	W933-Y1030 HydrophobicContact CB-CE1 3.97Å; W933-Y1030 VanDerWaalsContact CB-OH 3.28Å; W933-Y1030 WeakPolarHBondContact CB-OH 3.37Å; W933-Y1030 HydrophobicContact CD2-CE1 4.42Å; W933-Y1030 AromaticContact CE3-CD1 3.81Å; W933-Y1030 HydrophobicContact CE3-CD1 3.81Å; W933-Y1030 AromaticContact CE3-CE1 3.69Å; W933-Y1030 HydrophobicContact CE3-CE1 3.69Å; W933-Y1030 HydrophobicContact CE3-CE2 4.43Å; W933-Y1030 HydrophobicContact CE3-CG 4.24Å; W933-Y1030 HydrophobicContact CZ3-CD1 4.32Å; W933-Y1030 HydrophobicContact CZ3-CG 4.5Å; F947-Y1030 HydrophobicContact CE1-CD2 4.12Å; F947-Y1030 AromaticContact CE1-CE2 3.92Å; F947-Y1030 HydrophobicContact CE1-CE2 3.92Å; F947-Y1030 HydrophobicContact CZ-CD2 4.24Å; F947-Y1030 HydrophobicContact CZ-CE2 4.21Å; W971-Y1030 HydrophobicContact CH2-CD2 4.47Å; W971-Y1030 HydrophobicContact CH2-CE2 4.38Å; W971-Y1030 AromaticContact CZ3-CD2 3.73Å; W971-Y1030 HydrophobicContact CZ3-CD2 3.73Å; W971-Y1030 HydrophobicContact CZ3-CE2 4.01Å; W971-Y1030 HydrophobicContact CZ3-CG 4.42Å; A975-Y1030 HydrophobicContact CB-CD2 4.44Å; S1026-Y1030 WeakPolarHBondContact O-CB 3.46Å; S1026-Y1030 PolarHBondContact O-N 3.45Å; Y1030-T1033 PolarHBondContact O-OG1 2.88Å; Y1030-I1034 HydrophobicContact CD1-CD1 3.68Å; Y1030-I1034 HydrophobicContact CE1-CD1 3.21Å; Y1030-I1034 HydrophobicContact CE1-CG1 4.49Å; Y1030-I1034 HydrophobicContact CE2-CD1 4.28Å; Y1030-I1034 HydrophobicContact CG-CD1 4.38Å; Y1030-I1034 WeakPolarHBondContact O-CB 3.09Å; Y1030-I1034 VanDerWaalsContact O-CG1 3.31Å; Y1030-I1034 WeakPolarHBondContact O-CG1 3.31Å; Y1030-I1034 PolarHBondContact O-N 3.29Å; Y1030-Y1050 HydrophobicContact CD1-CD2 4.34Å
1031	H	90.5	Very high	85.1	Confident	38 Å²	38	67.7 Å²	67.7	18%	0.176	33%	0.325	C	S	.	.	H	α-helix	trans	-69.4	-37.4	176.4	-171.7	89.5	0	0	0	113.3	V1027 L1028 I1029 K1035 F1046 Y1050	V1027-H1031 WeakPolarHBondContact O-CB 3.01Å; V1027-H1031 PolarHBondContact O-N 3.11Å; L1028-H1031 PolarHBondContact O-N 2.93Å; I1029-H1031 VanDerWaalsContact C-N 3.28Å; I1029-H1031 PolarHBondContact O-N 3.41Å; H1031-K1035 VanDerWaalsContact NE2-CE 3.31Å; H1031-K1035 WeakPolarHBondContact NE2-CE 3.36Å; H1031-K1035 PolarHBondContact NE2-NZ 3.46Å; H1031-K1035 WeakPolarHBondContact O-CG 3.17Å; H1031-K1035 PolarHBondContact O-N 3.21Å; H1031-F1046 HydrophobicContact CB-CE1 4.46Å; H1031-F1046 AromaticContact CE1-CE2 3.39Å; H1031-F1046 WeakPolarHBondContact CE1-CE2 3.27Å; H1031-F1046 AromaticContact CE1-CZ 3.47Å; H1031-F1046 VanDerWaalsContact CE1-CZ 3.47Å; H1031-F1046 WeakPolarHBondContact CE1-CZ 3.44Å; H1031-F1046 AromaticContact CG-CZ 3.92Å; H1031-F1046 AromaticContact ND1-CD1 4Å; H1031-F1046 AromaticContact ND1-CE1 3.42Å; H1031-F1046 WeakPolarHBondContact ND1-CE1 3.28Å; H1031-F1046 AromaticContact ND1-CE2 3.51Å; H1031-F1046 AromaticContact ND1-CZ 3.15Å; H1031-F1046 WeakPolarHBondContact ND1-CZ 3.44Å; H1031-Y1050 HydrophobicContact CB-CE2 3.98Å; H1031-Y1050 AromaticContact ND1-CZ 3.49Å; H1031-Y1050 PolarHBondContact ND1-OH 3.06Å
1032	I	90.3	Very high	83.7	Confident	79 Å²	79	62.1 Å²	62.1	41%	0.405	31%	0.306	S	S	.	.	H	α-helix	trans	-76.5	-46.1	-179.5	-70.4	171.9	0	0	0	110.6	L1028 I1029 I1034 K1035 L1036	L1028-I1032 HydrophobicContact CD1-CD1 3.85Å; L1028-I1032 HydrophobicContact CD1-CG1 4.27Å; L1028-I1032 HydrophobicContact CG-CD1 3.83Å; L1028-I1032 WeakPolarHBondContact O-CB 3.28Å; L1028-I1032 VanDerWaalsContact O-CG1 3.29Å; L1028-I1032 WeakPolarHBondContact O-CG1 3.47Å; L1028-I1032 PolarHBondContact O-N 3.29Å; I1029-I1032 PolarHBondContact O-N 2.99Å; I1032-I1034 PolarHBondContact O-N 2.95Å; I1032-K1035 PolarHBondContact O-N 3.43Å; I1032-K1035 VanDerWaalsContact O-N 3.15Å; I1032-L1036 HydrophobicContact CG2-CD1 3.63Å; I1032-L1036 HydrophobicContact CG2-CG 4.24Å; I1032-L1036 WeakPolarHBondContact O-CG 3.4Å; I1032-L1036 PolarHBondContact O-N 3.41Å
1033	T	88.2	Confident	82.8	Confident	15 Å²	15	63.7 Å²	63.7	9%	0.092	32%	0.316	C	S	.	.	H	α-helix	trans	-61.1	-43.7	179.9	52.4	0	0	0	0	111.6	W971 I1029 Y1030 K1035 L1036 H1037	W971-T1033 HydrophobicContact CB-CG2 4Å; W971-T1033 VanDerWaalsContact CD2-CB 3.5Å; W971-T1033 HydrophobicContact CD2-CG2 3.81Å; W971-T1033 HydrophobicContact CE3-CG2 3.89Å; W971-T1033 HydrophobicContact CG-CG2 3.85Å; W971-T1033 WeakPolarHBondContact CZ3-OG1 3.06Å; I1029-T1033 HydrophobicContact CG2-CG2 4Å; I1029-T1033 WeakPolarHBondContact O-CG2 3.49Å; I1029-T1033 PolarHBondContact O-N 2.94Å; I1029-T1033 PolarHBondContact O-OG1 2.88Å; Y1030-T1033 PolarHBondContact O-OG1 2.88Å; T1033-K1035 VanDerWaalsContact C-N 3.33Å; T1033-K1035 PolarHBondContact O-N 2.95Å; T1033-L1036 PolarHBondContact O-N 2.9Å; T1033-H1037 WeakPolarHBondContact O-CB 3.14Å; T1033-H1037 PolarHBondContact O-CD2 3.44Å; T1033-H1037 PolarHBondContact O-N 2.84Å
1034	I	85.2	Confident	82	Confident	3 Å²	3	66.3 Å²	66.3	2%	0.015	33%	0.33	C	S	.	.	H	α-helix	trans	-59.7	-43.3	174.6	-72.4	175.9	0	0	0	111.3	L934 W971 Y1030 I1032 L1036 L1038 M1044 F1046	L934-I1034 HydrophobicContact CD1-CD1 4.33Å; L934-I1034 HydrophobicContact CD1-CG2 4.28Å; L934-I1034 HydrophobicContact CD2-CD1 4.2Å; W971-I1034 HydrophobicContact CH2-CD1 4.37Å; W971-I1034 HydrophobicContact CH2-CG1 3.7Å; W971-I1034 HydrophobicContact CZ2-CG1 4.39Å; W971-I1034 HydrophobicContact CZ3-CG1 4.43Å; Y1030-I1034 HydrophobicContact CD1-CD1 3.68Å; Y1030-I1034 HydrophobicContact CE1-CD1 3.21Å; Y1030-I1034 HydrophobicContact CE1-CG1 4.49Å; Y1030-I1034 HydrophobicContact CE2-CD1 4.28Å; Y1030-I1034 HydrophobicContact CG-CD1 4.38Å; Y1030-I1034 WeakPolarHBondContact O-CB 3.09Å; Y1030-I1034 VanDerWaalsContact O-CG1 3.31Å; Y1030-I1034 WeakPolarHBondContact O-CG1 3.31Å; Y1030-I1034 PolarHBondContact O-N 3.29Å; I1032-I1034 PolarHBondContact O-N 2.95Å; I1034-L1036 VanDerWaalsContact C-N 3.29Å; I1034-L1036 PolarHBondContact O-N 3.47Å; I1034-L1038 HydrophobicContact CB-CD1 4.39Å; I1034-L1038 HydrophobicContact CG1-CD1 4.19Å; I1034-L1038 HydrophobicContact CG2-CD1 4.41Å; I1034-L1038 WeakPolarHBondContact O-CB 3.4Å; I1034-L1038 PolarHBondContact O-N 2.89Å; I1034-L1038 VanDerWaalsContact O-N 3.11Å; I1034-M1044 HydrophobicContact CG2-CE 4.39Å; I1034-M1044 HydrophobicContact CG2-SD 4.21Å; I1034-F1046 HydrophobicContact CD1-CE1 4.46Å; I1034-F1046 HydrophobicContact CG2-CE1 4.41Å; I1034-F1046 HydrophobicContact CG2-CZ 4.44Å
1035	K	85.3	Confident	81.5	Confident	132 Å²	132	70.1 Å²	70.1	57%	0.574	35%	0.346	S	S	*	.	H	α-helix	trans	-70.4	-20.2	178.6	-78.6	-177.7	169.4	179.8	0	114.6	H1031 I1032 T1033	H1031-K1035 VanDerWaalsContact NE2-CE 3.31Å; H1031-K1035 WeakPolarHBondContact NE2-CE 3.36Å; H1031-K1035 PolarHBondContact NE2-NZ 3.46Å; H1031-K1035 WeakPolarHBondContact O-CG 3.17Å; H1031-K1035 PolarHBondContact O-N 3.21Å; I1032-K1035 PolarHBondContact O-N 3.43Å; I1032-K1035 VanDerWaalsContact O-N 3.15Å; T1033-K1035 VanDerWaalsContact C-N 3.33Å; T1033-K1035 PolarHBondContact O-N 2.95Å
1036	L	83.8	Confident	81.2	Confident	119 Å²	119	69.9 Å²	69.9	62%	0.623	34%	0.343	S	S	*	.	H	α-helix	trans	-96.4	-43.1	179.2	-68.9	176.6	0	0	0	112.8	I1032 T1033 I1034	I1032-L1036 HydrophobicContact CG2-CD1 3.63Å; I1032-L1036 HydrophobicContact CG2-CG 4.24Å; I1032-L1036 WeakPolarHBondContact O-CG 3.4Å; I1032-L1036 PolarHBondContact O-N 3.41Å; T1033-L1036 PolarHBondContact O-N 2.9Å; I1034-L1036 VanDerWaalsContact C-N 3.29Å; I1034-L1036 PolarHBondContact O-N 3.47Å
