A0A096MNC6_PAPAN Loading...

Tubulin gamma complex component 3

AlphaFold DB , UniProt , Accession A0A096MNC6, Species PAPAN (Papio anubis, Olive baboon), Gene TUBGCP3, Length 907 aa.

						>A0A096MNC6_PAPAN|A0A096MNC6|TUBGCP3
MATPDQKSPNVLLQNLCCRILGRSEADVAQQFQYAVRVIGSNFAPTVERDEFLVAEKIKKELIRQRREADAALFSELHRKLHSQGVLKNKWSILYLLLSLSEDPRRPPSKVSSYATLFAQALPRDAHSTPYYYARPQTLPLSYQDRSAQSAQSSGSVGSSGISSIGLCALSGPAPAPQSLLPGQSHQAPGVGDCLRQQLGSRLAWTLTANQPSSQATTSKGVPNAVSRNMTRSRREGDTGCTMEITEAALVRDILYVFQGIDGKNIKMNNTENCYKVEGKANLSRSLRDTAVRLSELGWLHNKIRRYTDQRSLDRSFGLVGQSFCAALHQELREYYRLLSVLHSQLQLEDDQGVNLGLESSLTLRRLLVWTYDPKIRLKTLAALVDHCQGRKGGELASAVHAYTKTGDPYMRSLVQHILSLVSHPVLSFLYRWIYDGELEDTYHEFFVASDPTVKTDRLWHDKYTLRKSMIPSFITMDQSRKVLLIGKSINFLHQVCHDQTPTTKMIAVTKSAESPQDAADLFTDLENAFQGKIDAAYFETSKYLLDVLNKKYSLLDHMQAMRRYLLLGQGDFIRHLMDLLKPELVRPATTLYQHNLTGILETAVRATNAQFDSPEILRRLDVRLLEVSPGDTGWDVFSLDYHVDGPIATVFTRECMSHYLRVFNFLWRAKRMEYILTDIRKGHMCNAKLLRNMPEFSGVLHQCHVLASEMVHFIHQMQYYITFEVLECSWDELWNKVQQAQDLDHIIAAHEVFLDTIISRCLLDGDSRALLNQLRAVFDQIIELQNAQDAIYRAALEELQRRLQFEEKKKQREIEGQWGVTAAEEEEENKRIGEFKESIPKMCSQLRILTHFYQGIVQQFLVLLTTSSDESLRFLSFRLDFNEHYKAREPRLRVSLGTRGRRSSHT
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.7	Very low	56.7	Low	251 Å²	251	114.5 Å²	114.5	100%	1.236	64%	0.638	S	S	*	*				0	128.5	0	-71.7	169.5	166.4	0	0	107.7
2	A	31.8	Very low	59	Low	96 Å²	96	112.9 Å²	112.9	79%	0.793	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-97.3	137.7	167.9	0	0	0	0	0	108.2
3	T	34.3	Very low	61	Low	136 Å²	136	106.2 Å²	106.2	83%	0.834	59%	0.589	S	S	*	*	P	Polyproline II helix	trans	-64.3	122.9	169.3	45.6	0	0	0	0	108.7	D5	T3-D5 PolarHBondContact O-N 2.75Å
4	P	43.7	Very low	62.6	Low	100 Å²	100	102 Å²	102	65%	0.649	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-64.7	133.4	178.5	27.1	-33.8	0	0	0	109.7	Q6	P4-Q6 PolarHBondContact O-N 2.95Å
5	D	44.5	Very low	64.1	Low	112 Å²	112	100.3 Å²	100.3	60%	0.599	55%	0.552	S	S	*	*			trans	-63.4	108.6	178.9	-132.5	-37.3	0	0	0	109.2	T3 K7 S8	T3-D5 PolarHBondContact O-N 2.75Å; D5-K7 PolarHBondContact O-N 3.39Å; D5-S8 WeakPolarHBondContact O-CB 3.26Å; D5-S8 PolarHBondContact O-N 2.77Å
6	Q	53.2	Low	65.5	Low	164 Å²	164	99.8 Å²	99.8	77%	0.766	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-3.1	-179.4	-67.9	-178.9	-18.9	0	0	113.5	P4	P4-Q6 PolarHBondContact O-N 2.95Å
7	K	58.6	Low	66.6	Low	174 Å²	174	94.9 Å²	94.9	76%	0.757	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-5.4	178.7	-61.1	164.4	-173.2	163.2	0	113	D5	D5-K7 PolarHBondContact O-N 3.39Å
8	S	78.2	Confident	67.7	Low	42 Å²	42	90.8 Å²	90.8	29%	0.294	50%	0.501	S	S	.	.			trans	-65.3	130.5	176.5	175.5	0	0	0	0	110.9	D5 N10 V