1037	H	72.8	Confident	81	Confident	109 Å²	109	70.1 Å²	70.1	51%	0.505	35%	0.345	S	S	.	.	H	α-helix	trans	-87.9	-42.3	-174.9	-63.4	-52	0	0	0	112.8	W971 T1033 R1039	W971-H1037 AromaticContact CD1-CD2 3.65Å; W971-H1037 AromaticContact CD1-NE2 3.95Å; W971-H1037 AromaticContact NE1-CD2 3.49Å; W971-H1037 PolarHBondContact NE1-CD2 3.45Å; T1033-H1037 WeakPolarHBondContact O-CB 3.14Å; T1033-H1037 PolarHBondContact O-CD2 3.44Å; T1033-H1037 PolarHBondContact O-N 2.84Å; H1037-R1039 VanDerWaalsContact C-N 3.29Å; H1037-R1039 PolarHBondContact O-N 2.85Å
1038	L	68.7	Low	80.8	Confident	34 Å²	34	73.3 Å²	73.3	18%	0.178	36%	0.36	C	S	.	.			trans	-83	73	-180	-71.5	90.4	0	0	0	111.7	L934 W971 I1034 T1040 M1044	L934-L1038 HydrophobicContact CD2-CD2 4.26Å; W971-L1038 HydrophobicContact CZ2-CD1 4.47Å; I1034-L1038 HydrophobicContact CB-CD1 4.39Å; I1034-L1038 HydrophobicContact CG1-CD1 4.19Å; I1034-L1038 HydrophobicContact CG2-CD1 4.41Å; I1034-L1038 WeakPolarHBondContact O-CB 3.4Å; I1034-L1038 PolarHBondContact O-N 2.89Å; I1034-L1038 VanDerWaalsContact O-N 3.11Å; L1038-T1040 HydrophobicContact CB-CG2 4.16Å; L1038-T1040 HydrophobicContact CD2-CG2 4.22Å; L1038-T1040 HydrophobicContact CG-CG2 4.29Å; L1038-T1040 PolarHBondContact O-N 2.8Å; L1038-M1044 HydrophobicContact CB-CE 3.64Å; L1038-M1044 HydrophobicContact CB-SD 3.64Å; L1038-M1044 HydrophobicContact CD2-SD 3.7Å; L1038-M1044 HydrophobicContact CG-SD 4.29Å; L1038-M1044 WeakPolarHBondContact O-CE 3.37Å
1039	R	60.7	Low	80.8	Confident	239 Å²	239	69 Å²	69	90%	0.902	34%	0.338	S	S	*	.			trans	-74.4	44.5	155	-74.7	-171.7	172.2	-175.9	-1.4	111.3	H1037	H1037-R1039 VanDerWaalsContact C-N 3.29Å; H1037-R1039 PolarHBondContact O-N 2.85Å
1040	T	60.5	Low	80.8	Confident	59 Å²	59	67.6 Å²	67.6	36%	0.362	33%	0.328	S	S	.	.			trans	-82.6	142.8	178.2	59.5	0	0	0	0	110.5	Q936 L1038 G1042	Q936-T1040 PolarHBondContact NE2-OG1 3.48Å; Q936-T1040 VanDerWaalsContact NE2-OG1 3.1Å; L1038-T1040 HydrophobicContact CB-CG2 4.16Å; L1038-T1040 HydrophobicContact CD2-CG2 4.22Å; L1038-T1040 HydrophobicContact CG-CG2 4.29Å; L1038-T1040 PolarHBondContact O-N 2.8Å; T1040-G1042 VanDerWaalsContact C-N 3.26Å; T1040-G1042 PolarHBondContact O-N 3.01Å
1041	E	59.1	Low	81	Confident	177 Å²	177	69.1 Å²	69.1	83%	0.827	35%	0.346	S	S	*	.	S	Bend	trans	-67.6	-20	-167.4	-58.4	177.1	150.2	0	0	114.8	Y938	Y938-E1041 PolarHBondContact OH-O 2.99Å; Y938-E1041 VanDerWaalsContact OH-O 3.09Å
1042	G	67.4	Low	81.2	Confident	20 Å²	20	70.3 Å²	70.3	21%	0.206	35%	0.353	C	S	.	.	S	Bend	trans	-88.4	158.4	-177.6	0	0	0	0	0	115.1	T1040 M1044	T1040-G1042 VanDerWaalsContact C-N 3.26Å; T1040-G1042 PolarHBondContact O-N 3.01Å; G1042-M1044 PolarHBondContact O-N 3.43Å
1043	P	77.5	Confident	81.4	Confident	59 Å²	59	66.5 Å²	66.5	38%	0.383	33%	0.334	S	S	.	.			trans	-64.1	133.4	175.1	27.8	-33.9	0	0	0	110.8	G937 Y938	G937-P1043 PolarHBondContact N-O 2.91Å; Y938-P1043 HydrophobicContact CD1-CG 4.08Å; Y938-P1043 VanDerWaalsContact CE1-CD 3.47Å; Y938-P1043 HydrophobicContact CE1-CG 4.18Å
1044	M	78.7	Confident	81.7	Confident	56 Å²	56	70.8 Å²	70.8	28%	0.276	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	127.3	175.8	-70.7	-169.5	-69	0	0	110.1	L934 Y935 Q936 I1034 L1038 G1042	L934-M1044 HydrophobicContact CD1-CB 4.22Å; L934-M1044 HydrophobicContact CD1-SD 4.49Å; L934-M1044 HydrophobicContact CD2-SD 4.41Å; Y935-M1044 WeakPolarHBondContact O-CA 3.36Å; Q936-M1044 HydrophobicContact CB-CG 4.42Å; Q936-M1044 HydrophobicContact CG-CG 4.09Å; I1034-M1044 HydrophobicContact CG2-CE 4.39Å; I1034-M1044 HydrophobicContact CG2-SD 4.21Å; L1038-M1044 HydrophobicContact CB-CE 3.64Å; L1038-M1044 HydrophobicContact CB-SD 3.64Å; L1038-M1044 HydrophobicContact CD2-SD 3.7Å; L1038-M1044 HydrophobicContact CG-SD 4.29Å; L1038-M1044 WeakPolarHBondContact O-CE 3.37Å; G1042-M1044 PolarHBondContact O-N 3.43Å
1045	N	85.8	Confident	82.3	Confident	105 Å²	105	75.9 Å²	75.9	56%	0.561	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.6	135.9	173.7	-66.3	-68.3	0	0	0	109.4	Y935 G1047	Y935-N1045 PolarHBondContact N-O 2.73Å; Y935-N1045 PolarHBondContact O-N 3.16Å; N1045-G1047 PolarHBondContact O-N 3.43Å
1046	F	89.2	Confident	82.7	Confident	63 Å²	63	69.6 Å²	69.6	28%	0.276	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	131.6	171.2	-65.5	-81.8	0	0	0	109.4	H1031 I1034 Y1050	H1031-F1046 HydrophobicContact CB-CE1 4.46Å; H1031-F1046 AromaticContact CE1-CE2 3.39Å; H1031-F1046 WeakPolarHBondContact CE1-CE2 3.27Å; H1031-F1046 AromaticContact CE1-CZ 3.47Å; H1031-F1046 VanDerWaalsContact CE1-CZ 3.47Å; H1031-F1046 WeakPolarHBondContact CE1-CZ 3.44Å; H1031-F1046 AromaticContact CG-CZ 3.92Å; H1031-F1046 AromaticContact ND1-CD1 4Å; H1031-F1046 AromaticContact ND1-CE1 3.42Å; H1031-F1046 WeakPolarHBondContact ND1-CE1 3.28Å; H1031-F1046 AromaticContact ND1-CE2 3.51Å; H1031-F1046 AromaticContact ND1-CZ 3.15Å; H1031-F1046 WeakPolarHBondContact ND1-CZ 3.44Å; I1034-F1046 HydrophobicContact CD1-CE1 4.46Å; I1034-F1046 HydrophobicContact CG2-CE1 4.41Å; I1034-F1046 HydrophobicContact CG2-CZ 4.44Å; F1046-Y1050 HydrophobicContact CB-CD1 3.66Å; F1046-Y1050 HydrophobicContact CB-CE1 4.19Å; F1046-Y1050 HydrophobicContact CB-CG 4.06Å; F1046-Y1050 HydrophobicContact CD1-CD1 4.17Å; F1046-Y1050 HydrophobicContact CD1-CD2 4.08Å; F1046-Y1050 HydrophobicContact CD1-CE1 4.3Å; F1046-Y1050 HydrophobicContact CD1-CE2 4.21Å; F1046-Y1050 HydrophobicContact CD1-CG 4.07Å; F1046-Y1050 HydrophobicContact CG-CD1 4.08Å; F1046-Y1050 HydrophobicContact CG-CE1 4.2Å; F1046-Y1050 HydrophobicContact CG-CG 4.39Å
1047	G	87.9	Confident	83.3	Confident	7 Å²	7	64.2 Å²	64.2	7%	0.072	32%	0.315	C	S	.	.			trans	-85.3	-177.6	-174.5	0	0	0	0	0	114	T932 W933 N1045 A1049 Y1050 G1051	T932-G1047 CarbonylContact O-C 3.54Å; T932-G1047 WeakPolarHBondContact O-CA 3.32Å; W933-G1047 PolarHBondContact O-N 2.95Å; N1045-G1047 PolarHBondContact O-N 3.43Å; G1047-A1049 PolarHBondContact O-N 2.85Å; G1047-Y1050 WeakPolarHBondContact O-CB 3.47Å; G1047-Y1050 PolarHBondContact O-N 2.9Å; G1047-G1051 PolarHBondContact O-N 2.91Å
1048	E	90.7	Very high	84.4	Confident	68 Å²	68	65 Å²	65	32%	0.318	32%	0.318	S	S	.	.	H	α-helix	trans	-65.9	-37.1	-174.9	-69.3	177.5	160.4	0	0	113.2	P402 T932 Y935 Y1050 G1051 I1052	P402-E1048 VanDerWaalsContact CB-OE1 3.3Å; P402-E1048 WeakPolarHBondContact CB-OE1 3.41Å; P402-E1048 WeakPolarHBondContact CD-OE1 3.45Å; T932-E1048 PolarHBondContact O-N 3.49Å; Y935-E1048 PolarHBondContact OH-N 2.88Å; E1048-Y1050 VanDerWaalsContact C-N 3.28Å; E1048-Y1050 PolarHBondContact O-N 2.97Å; E1048-G1051 CarbonylContact O-C 3.27Å; E1048-G1051 WeakPolarHBondContact O-CA 3.2Å; E1048-G1051 PolarHBondContact O-N 3.23Å; E1048-I1052 VanDerWaalsContact O-CG1 3.28Å; E1048-I1052 WeakPolarHBondContact O-CG1 3.44Å; E1048-I1052 PolarHBondContact O-N 3.3Å
1049	A	92.4	Very high	85.7	Confident	0 Å²	0	64 Å²	64	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-61.8	-37.2	178.9	0	0	0	0	0	112.1	A930 T932 W933 G1047 I1052 S1053	A930-A1049 HydrophobicContact CB-CB 3.86Å; T932-A1049 WeakPolarHBondContact O-CB 3.45Å; T932-A1049 PolarHBondContact O-N 2.89Å; T932-A1049 PolarHBondContact OG1-N 3.43Å; W933-A1049 VanDerWaalsContact CD1-CB 3.49Å; W933-A1049 HydrophobicContact CD2-CB 4.18Å; W933-A1049 HydrophobicContact CG-CB 3.94Å; G1047-A1049 PolarHBondContact O-N 2.85Å; A1049-I1052 PolarHBondContact O-N 2.82Å; A1049-S1053 PolarHBondContact O-N 2.83Å
1050	Y	92.7	Very high	87.3	Confident	31 Å²	31	52.6 Å²	52.6	12%	0.122	27%	0.269	C	S	.	.	H	α-helix	trans	-61.5	-43.7	172.2	176.6	-92.6	0	0	0	111.2	W933 V1027 Y1030 H1031 F1046 G1047 E1048 S1053 W1054	W933-Y1050 HydrophobicContact CE3-CD2 4.39Å; W933-Y1050 HydrophobicContact CZ3-CD2 4.32Å; V1027-Y1050 HydrophobicContact CG1-CD2 3.81Å; V1027-Y1050 HydrophobicContact CG1-CE2 3.36Å; Y1030-Y1050 HydrophobicContact CD1-CD2 4.34Å; H1031-Y1050 HydrophobicContact CB-CE2 3.98Å; H1031-Y1050 AromaticContact ND1-CZ 3.49Å; H1031-Y1050 PolarHBondContact ND1-OH 3.06Å; F1046-Y1050 HydrophobicContact CB-CD1 3.66Å; F1046-Y1050 HydrophobicContact CB-CE1 4.19Å; F1046-Y1050 HydrophobicContact CB-CG 4.06Å; F1046-Y1050 HydrophobicContact CD1-CD1 4.17Å; F1046-Y1050 HydrophobicContact CD1-CD2 4.08Å; F1046-Y1050 HydrophobicContact CD1-CE1 4.3Å; F1046-Y1050 HydrophobicContact CD1-CE2 4.21Å; F1046-Y1050 HydrophobicContact CD1-CG 4.07Å; F1046-Y1050 HydrophobicContact CG-CD1 4.08Å; F1046-Y1050 HydrophobicContact CG-CE1 4.2Å; F1046-Y1050 HydrophobicContact CG-CG 4.39Å; G1047-Y1050 WeakPolarHBondContact O-CB 3.47Å; G1047-Y1050 PolarHBondContact O-N 2.9Å; E1048-Y1050 VanDerWaalsContact C-N 3.28Å; E1048-Y1050 PolarHBondContact O-N 2.97Å; Y1050-S1053 PolarHBondContact O-N 3.25Å; Y1050-S1053 PolarHBondContact O-OG 2.92Å; Y1050-W1054 AromaticContact CE1-CD1 3.66Å; Y1050-W1054 AromaticContact CE1-NE1 3.62Å; Y1050-W1054 AromaticContact CE2-NE1 3.82Å; Y1050-W1054 AromaticContact CZ-CD1 3.69Å; Y1050-W1054 AromaticContact CZ-NE1 3.2Å; Y1050-W1054 PolarHBondContact O-N 2.96Å; Y1050-W1054 PolarHBondContact OH-NE1 3.04Å
1051	G	93.3	Very high	89	Confident	39 Å²	39	53.5 Å²	53.5	40%	0.402	27%	0.271	S	S	.	.	H	α-helix	trans	-63.8	-41.3	173.9	0	0	0	0	0	113.8	G1047 E1048 S1053 W1054 F1055	G1047-G1051 PolarHBondContact O-N 2.91Å; E1048-G1051 CarbonylContact O-C 3.27Å; E1048-G1051 WeakPolarHBondContact O-CA 3.2Å; E1048-G1051 PolarHBondContact O-N 3.23Å; G1051-S1053 VanDerWaalsContact C-N 3.34Å; G1051-S1053 PolarHBondContact O-N 3.38Å; G1051-W1054 PolarHBondContact O-N 3.01Å; G1051-F1055 PolarHBondContact O-N 3.19Å
1052	I	95.2	Very high	90.7	Very high	62 Å²	62	48 Å²	48	32%	0.318	25%	0.247	S	C	.	.	H	α-helix	trans	-64.4	-38.5	177.5	-64.9	163.8	0	0	0	110.6	C923 E1048 A1049 W1054 F1055 A1056	C923-I1052 HydrophobicContact CB-CG2 3.9Å; C923-I1052 WeakPolarHBondContact O-CG2 3.35Å; E1048-I1052 VanDerWaalsContact O-CG1 3.28Å; E1048-I1052 WeakPolarHBondContact O-CG1 3.44Å; E1048-I1052 PolarHBondContact O-N 3.3Å; A1049-I1052 PolarHBondContact O-N 2.82Å; I1052-W1054 PolarHBondContact O-N 3.11Å; I1052-F1055 PolarHBondContact O-N 2.77Å; I1052-A1056 WeakPolarHBondContact O-CB 3.44Å; I1052-A1056 PolarHBondContact O-N 2.86Å
1053	S	94.4	Very high	92	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63	-40.7	176.9	74.4	0	0	0	0	113	V1027 A1049 Y1050 G1051 A1056 C1057	V1027-S1053 WeakPolarHBondContact CG2-OG 3.42Å; A1049-S1053 PolarHBondContact O-N 2.83Å; Y1050-S1053 PolarHBondContact O-N 3.25Å; Y1050-S1053 PolarHBondContact O-OG 2.92Å; G1051-S1053 VanDerWaalsContact C-N 3.34Å; G1051-S1053 PolarHBondContact O-N 3.38Å; S1053-A1056 PolarHBondContact O-N 3.18Å; S1053-C1057 WeakPolarHBondContact O-CB 3.41Å; S1053-C1057 PolarHBondContact O-N 3.02Å
1054	W	95.6	Very high	92.7	Very high	104 Å²	104	44.4 Å²	44.4	39%	0.394	22%	0.22	S	C	.	.	H	α-helix	trans	-65.4	-39.3	171.8	-84.4	109	0	0	0	112.8	A1024 V1027 Y1050 G1051 I1052 C1057 F1058	A1024-W1054 HydrophobicContact CB-CZ3 4.41Å; V1027-W1054 HydrophobicContact CG1-CD2 4.35Å; V1027-W1054 HydrophobicContact CG1-CG 4.34Å; V1027-W1054 HydrophobicContact CG1-CZ2 4.15Å; Y1050-W1054 AromaticContact CE1-CD1 3.66Å; Y1050-W1054 AromaticContact CE1-NE1 3.62Å; Y1050-W1054 AromaticContact CE2-NE1 3.82Å; Y1050-W1054 AromaticContact CZ-CD1 3.69Å; Y1050-W1054 AromaticContact CZ-NE1 3.2Å; Y1050-W1054 PolarHBondContact O-N 2.96Å; Y1050-W1054 PolarHBondContact OH-NE1 3.04Å; G1051-W1054 PolarHBondContact O-N 3.01Å; I1052-W1054 PolarHBondContact O-N 3.11Å; W1054-C1057 WeakPolarHBondContact O-CB 3.35Å; W1054-C1057 PolarHBondContact O-N 2.87Å; W1054-F1058 PolarHBondContact O-N 3.1Å
1055	F	95.9	Very high	93.4	Very high	110 Å²	110	45.5 Å²	45.5	48%	0.482	23%	0.227	S	C	.	.	H	α-helix	trans	-64.3	-45	176.1	177.7	-112.2	0	0	0	111.6	G1051 I1052 F1058 L1059	G1051-F1055 PolarHBondContact O-N 3.19Å; I1052-F1055 PolarHBondContact O-N 2.77Å; F1055-F1058 WeakPolarHBondContact O-CB 3.38Å; F1055-F1058 PolarHBondContact O-N 2.78Å; F1055-L1059 HydrophobicContact CD1-CD1 4.05Å; F1055-L1059 HydrophobicContact CD1-CG 4.5Å; F1055-L1059 HydrophobicContact CE1-CD1 3.55Å; F1055-L1059 HydrophobicContact CE1-CG 4.17Å; F1055-L1059 HydrophobicContact CE2-CD2 4.33Å; F1055-L1059 HydrophobicContact CE2-CG 4.35Å; F1055-L1059 HydrophobicContact CZ-CD1 3.83Å; F1055-L1059 HydrophobicContact CZ-CD2 4.12Å; F1055-L1059 HydrophobicContact CZ-CG 4.09Å; F1055-L1059 WeakPolarHBondContact O-CG 3.35Å; F1055-L1059 PolarHBondContact O-N 3.01Å
1056	A	95.2	Very high	93.6	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-63.2	-40.5	175.2	0	0	0	0	0	112.4	C923 L924 I1052 S1053 F1058 L1059 H1060	C923-A1056 HydrophobicContact CB-CB 3.8Å; L924-A1056 HydrophobicContact CD2-CB 3.52Å; L924-A1056 HydrophobicContact CG-CB 3.77Å; I1052-A1056 WeakPolarHBondContact O-CB 3.44Å; I1052-A1056 PolarHBondContact O-N 2.86Å; S1053-A1056 PolarHBondContact O-N 3.18Å; A1056-F1058 VanDerWaalsContact C-N 3.32Å; A1056-F1058 PolarHBondContact O-N 2.96Å; A1056-L1059 PolarHBondContact O-N 2.88Å; A1056-H1060 PolarHBondContact O-CD2 3.06Å; A1056-H1060 PolarHBondContact O-N 2.88Å
1057	C	95.6	Very high	93.7	Very high	6 Å²	6	39.2 Å²	39.2	4%	0.041	20%	0.196	C	C	.	.	H	α-helix	trans	-56.4	-45.3	171.2	-178.4	0	0	0	0	111.8	A1020 T1023 S1053 W1054 H1060 I1061	A1020-C1057 PolarHBondContact O-SG 3.21Å; T1023-C1057 HydrophobicContact CG2-CB 3.9Å; S1053-C1057 WeakPolarHBondContact O-CB 3.41Å; S1053-C1057 PolarHBondContact O-N 3.02Å; W1054-C1057 WeakPolarHBondContact O-CB 3.35Å; W1054-C1057 PolarHBondContact O-N 2.87Å; C1057-H1060 PolarHBondContact O-N 3.27Å; C1057-I1061 WeakPolarHBondContact O-CG1 3.31Å; C1057-I1061 PolarHBondContact O-N 3.19Å; C1057-I1061 VanDerWaalsContact O-N 3.09Å
1058	F	95.8	Very high	93.7	Very high	126 Å²	126	40.3 Å²	40.3	55%	0.553	20%	0.2	S	C	*	.	H	α-helix	trans	-64.4	-40.3	176	177.2	-94.9	0	0	0	112.3	W1054 F1055 A1056 I1061 L1062	W1054-F1058 PolarHBondContact O-N 3.1Å; F1055-F1058 WeakPolarHBondContact O-CB 3.38Å; F1055-F1058 PolarHBondContact O-N 2.78Å; A1056-F1058 VanDerWaalsContact C-N 3.32Å; A1056-F1058 PolarHBondContact O-N 2.96Å; F1058-I1061 PolarHBondContact O-N 3.21Å; F1058-L1062 HydrophobicContact CE1-CD2 4.36Å; F1058-L1062 WeakPolarHBondContact O-CB 3.46Å; F1058-L1062 PolarHBondContact O-N 2.87Å
1059	L	96.2	Very high	93.4	Very high	12 Å²	12	39.2 Å²	39.2	6%	0.063	20%	0.196	C	C	.	.	H	α-helix	trans	-64.5	-39.9	176	-68.8	-177.9	0	0	0	112.6	L916 V919 A920 F1055 A1056 L1062 A1063	L916-L1059 HydrophobicContact CD2-CD2 3.89Å; V919-L1059 HydrophobicContact CB-CD1 4.44Å; V919-L1059 HydrophobicContact CG1-CD1 3.8Å; A920-L1059 HydrophobicContact CB-CB 3.62Å; A920-L1059 HydrophobicContact CB-CD1 4.36Å; F1055-L1059 HydrophobicContact CD1-CD1 4.05Å; F1055-L1059 HydrophobicContact CD1-CG 4.5Å; F1055-L1059 HydrophobicContact CE1-CD1 3.55Å; F1055-L1059 HydrophobicContact CE1-CG 4.17Å; F1055-L1059 HydrophobicContact CE2-CD2 4.33Å; F1055-L1059 HydrophobicContact CE2-CG 4.35Å; F1055-L1059 HydrophobicContact CZ-CD1 3.83Å; F1055-L1059 HydrophobicContact CZ-CD2 4.12Å; F1055-L1059 HydrophobicContact CZ-CG 4.09Å; F1055-L1059 WeakPolarHBondContact O-CG 3.35Å; F1055-L1059 PolarHBondContact O-N 3.01Å; A1056-L1059 PolarHBondContact O-N 2.88Å; L1059-L1062 PolarHBondContact O-N 2.73Å; L1059-A1063 WeakPolarHBondContact O-CB 3.31Å; L1059-A1063 PolarHBondContact O-N 3.41Å
1060	H	95.4	Very high	92.5	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-64	-41.1	173.7	-79.7	-60.1	0	0	0	112.1	A920 H1016 A1020 A1056 C1057 L1062 A1063 A1064	A920-H1060 WeakPolarHBondContact CB-NE2 3.43Å; H1016-H1060 AromaticContact CE1-ND1 3.97Å; H1016-H1060 AromaticContact ND1-CE1 3.86Å; H1016-H1060 AromaticContact ND1-ND1 3.34Å; H1016-H1060 PolarHBondContact ND1-ND1 3.44Å; A1020-H1060 HydrophobicContact CB-CB 3.86Å; A1056-H1060 PolarHBondContact O-CD2 3.06Å; A1056-H1060 PolarHBondContact O-N 2.88Å; C1057-H1060 PolarHBondContact O-N 3.27Å; H1060-L1062 VanDerWaalsContact C-N 3.34Å; H1060-L1062 PolarHBondContact O-N 3.11Å; H1060-A1063 PolarHBondContact O-N 3.36Å; H1060-A1064 VanDerWaalsContact O-CB 3.27Å; H1060-A1064 WeakPolarHBondContact O-CB 3.47Å; H1060-A1064 PolarHBondContact O-N 2.86Å
1061	I	95.7	Very high	91.8	Very high	78 Å²	78	41 Å²	41	40%	0.4	21%	0.206	S	C	.	.	H	α-helix	trans	-61.9	-43.1	173.3	-66.1	168.8	0	0	0	110.7	A1020 C1057 F1058 A1064 I1065	A1020-I1061 HydrophobicContact CB-CD1 4.3Å; A1020-I1061 HydrophobicContact CB-CG1 3.58Å; C1057-I1061 WeakPolarHBondContact O-CG1 3.31Å; C1057-I1061 PolarHBondContact O-N 3.19Å; C1057-I1061 VanDerWaalsContact O-N 3.09Å; F1058-I1061 PolarHBondContact O-N 3.21Å; I1061-A1064 PolarHBondContact O-N 3.1Å; I1061-I1065 HydrophobicContact CG2-CD1 3.79Å; I1061-I1065 HydrophobicContact CG2-CG1 4.46Å; I1061-I1065 WeakPolarHBondContact O-CB 3.15Å; I1061-I1065 VanDerWaalsContact O-CG1 3.27Å; I1061-I1065 WeakPolarHBondContact O-CG1 3.42Å; I1061-I1065 PolarHBondContact O-N 2.89Å
1062	L	94.7	Very high	91	Very high	62 Å²	62	42.4 Å²	42.4	33%	0.325	20%	0.203	S	C	.	.	H	α-helix	trans	-65.6	-43	178.7	-176.8	60.9	0	0	0	111.9	L916 F1058 L1059 H1060 I1065 L1066	L916-L1062 HydrophobicContact CD1-CD2 4.05Å; L916-L1062 HydrophobicContact CD1-CG 4.22Å; F1058-L1062 HydrophobicContact CE1-CD2 4.36Å; F1058-L1062 WeakPolarHBondContact O-CB 3.46Å; F1058-L1062 PolarHBondContact O-N 2.87Å; L1059-L1062 PolarHBondContact O-N 2.73Å; H1060-L1062 VanDerWaalsContact C-N 3.34Å; H1060-L1062 PolarHBondContact O-N 3.11Å; L1062-I1065 PolarHBondContact O-N 3.25Å; L1062-L1066 HydrophobicContact CG-CD1 4.42Å; L1062-L1066 VanDerWaalsContact O-CG 3.29Å; L1062-L1066 WeakPolarHBondContact O-CG 3.45Å; L1062-L1066 PolarHBondContact O-N 3.11Å
1063	A	93.4	Very high	90.1	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-63.2	-44.8	174.8	0	0	0	0	0	111.7	A913 L916 A917 L1059 H1060 I1065 L1066 L1067	A913-A1063 WeakPolarHBondContact O-CB 3.41Å; L916-A1063 HydrophobicContact CB-CB 4.22Å; A917-A1063 HydrophobicContact CB-CB 3.96Å; L1059-A1063 WeakPolarHBondContact O-CB 3.31Å; L1059-A1063 PolarHBondContact O-N 3.41Å; H1060-A1063 PolarHBondContact O-N 3.36Å; A1063-I1065 PolarHBondContact O-N 3.19Å; A1063-L1066 PolarHBondContact O-N 3.37Å; A1063-L1066 VanDerWaalsContact O-N 3.15Å; A1063-L1067 WeakPolarHBondContact O-CG 3.44Å; A1063-L1067 PolarHBondContact O-N 3.01Å
1064	A	93.8	Very high	88.9	Confident	3 Å²	3	44.9 Å²	44.9	3%	0.025	22%	0.217	C	C	.	.	H	α-helix	trans	-59.3	-44.8	175	0	0	0	0	0	112.1	G1013 H1016 V1017 H1060 I1061 L1066 L1067 L1068	G1013-A1064 WeakPolarHBondContact O-CB 3.39Å; H1016-A1064 HydrophobicContact CB-CB 3.9Å; V1017-A1064 HydrophobicContact CG2-CB 3.64Å; H1060-A1064 VanDerWaalsContact O-CB 3.27Å; H1060-A1064 WeakPolarHBondContact O-CB 3.47Å; H1060-A1064 PolarHBondContact O-N 2.86Å; I1061-A1064 PolarHBondContact O-N 3.1Å; A1064-L1066 VanDerWaalsContact C-N 3.31Å; A1064-L1066 PolarHBondContact O-N 2.89Å; A1064-L1067 PolarHBondContact O-N 2.88Å; A1064-L1068 VanDerWaalsContact O-CB 3.26Å; A1064-L1068 WeakPolarHBondContact O-CB 3.28Å; A1064-L1068 VanDerWaalsContact O-CG 3.27Å; A1064-L1068 WeakPolarHBondContact O-CG 3.18Å; A1064-L1068 PolarHBondContact O-N 3.42Å
1065	I	92.3	Very high	88	Confident	80 Å²	80	43 Å²	43	41%	0.41	21%	0.212	S	C	.	.	H	α-helix	trans	-61.3	-39.8	175.2	-71.5	166.7	0	0	0	111.2	I1061 L1062 A1063 L1068 L1069 I1072	I1061-I1065 HydrophobicContact CG2-CD1 3.79Å; I1061-I1065 HydrophobicContact CG2-CG1 4.46Å; I1061-I1065 WeakPolarHBondContact O-CB 3.15Å; I1061-I1065 VanDerWaalsContact O-CG1 3.27Å; I1061-I1065 WeakPolarHBondContact O-CG1 3.42Å; I1061-I1065 PolarHBondContact O-N 2.89Å; L1062-I1065 PolarHBondContact O-N 3.25Å; A1063-I1065 PolarHBondContact O-N 3.19Å; I1065-L1068 CarbonylContact O-C 3.22Å; I1065-L1068 PolarHBondContact O-N 3.16Å; I1065-L1069 WeakPolarHBondContact O-CG 3.32Å; I1065-L1069 PolarHBondContact O-N 3.07Å; I1065-I1072 HydrophobicContact CG2-CD1 4.35Å
1066	L	91.3	Very high	86.7	Confident	34 Å²	34	41 Å²	41	18%	0.178	21%	0.206	C	C	.	.	H	α-helix	trans	-69.7	-35.6	178.7	-71.2	172.3	0	0	0	113.1	A913 L916 L1062 A1063 A1064 L1069	A913-L1066 HydrophobicContact CB-CB 3.58Å; A913-L1066 HydrophobicContact CB-CD1 4.28Å; L916-L1066 HydrophobicContact CD1-CD1 3.6Å; L1062-L1066 HydrophobicContact CG-CD1 4.42Å; L1062-L1066 VanDerWaalsContact O-CG 3.29Å; L1062-L1066 WeakPolarHBondContact O-CG 3.45Å; L1062-L1066 PolarHBondContact O-N 3.11Å; A1063-L1066 PolarHBondContact O-N 3.37Å; A1063-L1066 VanDerWaalsContact O-N 3.15Å; A1064-L1066 VanDerWaalsContact C-N 3.31Å; A1064-L1066 PolarHBondContact O-N 2.89Å; L1066-L1069 HydrophobicContact CD2-CD1 3.84Å; L1066-L1069 WeakPolarHBondContact O-CB 3.41Å
1067	L	89.8	Confident	85.6	Confident	2 Å²	2	44.7 Å²	44.7	1%	0.01	23%	0.228	C	C	.	.	H	α-helix	trans	-71.9	-38.4	173.1	-69.3	165.6	0	0	0	112	A913 S993 F1009 A1063 A1064 L1069	A913-L1067 HydrophobicContact CB-CD1 4.49Å; A913-L1067 HydrophobicContact CB-CD2 4Å; A913-L1067 HydrophobicContact CB-CG 3.76Å; S993-L1067 WeakPolarHBondContact OG-CD1 3.41Å; F1009-L1067 HydrophobicContact CB-CD2 4.43Å; F1009-L1067 HydrophobicContact CD1-CD2 3.75Å; F1009-L1067 HydrophobicContact CG-CD2 4.48Å; A1063-L1067 WeakPolarHBondContact O-CG 3.44Å; A1063-L1067 PolarHBondContact O-N 3.01Å; A1064-L1067 PolarHBondContact O-N 2.88Å; L1067-L1069 VanDerWaalsContact C-N 3.33Å
1068	L	89.2	Confident	84.6	Confident	29 Å²	29	47.3 Å²	47.3	15%	0.152	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	1.4	178.9	-62.6	172	0	0	0	113.5	H1010 V1017 A1064 I1065 D1070 E1071 I1072	H1010-L1068 WeakPolarHBondContact ND1-CD2 3.3Å; V1017-L1068 HydrophobicContact CG2-CD1 4.07Å; A1064-L1068 VanDerWaalsContact O-CB 3.26Å; A1064-L1068 WeakPolarHBondContact O-CB 3.28Å; A1064-L1068 VanDerWaalsContact O-CG 3.27Å; A1064-L1068 WeakPolarHBondContact O-CG 3.18Å; A1064-L1068 PolarHBondContact O-N 3.42Å; I1065-L1068 CarbonylContact O-C 3.22Å; I1065-L1068 PolarHBondContact O-N 3.16Å; L1068-D1070 PolarHBondContact O-N 3.4Å; L1068-D1070 VanDerWaalsContact O-N 3.09Å; L1068-E1071 PolarHBondContact O-N 2.94Å; L1068-I1072 HydrophobicContact CB-CD1 4.11Å; L1068-I1072 WeakPolarHBondContact O-CB 3.47Å; L1068-I1072 VanDerWaalsContact O-CG1 3.27Å; L1068-I1072 WeakPolarHBondContact O-CG1 3.11Å; L1068-I1072 PolarHBondContact O-N 3.37Å
1069	L	83.5	Confident	83.3	Confident	46 Å²	46	44.8 Å²	44.8	24%	0.241	23%	0.234	C	C	.	.	H	α-helix	trans	-49.6	-38	174.4	-91.8	177.1	0	0	0	111.4	A909 I1065 L1066 L1067 E1071 I1072 I1073	A909-L1069 HydrophobicContact CB-CD1 4.2Å; I1065-L1069 WeakPolarHBondContact O-CG 3.32Å; I1065-L1069 PolarHBondContact O-N 3.07Å; L1066-L1069 HydrophobicContact CD2-CD1 3.84Å; L1066-L1069 WeakPolarHBondContact O-CB 3.41Å; L1067-L1069 VanDerWaalsContact C-N 3.33Å; L1069-E1071 PolarHBondContact O-N 3.45Å; L1069-I1072 PolarHBondContact O-N 3.09Å; L1069-I1073 HydrophobicContact CB-CD1 4.45Å; L1069-I1073 HydrophobicContact CD2-CD1 4.39Å; L1069-I1073 VanDerWaalsContact O-CB 3.31Å; L1069-I1073 WeakPolarHBondContact O-CB 3.44Å; L1069-I1073 WeakPolarHBondContact O-CD1 3.44Å; L1069-I1073 VanDerWaalsContact O-CG1 3.24Å; L1069-I1073 WeakPolarHBondContact O-CG1 3.48Å; L1069-I1073 PolarHBondContact O-N 3.3Å
1070	D	74.2	Confident	81.9	Confident	9 Å²	9	44.8 Å²	44.8	5%	0.048	24%	0.235	C	C	.	.	H	α-helix	trans	-60.8	-42.8	-179.1	-62	-12.1	0	0	0	111.9	W901 F906 R910 L1006 L1068 N1074	W901-D1070 HydrophobicContact CH2-CB 3.71Å; W901-D1070 HydrophobicContact CZ3-CB 3.66Å; W901-D1070 VanDerWaalsContact CZ3-CG 3.44Å; W901-D1070 WeakPolarHBondContact CZ3-OD1 3.38Å; F906-D1070 WeakPolarHBondContact CD1-OD1 3.25Å; R910-D1070 IonicContact CZ-OD2 2.68Å; R910-D1070 IonicContact NE-OD2 3.87Å; R910-D1070 PolarHBondContact NE-OD2 3.34Å; R910-D1070 VanDerWaalsContact NE-OD2 3.17Å; R910-D1070 IonicContact NH2-OD1 3.18Å; R910-D1070 IonicContact NH2-OD2 2.88Å; R910-D1070 PolarHBondContact NH2-OD2 2.98Å; L1006-D1070 HydrophobicContact CD1-CB 4.08Å; L1068-D1070 PolarHBondContact O-N 3.4Å; L1068-D1070 VanDerWaalsContact O-N 3.09Å; D1070-N1074 PolarHBondContact O-N 3.29Å; D1070-N1074 PolarHBondContact O-ND2 2.91Å
1071	E	78.1	Confident	80.6	Confident	59 Å²	59	48.1 Å²	48.1	28%	0.276	27%	0.27	S	S	.	.	H	α-helix	trans	-78.4	-41.5	172.9	-179.6	159.6	-132.2	0	0	111.9	R6 H1010 L1068 L1069 I1073 N1074 E1075	R6-E1071 IonicContact CZ-OE1 3.17Å; R6-E1071 IonicContact NE-OE1 3.62Å; R6-E1071 IonicContact NH1-OE1 3.95Å; R6-E1071 PolarHBondContact NH1-OE1 3.44Å; R6-E1071 IonicContact NH2-OE1 3.85Å; H1010-E1071 IonicContact CE1-OE2 2.7Å; H1010-E1071 PolarHBondContact CE1-OE2 3.29Å; H1010-E1071 VanDerWaalsContact CE1-OE2 3.31Å; H1010-E1071 IonicContact ND1-OE2 3.17Å; L1068-E1071 PolarHBondContact O-N 2.94Å; L1069-E1071 PolarHBondContact O-N 3.45Å; E1071-I1073 VanDerWaalsContact C-N 3.31Å; E1071-I1073 PolarHBondContact O-N 3.03Å; E1071-N1074 PolarHBondContact O-N 3.1Å; E1071-N1074 VanDerWaalsContact O-N 3.12Å; E1071-E1075 HydrophobicContact CG-CG 4.28Å; E1071-E1075 PolarHBondContact O-N 3.26Å
1072	I	76.5	Confident	79.6	Confident	68 Å²	68	54.8 Å²	54.8	35%	0.349	29%	0.29	S	S	.	.	H	α-helix	trans	-58.6	-42.6	-179.2	-68.2	164.3	0	0	0	110.8	I1065 L1068 L1069 L1076	I1065-I1072 HydrophobicContact CG2-CD1 4.35Å; L1068-I1072 HydrophobicContact CB-CD1 4.11Å; L1068-I1072 WeakPolarHBondContact O-CB 3.47Å; L1068-I1072 VanDerWaalsContact O-CG1 3.27Å; L1068-I1072 WeakPolarHBondContact O-CG1 3.11Å; L1068-I1072 PolarHBondContact O-N 3.37Å; L1069-I1072 PolarHBondContact O-N 3.09Å; I1072-L1076 HydrophobicContact CG2-CD1 3.83Å; I1072-L1076 HydrophobicContact CG2-CG 4.39Å; I1072-L1076 VanDerWaalsContact O-CB 3.27Å; I1072-L1076 WeakPolarHBondContact O-CB 3.42Å; I1072-L1076 WeakPolarHBondContact O-CG 3.2Å; I1072-L1076 PolarHBondContact O-N 3.47Å
1073	I	75	Confident	78.7	Confident	47 Å²	47	54.6 Å²	54.6	24%	0.241	29%	0.292	C	S	.	.	H	α-helix	trans	-67.3	-43.7	176.4	-70.4	164	0	0	0	110.6	F906 L1069 E1071 E1075 L1076 V1077	F906-I1073 HydrophobicContact CE1-CD1 3.84Å; F906-I1073 HydrophobicContact CZ-CD1 4.19Å; L1069-I1073 HydrophobicContact CB-CD1 4.45Å; L1069-I1073 HydrophobicContact CD2-CD1 4.39Å; L1069-I1073 VanDerWaalsContact O-CB 3.31Å; L1069-I1073 WeakPolarHBondContact O-CB 3.44Å; L1069-I1073 WeakPolarHBondContact O-CD1 3.44Å; L1069-I1073 VanDerWaalsContact O-CG1 3.24Å; L1069-I1073 WeakPolarHBondContact O-CG1 3.48Å; L1069-I1073 PolarHBondContact O-N 3.3Å; E1071-I1073 VanDerWaalsContact C-N 3.31Å; E1071-I1073 PolarHBondContact O-N 3.03Å; I1073-E1075 PolarHBondContact O-N 3.25Å; I1073-L1076 PolarHBondContact O-N 3.37Å; I1073-V1077 WeakPolarHBondContact O-CG2 3.44Å; I1073-V1077 PolarHBondContact O-N 3.12Å
1074	N	70.7	Confident	77.8	Confident	68 Å²	68	61 Å²	61	36%	0.364	32%	0.321	S	S	.	.	H	α-helix	trans	-63.6	-39.4	177.6	-85.9	-65	0	0	0	112.5	D1070 E1071 V1077 N1078	D1070-N1074 PolarHBondContact O-N 3.29Å; D1070-N1074 PolarHBondContact O-ND2 2.91Å; E1071-N1074 PolarHBondContact O-N 3.1Å; E1071-N1074 VanDerWaalsContact O-N 3.12Å; N1074-V1077 PolarHBondContact O-N 3.49Å; N1074-N1078 PolarHBondContact O-N 3.06Å; N1074-N1078 PolarHBondContact O-ND2 2.87Å
1075	E	76.1	Confident	76.9	Confident	64 Å²	64	63.8 Å²	63.8	30%	0.299	34%	0.341	S	S	.	.	H	α-helix	trans	-71.2	-39.4	172.1	-75.6	-47.4	121.2	0	0	112.7	R6 E1071 I1073 V1077 N1078 L1079	R6-E1075 IonicContact CZ-OE1 3.9Å; R6-E1075 IonicContact NH1-OE1 3.64Å; R6-E1075 PolarHBondContact NH1-OE1 2.79Å; R6-E1075 IonicContact NH2-OE1 3.19Å; E1071-E1075 HydrophobicContact CG-CG 4.28Å; E1071-E1075 PolarHBondContact O-N 3.26Å; I1073-E1075 PolarHBondContact O-N 3.25Å; E1075-V1077 PolarHBondContact O-N 3.22Å; E1075-N1078 PolarHBondContact O-N 2.89Å; E1075-N1078 PolarHBondContact OE1-ND2 3.43Å; E1075-L1079 HydrophobicContact CB-CD1 4.41Å; E1075-L1079 WeakPolarHBondContact O-CB 3.45Å; E1075-L1079 WeakPolarHBondContact O-CD1 3.16Å; E1075-L1079 PolarHBondContact O-N 3.42Å
1076	L	68.6	Low	75.9	Confident	67 Å²	67	61.4 Å²	61.4	35%	0.351	33%	0.33	S	S	.	.	H	α-helix	trans	-61.1	-30.7	172.4	-75.7	169.8	0	0	0	112.2	I1072 I1073 A1080 V1086	I1072-L1076 HydrophobicContact CG2-CD1 3.83Å; I1072-L1076 HydrophobicContact CG2-CG 4.39Å; I1072-L1076 VanDerWaalsContact O-CB 3.27Å; I1072-L1076 WeakPolarHBondContact O-CB 3.42Å; I1072-L1076 WeakPolarHBondContact O-CG 3.2Å; I1072-L1076 PolarHBondContact O-N 3.47Å; I1073-L1076 PolarHBondContact O-N 3.37Å; L1076-A1080 WeakPolarHBondContact O-CB 3.38Å; L1076-A1080 PolarHBondContact O-N 3.28Å; L1076-V1086 HydrophobicContact CD2-CG1 3.86Å
1077	V	71.9	Confident	74.9	Confident	78 Å²	78	66.2 Å²	66.2	47%	0.473	35%	0.346	S	S	.	.	H	α-helix	trans	-73	-46.8	171.5	170.8	0	0	0	0	111.4	I1073 N1074 E1075 L1079 A1080 G1081 L1090	I1073-V1077 WeakPolarHBondContact O-CG2 3.44Å; I1073-V1077 PolarHBondContact O-N 3.12Å; N1074-V1077 PolarHBondContact O-N 3.49Å; E1075-V1077 PolarHBondContact O-N 3.22Å; V1077-L1079 VanDerWaalsContact C-N 3.31Å; V1077-L1079 PolarHBondContact O-N 2.87Å; V1077-A1080 PolarHBondContact O-N 2.79Å; V1077-G1081 PolarHBondContact O-N 3.5Å; V1077-L1090 HydrophobicContact CG2-CD2 4.09Å
1078	N	74.6	Confident	74.1	Confident	62 Å²	62	67.7 Å²	67.7	33%	0.332	36%	0.356	S	S	.	.	H	α-helix	trans	-56.3	-43.7	173.2	-76.9	-45.8	0	0	0	111.5	M1 N1074 E1075 G1081	M1-N1078 PolarHBondContact N-OD1 3.45Å; M1-N1078 VanDerWaalsContact N-OD1 3.13Å; N1074-N1078 PolarHBondContact O-N 3.06Å; N1074-N1078 PolarHBondContact O-ND2 2.87Å; E1075-N1078 PolarHBondContact O-N 2.89Å; E1075-N1078 PolarHBondContact OE1-ND2 3.43Å; N1078-G1081 PolarHBondContact O-N 2.91Å
1079	L	68.9	Low	73.5	Confident	73 Å²	73	68.9 Å²	68.9	38%	0.382	37%	0.366	S	S	.	.	H	α-helix	trans	-74.7	-32	177.4	-86.2	80.6	0	0	0	112.7	E1075 V1077 G1081 R1082 V1083 V1086	E1075-L1079 HydrophobicContact CB-CD1 4.41Å; E1075-L1079 WeakPolarHBondContact O-CB 3.45Å; E1075-L1079 WeakPolarHBondContact O-CD1 3.16Å; E1075-L1079 PolarHBondContact O-N 3.42Å; V1077-L1079 VanDerWaalsContact C-N 3.31Å; V1077-L1079 PolarHBondContact O-N 2.87Å; L1079-G1081 PolarHBondContact O-N 3.48Å; L1079-R1082 CarbonylContact O-C 3.44Å; L1079-R1082 WeakPolarHBondContact O-CA 3.33Å; L1079-R1082 PolarHBondContact O-N 2.99Å; L1079-V1083 PolarHBondContact O-N 2.69Å; L1079-V1086 HydrophobicContact CB-CG1 4.36Å
1080	A	67	Low	72.9	Confident	11 Å²	11	68.3 Å²	68.3	9%	0.091	36%	0.363	C	S	.	.	H	α-helix	trans	-64.2	-22.1	173.1	0	0	0	0	0	112.9	L1076 V1077 R1082 V1086 R1087 L1090	L1076-A1080 WeakPolarHBondContact O-CB 3.38Å; L1076-A1080 PolarHBondContact O-N 3.28Å; V1077-A1080 PolarHBondContact O-N 2.79Å; A1080-R1082 VanDerWaalsContact C-N 3.31Å; A1080-V1086 HydrophobicContact CB-CG1 4.16Å; A1080-R1087 HydrophobicContact CB-CB 4.09Å; A1080-R1087 HydrophobicContact CB-CG 4.38Å; A1080-L1090 HydrophobicContact CB-CD2 4.02Å
1081	G	68.2	Low	73	Confident	71 Å²	71	74.2 Å²	74.2	73%	0.732	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-23.6	167.7	0	0	0	0	0	114	V1077 N1078 L1079	V1077-G1081 PolarHBondContact O-N 3.5Å; N1078-G1081 PolarHBondContact O-N 2.91Å; L1079-G1081 PolarHBondContact O-N 3.48Å
1082	R	74.4	Confident	72.8	Confident	218 Å²	218	73.5 Å²	73.5	82%	0.823	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	-31.3	-178.2	-65.1	-179.6	177.5	174.4	-1.4	114.2	L1079 A1080	L1079-R1082 CarbonylContact O-C 3.44Å; L1079-R1082 WeakPolarHBondContact O-CA 3.33Å; L1079-R1082 PolarHBondContact O-N 2.99Å; A1080-R1082 VanDerWaalsContact C-N 3.31Å
1083	V	76.2	Confident	72.8	Confident	58 Å²	58	74.8 Å²	74.8	35%	0.352	40%	0.396	S	S	.	.			trans	-125.9	113.8	-165.5	-169.4	0	0	0	0	111.1	L1079 S1085 V1086 R1087	L1079-V1083 PolarHBondContact O-N 2.69Å; V1083-S1085 VanDerWaalsContact C-N 3.32Å; V1083-S1085 WeakPolarHBondContact CG1-OG 3.47Å; V1083-S1085 PolarHBondContact O-N 2.94Å; V1083-V1086 HydrophobicContact CB-CB 4.19Å; V1083-V1086 HydrophobicContact CB-CG2 3.85Å; V1083-V1086 HydrophobicContact CG1-CG2 3.92Å; V1083-V1086 PolarHBondContact O-N 2.72Å; V1083-R1087 PolarHBondContact O-N 3.38Å
1084	H	73.2	Confident	72.9	Confident	134 Å²	134	77.2 Å²	77.2	62%	0.62	41%	0.408	S	S	*	.	H	α-helix	trans	-65.9	-30.2	-174	-168.7	-91.6	0	0	0	114	R1087 S1088	H1084-R1087 PolarHBondContact O-N 3.33Å; H1084-S1088 PolarHBondContact CE1-OG 2.96Å; H1084-S1088 WeakPolarHBondContact O-CB 3.45Å; H1084-S1088 PolarHBondContact O-N 3.47Å; H1084-S1088 PolarHBondContact O-OG 2.94Å
1085	S	75.2	Confident	73.1	Confident	62 Å²	62	78.3 Å²	78.3	43%	0.434	41%	0.411	S	S	.	.	H	α-helix	trans	-66.2	-43.6	173.9	56.6	0	0	0	0	111.6	V1083 S1088 C1089	V1083-S1085 VanDerWaalsContact C-N 3.32Å; V1083-S1085 WeakPolarHBondContact CG1-OG 3.47Å; V1083-S1085 PolarHBondContact O-N 2.94Å; S1085-S1088 PolarHBondContact O-N 3.4Å; S1085-C1089 WeakPolarHBondContact O-CB 3.46Å; S1085-C1089 PolarHBondContact O-N 3.11Å
1086	V	71	Confident	73	Confident	30 Å²	30	79.2 Å²	79.2	18%	0.182	42%	0.421	C	S	.	.	H	α-helix	trans	-61.4	-47.2	174	-177.5	0	0	0	0	110.3	L1076 L1079 A1080 V1083 S1088 C1089 L1090	L1076-V1086 HydrophobicContact CD2-CG1 3.86Å; L1079-V1086 HydrophobicContact CB-CG1 4.36Å; A1080-V1086 HydrophobicContact CB-CG1 4.16Å; V1083-V1086 HydrophobicContact CB-CB 4.19Å; V1083-V1086 HydrophobicContact CB-CG2 3.85Å; V1083-V1086 HydrophobicContact CG1-CG2 3.92Å; V1083-V1086 PolarHBondContact O-N 2.72Å; V1086-S1088 VanDerWaalsContact C-N 3.26Å; V1086-S1088 PolarHBondContact O-N 3.04Å; V1086-C1089 PolarHBondContact O-N 3.38Å; V1086-L1090 WeakPolarHBondContact O-CB 3.46Å; V1086-L1090 PolarHBondContact O-N 3.05Å
1087	R	71	Confident	73.2	Confident	135 Å²	135	80.9 Å²	80.9	51%	0.509	42%	0.423	S	S	.	.	H	α-helix	trans	-58.5	-36.6	175.4	-162.3	178.2	-173	-165	4.8	112.8	A1080 V1083 H1084 K1091	A1080-R1087 HydrophobicContact CB-CB 4.09Å; A1080-R1087 HydrophobicContact CB-CG 4.38Å; V1083-R1087 PolarHBondContact O-N 3.38Å; H1084-R1087 PolarHBondContact O-N 3.33Å; R1087-K1091 WeakPolarHBondContact O-CB 3.41Å; R1087-K1091 WeakPolarHBondContact O-CG 3.16Å; R1087-K1091 PolarHBondContact O-N 2.85Å
1088	S	73.5	Confident	73.3	Confident	32 Å²	32	79.4 Å²	79.4	22%	0.224	42%	0.417	C	S	.	.	H	α-helix	trans	-74.2	-38.7	177.7	-59.9	0	0	0	0	112.4	H1084 S1085 V1086 C1092	H1084-S1088 PolarHBondContact CE1-OG 2.96Å; H1084-S1088 WeakPolarHBondContact O-CB 3.45Å; H1084-S1088 PolarHBondContact O-N 3.47Å; H1084-S1088 PolarHBondContact O-OG 2.94Å; S1085-S1088 PolarHBondContact O-N 3.4Å; V1086-S1088 VanDerWaalsContact C-N 3.26Å; V1086-S1088 PolarHBondContact O-N 3.04Å; S1088-C1092 WeakPolarHBondContact O-CB 3.48Å; S1088-C1092 PolarHBondContact O-N 3.29Å
1089	C	75	Confident	73.4	Confident	54 Å²	54	83.9 Å²	83.9	37%	0.365	43%	0.429	S	S	.	.	H	α-helix	trans	-65.4	-47.9	173.6	-167.7	0	0	0	0	111.1	F495 S1085 V1086 K1091 C1092 I1093	F495-C1089 HydrophobicContact CZ-CB 3.91Å; S1085-C1089 WeakPolarHBondContact O-CB 3.46Å; S1085-C1089 PolarHBondContact O-N 3.11Å; V1086-C1089 PolarHBondContact O-N 3.38Å; C1089-K1091 PolarHBondContact O-N 2.84Å; C1089-C1092 CarbonylContact O-C 3.56Å; C1089-C1092 WeakPolarHBondContact O-CA 3.41Å; C1089-C1092 VanDerWaalsContact O-CB 3.29Å; C1089-C1092 WeakPolarHBondContact O-CB 3.48Å; C1089-C1092 PolarHBondContact O-N 3.48Å; C1089-I1093 WeakPolarHBondContact O-CG1 3.4Å; C1089-I1093 PolarHBondContact O-N 3.24Å
1090	L	72.5	Confident	73.8	Confident	35 Å²	35	83.8 Å²	83.8	18%	0.183	43%	0.431	C	S	.	.	H	α-helix	trans	-59.3	-45.2	176.5	-171	68.8	0	0	0	111.5	V1077 A1080 V1086 C1092 I1093 I1094	V1077-L1090 HydrophobicContact CG2-CD2 4.09Å; A1080-L1090 HydrophobicContact CB-CD2 4.02Å; V1086-L1090 WeakPolarHBondContact O-CB 3.46Å; V1086-L1090 PolarHBondContact O-N 3.05Å; L1090-C1092 VanDerWaalsContact C-N 3.29Å; L1090-C1092 PolarHBondContact O-N 3.05Å; L1090-I1093 PolarHBondContact O-N 2.82Å; L1090-I1094 HydrophobicContact CD1-CD1 4.46Å; L1090-I1094 HydrophobicContact CG-CD1 3.96Å; L1090-I1094 WeakPolarHBondContact O-CB 3.36Å; L1090-I1094 VanDerWaalsContact O-CG1 3.28Å; L1090-I1094 WeakPolarHBondContact O-CG1 3.35Å; L1090-I1094 PolarHBondContact O-N 2.93Å
1091	K	74.8	Confident	74.2	Confident	132 Å²	132	85.9 Å²	85.9	57%	0.574	44%	0.441	S	S	*	.	H	α-helix	trans	-60.1	-36.2	171.3	-80.1	-176.1	175.9	-171.7	0	112.7	R1087 C1089 H1095	R1087-K1091 WeakPolarHBondContact O-CB 3.41Å; R1087-K1091 WeakPolarHBondContact O-CG 3.16Å; R1087-K1091 PolarHBondContact O-N 2.85Å; C1089-K1091 PolarHBondContact O-N 2.84Å; K1091-H1095 WeakPolarHBondContact O-CB 3.24Å; K1091-H1095 PolarHBondContact O-N 3.46Å
1092	C	74.5	Confident	74.5	Confident	44 Å²	44	88.1 Å²	88.1	30%	0.297	43%	0.432	S	S	.	.	H	α-helix	trans	-67.9	-44.3	175.8	-168	0	0	0	0	111.5	S1088 C1089 L1090 H1095 T1096	S1088-C1092 WeakPolarHBondContact O-CB 3.48Å; S1088-C1092 PolarHBondContact O-N 3.29Å; C1089-C1092 CarbonylContact O-C 3.56Å; C1089-C1092 WeakPolarHBondContact O-CA 3.41Å; C1089-C1092 VanDerWaalsContact O-CB 3.29Å; C1089-C1092 WeakPolarHBondContact O-CB 3.48Å; C1089-C1092 PolarHBondContact O-N 3.48Å; L1090-C1092 VanDerWaalsContact C-N 3.29Å; L1090-C1092 PolarHBondContact O-N 3.05Å; C1092-H1095 PolarHBondContact O-N 2.75Å; C1092-T1096 WeakPolarHBondContact O-CB 3.38Å; C1092-T1096 PolarHBondContact O-N 3.47Å; C1092-T1096 PolarHBondContact O-OG1 3.46Å; C1092-T1096 VanDerWaalsContact O-OG1 3.05Å
1093	I	77.3	Confident	74.7	Confident	96 Å²	96	84.3 Å²	84.3	49%	0.492	42%	0.421	S	S	.	.	H	α-helix	trans	-60.7	-52	175.7	-66.9	164.1	0	0	0	110.4	C1089 L1090 H1095 T1096 Y1097	C1089-I1093 WeakPolarHBondContact O-CG1 3.4Å; C1089-I1093 PolarHBondContact O-N 3.24Å; L1090-I1093 PolarHBondContact O-N 2.82Å; I1093-H1095 VanDerWaalsContact C-N 3.3Å; I1093-H1095 PolarHBondContact O-N 3.35Å; I1093-T1096 PolarHBondContact O-N 2.97Å; I1093-T1096 VanDerWaalsContact O-N 3.14Å; I1093-Y1097 VanDerWaalsContact O-CB 3.25Å; I1093-Y1097 WeakPolarHBondContact O-CB 3.4Å; I1093-Y1097 PolarHBondContact O-N 2.89Å
1094	I	77.3	Confident	74.7	Confident	97 Å²	97	88.4 Å²	88.4	50%	0.497	44%	0.435	S	S	.	.	H	α-helix	trans	-57.8	-41.4	177.6	-67.8	166.6	0	0	0	111.2	L1090 Y1097 S1098	L1090-I1094 HydrophobicContact CD1-CD1 4.46Å; L1090-I1094 HydrophobicContact CG-CD1 3.96Å; L1090-I1094 WeakPolarHBondContact O-CB 3.36Å; L1090-I1094 VanDerWaalsContact O-CG1 3.28Å; L1090-I1094 WeakPolarHBondContact O-CG1 3.35Å; L1090-I1094 PolarHBondContact O-N 2.93Å; I1094-Y1097 PolarHBondContact O-N 3.14Å; I1094-S1098 WeakPolarHBondContact O-CB 3.4Å; I1094-S1098 PolarHBondContact O-N 2.97Å; I1094-S1098 PolarHBondContact O-OG 3.35Å
1095	H	73.1	Confident	74.8	Confident	92 Å²	92	90.9 Å²	90.9	43%	0.426	44%	0.439	S	S	.	.	H	α-helix	trans	-71.2	-34.2	178	-170.2	-18.3	0	0	0	112.9	K1091 C1092 I1093 S1098 R1099	K1091-H1095 WeakPolarHBondContact O-CB 3.24Å; K1091-H1095 PolarHBondContact O-N 3.46Å; C1092-H1095 PolarHBondContact O-N 2.75Å; I1093-H1095 VanDerWaalsContact C-N 3.3Å; I1093-H1095 PolarHBondContact O-N 3.35Å; H1095-S1098 PolarHBondContact O-OG 3.36Å; H1095-R1099 PolarHBondContact CE1-NE 3.26Å; H1095-R1099 WeakPolarHBondContact O-CB 3.44Å; H1095-R1099 WeakPolarHBondContact O-CG 3.49Å; H1095-R1099 PolarHBondContact O-N 3.24Å
1096	T	75.5	Confident	74.8	Confident	82 Å²	82	94 Å²	94	50%	0.503	45%	0.446	S	S	.	.	H	α-helix	trans	-68.9	-43.4	172.6	-62.9	0	0	0	0	110.6	C1092 I1093 R1099 T1100	C1092-T1096 WeakPolarHBondContact O-CB 3.38Å; C1092-T1096 PolarHBondContact O-N 3.47Å; C1092-T1096 PolarHBondContact O-OG1 3.46Å; C1092-T1096 VanDerWaalsContact O-OG1 3.05Å; I1093-T1096 PolarHBondContact O-N 2.97Å; I1093-T1096 VanDerWaalsContact O-N 3.14Å; T1096-R1099 PolarHBondContact O-N 2.8Å; T1096-T1100 PolarHBondContact O-N 2.83Å; T1096-T1100 PolarHBondContact O-OG1 3.13Å
1097	Y	72.7	Confident	75.1	Confident	102 Å²	102	98.3 Å²	98.3	40%	0.4	47%	0.468	S	S	.	.	H	α-helix	trans	-61.2	-49.3	177.5	-180	-113.3	0	0	0	112.2	I905 I1093 I1094 R1099 T1100 I1101	I905-Y1097 WeakPolarHBondContact CD1-OH 3.44Å; I905-Y1097 HydrophobicContact CG1-CE2 4.48Å; I905-Y1097 VanDerWaalsContact CG1-OH 3.28Å; I905-Y1097 WeakPolarHBondContact CG1-OH 3.45Å; I905-Y1097 HydrophobicContact CG2-CE2 4.44Å; I1093-Y1097 VanDerWaalsContact O-CB 3.25Å; I1093-Y1097 WeakPolarHBondContact O-CB 3.4Å; I1093-Y1097 PolarHBondContact O-N 2.89Å; I1094-Y1097 PolarHBondContact O-N 3.14Å; Y1097-R1099 VanDerWaalsContact C-N 3.33Å; Y1097-R1099 PolarHBondContact O-N 2.81Å; Y1097-T1100 WeakPolarHBondContact CA-OG1 3.33Å; Y1097-T1100 PolarHBondContact O-N 3.4Å; Y1097-T1100 PolarHBondContact O-OG1 2.99Å; Y1097-I1101 HydrophobicContact CD1-CD1 4.02Å; Y1097-I1101 HydrophobicContact CD2-CD1 4.5Å; Y1097-I1101 HydrophobicContact CE1-CD1 3.52Å; Y1097-I1101 HydrophobicContact CE2-CD1 4.05Å; Y1097-I1101 HydrophobicContact CG-CD1 4.49Å; Y1097-I1101 PolarHBondContact O-N 3.46Å
1098	S	73.2	Confident	75.1	Confident	48 Å²	48	98.6 Å²	98.6	34%	0.336	47%	0.473	S	S	.	.	H	α-helix	trans	-61.5	-39.9	176.2	68.3	0	0	0	0	112	I1094 H1095 T1100 I1101 Q1102	I1094-S1098 WeakPolarHBondContact O-CB 3.4Å; I1094-S1098 PolarHBondContact O-N 2.97Å; I1094-S1098 PolarHBondContact O-OG 3.35Å; H1095-S1098 PolarHBondContact O-OG 3.36Å; S1098-T1100 PolarHBondContact O-N 2.78Å; S1098-I1101 PolarHBondContact O-N 3.49Å; S1098-Q1102 WeakPolarHBondContact O-CB 3.39Å; S1098-Q1102 WeakPolarHBondContact O-CG 3.35Å; S1098-Q1102 PolarHBondContact O-N 3.35Å
1099	R	77.6	Confident	75.1	Confident	155 Å²	155	100.9 Å²	100.9	59%	0.585	49%	0.485	S	S	*	.	H	α-helix	trans	-61.9	-38.7	171.1	-83.8	-177.9	165.1	-179.5	-1.2	112.8	H1095 T1096 Y1097 K1103	H1095-R1099 PolarHBondContact CE1-NE 3.26Å; H1095-R1099 WeakPolarHBondContact O-CB 3.44Å; H1095-R1099 WeakPolarHBondContact O-CG 3.49Å; H1095-R1099 PolarHBondContact O-N 3.24Å; T1096-R1099 PolarHBondContact O-N 2.8Å; Y1097-R1099 VanDerWaalsContact C-N 3.33Å; Y1097-R1099 PolarHBondContact O-N 2.81Å; R1099-K1103 WeakPolarHBondContact O-CB 3.43Å; R1099-K1103 WeakPolarHBondContact O-CG 3.42Å; R1099-K1103 PolarHBondContact O-N 3.41Å
1100	T	76.8	Confident	74.8	Confident	71 Å²	71	104.3 Å²	104.3	44%	0.436	50%	0.496	S	S	.	.	H	α-helix	trans	-70.3	-35.7	175.6	48.7	0	0	0	0	113	T1096 Y1097 S1098 K1104	T1096-T1100 PolarHBondContact O-N 2.83Å; T1096-T1100 PolarHBondContact O-OG1 3.13Å; Y1097-T1100 WeakPolarHBondContact CA-OG1 3.33Å; Y1097-T1100 PolarHBondContact O-N 3.4Å; Y1097-T1100 PolarHBondContact O-OG1 2.99Å; S1098-T1100 PolarHBondContact O-N 2.78Å; T1100-K1104 PolarHBondContact O-N 2.77Å
1101	I	75.5	Confident	74.4	Confident	55 Å²	55	109.5 Å²	109.5	28%	0.282	51%	0.514	S	S	.	.	H	α-helix	trans	-66.8	-46	173	-70.7	176.5	0	0	0	110.8	Y1097 S1098 K1103 K1104 R1105	Y1097-I1101 HydrophobicContact CD1-CD1 4.02Å; Y1097-I1101 HydrophobicContact CD2-CD1 4.5Å; Y1097-I1101 HydrophobicContact CE1-CD1 3.52Å; Y1097-I1101 HydrophobicContact CE2-CD1 4.05Å; Y1097-I1101 HydrophobicContact CG-CD1 4.49Å; Y1097-I1101 PolarHBondContact O-N 3.46Å; S1098-I1101 PolarHBondContact O-N 3.49Å; I1101-K1103 VanDerWaalsContact C-N 3.34Å; I1101-K1103 PolarHBondContact O-N 2.83Å; I1101-K1104 PolarHBondContact O-N 3.12Å; I1101-R1105 HydrophobicContact CG2-CG 4.47Å; I1101-R1105 PolarHBondContact O-N 2.75Å
1102	Q	73.5	Confident	74.1	Confident	118 Å²	118	108.4 Å²	108.4	55%	0.551	51%	0.514	S	S	*	.	H	α-helix	trans	-58.1	-45.3	175.5	-76.7	177.5	-25.8	0	0	111.4	S1098 R1105 Q1106	S1098-Q1102 WeakPolarHBondContact O-CB 3.39Å; S1098-Q1102 WeakPolarHBondContact O-CG 3.35Å; S1098-Q1102 PolarHBondContact O-N 3.35Å; Q1102-R1105 PolarHBondContact O-N 3.04Å; Q1102-Q1106 WeakPolarHBondContact O-CB 3.21Å; Q1102-Q1106 VanDerWaalsContact O-CG 3.31Å; Q1102-Q1106 WeakPolarHBondContact O-CG 3.45Å; Q1102-Q1106 PolarHBondContact O-N 2.97Å
1103	K	79.2	Confident	73.8	Confident	138 Å²	138	111.5 Å²	111.5	60%	0.6	53%	0.527	S	S	*	.	H	α-helix	trans	-61.6	-42.5	174.2	-77.3	-173.8	174.8	-165.6	0	113.1	R1099 I1101 Q1106 L1107	R1099-K1103 WeakPolarHBondContact O-CB 3.43Å; R1099-K1103 WeakPolarHBondContact O-CG 3.42Å; R1099-K1103 PolarHBondContact O-N 3.41Å; I1101-K1103 VanDerWaalsContact C-N 3.34Å; I1101-K1103 PolarHBondContact O-N 2.83Å; K1103-Q1106 PolarHBondContact O-N 2.88Å; K1103-L1107 WeakPolarHBondContact O-CB 3.37Å; K1103-L1107 VanDerWaalsContact O-CG 3.32Å; K1103-L1107 WeakPolarHBondContact O-CG 3.28Å; K1103-L1107 PolarHBondContact O-N 3.3Å
1104	K	76.1	Confident	73.2	Confident	145 Å²	145	113.9 Å²	113.9	63%	0.63	53%	0.534	S	S	*	.	H	α-helix	trans	-61	-48.3	174.4	-80.6	-170.7	174.4	-172.1	0	111.3	T1100 I1101 Q1106 L1107 F1108	T1100-K1104 PolarHBondContact O-N 2.77Å; I1101-K1104 PolarHBondContact O-N 3.12Å; K1104-Q1106 PolarHBondContact O-N 3.15Å; K1104-L1107 PolarHBondContact O-N 2.96Å; K1104-F1108 WeakPolarHBondContact O-CD2 3.48Å; K1104-F1108 PolarHBondContact O-N 3.18Å
1105	R	75.3	Confident	72.3	Confident	186 Å²	186	115.3 Å²	115.3	70%	0.702	54%	0.536	S	S	*	.	H	α-helix	trans	-58.9	-45.4	176.7	-71.7	-174.3	179.5	-173.2	0.5	111.7	I1101 Q1102 L1107 F1108 T1109	I1101-R1105 HydrophobicContact CG2-CG 4.47Å; I1101-R1105 PolarHBondContact O-N 2.75Å; Q1102-R1105 PolarHBondContact O-N 3.04Å; R1105-L1107 PolarHBondContact O-N 3.27Å; R1105-F1108 PolarHBondContact O-N 2.92Å; R1105-T1109 PolarHBondContact O-N 3.07Å; R1105-T1109 PolarHBondContact O-OG1 2.88Å
1106	Q	76.4	Confident	71.4	Confident	127 Å²	127	113.1 Å²	113.1	59%	0.593	54%	0.539	S	S	*	.	H	α-helix	trans	-60.7	-41.8	176.5	-76.5	174.3	-26.6	0	0	113	Q1102 K1103 K1104 T1109 H1110	Q1102-Q1106 WeakPolarHBondContact O-CB 3.21Å; Q1102-Q1106 VanDerWaalsContact O-CG 3.31Å; Q1102-Q1106 WeakPolarHBondContact O-CG 3.45Å; Q1102-Q1106 PolarHBondContact O-N 2.97Å; K1103-Q1106 PolarHBondContact O-N 2.88Å; K1104-Q1106 PolarHBondContact O-N 3.15Å; Q1106-T1109 WeakPolarHBondContact CA-OG1 3.39Å; Q1106-T1109 PolarHBondContact O-N 3.21Å; Q1106-T1109 PolarHBondContact O-OG1 3.45Å; Q1106-H1110 WeakPolarHBondContact O-CB 3.16Å; Q1106-H1110 PolarHBondContact O-N 2.71Å
1107	L	75.4	Confident	70.5	Confident	121 Å²	121	115.4 Å²	115.4	63%	0.634	55%	0.548	S	S	*	.	H	α-helix	trans	-65.1	-43.9	175.9	-74.3	167.2	0	0	0	111.8	K1103 K1104 R1105 H1110 Y1111	K1103-L1107 WeakPolarHBondContact O-CB 3.37Å; K1103-L1107 VanDerWaalsContact O-CG 3.32Å; K1103-L1107 WeakPolarHBondContact O-CG 3.28Å; K1103-L1107 PolarHBondContact O-N 3.3Å; K1104-L1107 PolarHBondContact O-N 2.96Å; R1105-L1107 PolarHBondContact O-N 3.27Å; L1107-H1110 PolarHBondContact O-N 2.96Å; L1107-Y1111 WeakPolarHBondContact O-CB 3.49Å; L1107-Y1111 PolarHBondContact O-N 2.77Å
1108	F	71.8	Confident	69.5	Low	140 Å²	140	117.4 Å²	117.4	61%	0.614	57%	0.566	S	S	*	*	H	α-helix	trans	-62.2	-44.2	174.6	-88.6	-74	0	0	0	112.3	K1104 R1105 H1110 Y1111 N1112	K1104-F1108 WeakPolarHBondContact O-CD2 3.48Å; K1104-F1108 PolarHBondContact O-N 3.18Å; R1105-F1108 PolarHBondContact O-N 2.92Å; F1108-H1110 VanDerWaalsContact C-N 3.35Å; F1108-H1110 PolarHBondContact O-N 3.36Å; F1108-Y1111 PolarHBondContact O-N 3.16Å; F1108-N1112 PolarHBondContact O-N 3.42Å
1109	T	72.9	Confident	68	Low	80 Å²	80	127.4 Å²	127.4	49%	0.491	60%	0.603	S	S	.	*	H	α-helix	trans	-63.1	-40.3	175.4	48.7	0	0	0	0	112.2	R1105 Q1106 N1112 I1113	R1105-T1109 PolarHBondContact O-N 3.07Å; R1105-T1109 PolarHBondContact O-OG1 2.88Å; Q1106-T1109 WeakPolarHBondContact CA-OG1 3.39Å; Q1106-T1109 PolarHBondContact O-N 3.21Å; Q1106-T1109 PolarHBondContact O-OG1 3.45Å; T1109-N1112 PolarHBondContact O-N 3.4Å; T1109-I1113 WeakPolarHBondContact O-CB 3.28Å; T1109-I1113 WeakPolarHBondContact O-CD1 3.21Å; T1109-I1113 WeakPolarHBondContact O-CG1 3.4Å; T1109-I1113 PolarHBondContact O-N 3.12Å
1110	H	69.3	Low	67.6	Low	127 Å²	127	126.1 Å²	126.1	59%	0.588	60%	0.604	S	S	*	*	H	α-helix	trans	-69.3	-32.9	177.9	-171.2	-58.1	0	0	0	112.1	Q1106 L1107 F1108 K1114	Q1106-H1110 WeakPolarHBondContact O-CB 3.16Å; Q1106-H1110 PolarHBondContact O-N 2.71Å; L1107-H1110 PolarHBondContact O-N 2.96Å; F1108-H1110 VanDerWaalsContact C-N 3.35Å; F1108-H1110 PolarHBondContact O-N 3.36Å; H1110-K1114 VanDerWaalsContact O-CB 3.31Å; H1110-K1114 WeakPolarHBondContact O-CB 3.34Å; H1110-K1114 PolarHBondContact O-N 3.14Å; H1110-K1114 VanDerWaalsContact O-N 3.13Å
1111	Y	65.2	Low	67.1	Low	143 Å²	143	128.9 Å²	128.9	56%	0.561	61%	0.613	S	S	*	*	H	α-helix	trans	-68.2	-48.9	174.7	-161.5	-90.5	0	0	0	110.8	L1107 F1108 I1113 K1114 F1115	L1107-Y1111 WeakPolarHBondContact O-CB 3.49Å; L1107-Y1111 PolarHBondContact O-N 2.77Å; F1108-Y1111 PolarHBondContact O-N 3.16Å; Y1111-I1113 PolarHBondContact O-N 2.81Å; Y1111-K1114 PolarHBondContact O-N 3.47Å; Y1111-K1114 VanDerWaalsContact O-N 3.14Å; Y1111-F1115 AromaticContact CD1-CD2 3.87Å; Y1111-F1115 HydrophobicContact CD1-CD2 3.87Å; Y1111-F1115 HydrophobicContact CD1-CE2 4.22Å; Y1111-F1115 HydrophobicContact CD2-CE2 4.41Å; Y1111-F1115 AromaticContact CE1-CD2 3.57Å; Y1111-F1115 HydrophobicContact CE1-CD2 3.57Å; Y1111-F1115 AromaticContact CE1-CE2 3.56Å; Y1111-F1115 HydrophobicContact CE1-CE2 3.56Å; Y1111-F1115 HydrophobicContact CE1-CG 4.4Å; Y1111-F1115 HydrophobicContact CE1-CZ 4.36Å; Y1111-F1115 HydrophobicContact CE2-CD2 4.36Å; Y1111-F1115 AromaticContact CE2-CE2 3.8Å; Y1111-F1115 HydrophobicContact CE2-CE2 3.8Å; Y1111-F1115 HydrophobicContact CG-CD2 4.39Å; Y1111-F1115 AromaticContact CZ-CD2 3.85Å; Y1111-F1115 AromaticContact CZ-CE2 3.32Å; Y1111-F1115 PolarHBondContact O-N 2.96Å; Y1111-F1115 WeakPolarHBondContact OH-CE2 3.31Å
1112	N	67.1	Low	66.6	Low	109 Å²	109	133.1 Å²	133.1	58%	0.583	63%	0.632	S	S	*	*	H	α-helix	trans	-62.9	-39.9	178.8	-72.8	10.5	0	0	0	112.6	F1108 T1109 G1116	F1108-N1112 PolarHBondContact O-N 3.42Å; T1109-N1112 PolarHBondContact O-N 3.4Å; N1112-G1116 PolarHBondContact O-N 2.82Å
1113	I	68.8	Low	66.2	Low	110 Å²	110	133.9 Å²	133.9	56%	0.564	64%	0.636	S	S	*	*	H	α-helix	trans	-64.4	-40.3	174.3	-68.8	164.4	0	0	0	111	T1109 Y1111 G1116 N1117	T1109-I1113 WeakPolarHBondContact O-CB 3.28Å; T1109-I1113 WeakPolarHBondContact O-CD1 3.21Å; T1109-I1113 WeakPolarHBondContact O-CG1 3.4Å; T1109-I1113 PolarHBondContact O-N 3.12Å; Y1111-I1113 PolarHBondContact O-N 2.81Å; I1113-G1116 PolarHBondContact O-N 3.15Å; I1113-N1117 PolarHBondContact O-N 2.86Å
1114	K	64.3	Low	65.4	Low	145 Å²	145	133.7 Å²	133.7	63%	0.63	64%	0.639	S	S	*	*	H	α-helix	trans	-72	-30.1	-178.2	-165	175.9	-177.9	-175.5	0	113.4	H1110 Y1111	H1110-K1114 VanDerWaalsContact O-CB 3.31Å; H1110-K1114 WeakPolarHBondContact O-CB 3.34Å; H1110-K1114 PolarHBondContact O-N 3.14Å; H1110-K1114 VanDerWaalsContact O-N 3.13Å; Y1111-K1114 PolarHBondContact O-N 3.47Å; Y1111-K1114 VanDerWaalsContact O-N 3.14Å
1115	F	58.4	Low	64.7	Low	127 Å²	127	132.9 Å²	132.9	56%	0.557	64%	0.639	S	S	*	*	H	α-helix	trans	-85.6	-29.4	172.6	-86.2	-93.6	0	0	0	113.2	Y1111 N1117 N1118	Y1111-F1115 AromaticContact CD1-CD2 3.87Å; Y1111-F1115 HydrophobicContact CD1-CD2 3.87Å; Y1111-F1115 HydrophobicContact CD1-CE2 4.22Å; Y1111-F1115 HydrophobicContact CD2-CE2 4.41Å; Y1111-F1115 AromaticContact CE1-CD2 3.57Å; Y1111-F1115 HydrophobicContact CE1-CD2 3.57Å; Y1111-F1115 AromaticContact CE1-CE2 3.56Å; Y1111-F1115 HydrophobicContact CE1-CE2 3.56Å; Y1111-F1115 HydrophobicContact CE1-CG 4.4Å; Y1111-F1115 HydrophobicContact CE1-CZ 4.36Å; Y1111-F1115 HydrophobicContact CE2-CD2 4.36Å; Y1111-F1115 AromaticContact CE2-CE2 3.8Å; Y1111-F1115 HydrophobicContact CE2-CE2 3.8Å; Y1111-F1115 HydrophobicContact CG-CD2 4.39Å; Y1111-F1115 AromaticContact CZ-CD2 3.85Å; Y1111-F1115 AromaticContact CZ-CE2 3.32Å; Y1111-F1115 PolarHBondContact O-N 2.96Å; Y1111-F1115 WeakPolarHBondContact OH-CE2 3.31Å; F1115-N1117 VanDerWaalsContact C-N 3.31Å; F1115-N1117 PolarHBondContact O-N 3.34Å; F1115-N1118 PolarHBondContact O-N 3.46Å
1116	G	54.3	Low	63.9	Low	47 Å²	47	129.1 Å²	129.1	49%	0.485	64%	0.635	S	S	.	*	H	α-helix	trans	-66	-28	177.6	0	0	0	0	0	114.4	N1112 I1113 N1118	N1112-G1116 PolarHBondContact O-N 2.82Å; I1113-G1116 PolarHBondContact O-N 3.15Å; G1116-N1118 VanDerWaalsContact C-N 3.34Å
1117	N	57.2	Low	63	Low	130 Å²	130	129.3 Å²	129.3	70%	0.695	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	6.3	179	-74.3	10.7	0	0	0	114.5	I1113 F1115	I1113-N1117 PolarHBondContact O-N 2.86Å; F1115-N1117 VanDerWaalsContact C-N 3.31Å; F1115-N1117 PolarHBondContact O-N 3.34Å
1118	N	51.9	Low	61.9	Low	143 Å²	143	130 Å²	130	77%	0.765	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.8	27.5	178.2	-82.2	12.3	0	0	0	112.4	F1115 G1116	F1115-N1118 PolarHBondContact O-N 3.46Å; G1116-N1118 VanDerWaalsContact C-N 3.34Å
1119	K	42.1	Very low	61	Low	259 Å²	259	129.1 Å²	129.1	100%	1.126	64%	0.64	S	S	*	*			trans	-126.1	0	168.1	-76.2	-173.1	175.3	-177.9	0	109.1

Retrieved 1,119 of 1,119 residues in 1229.9 ms (Link to these results)

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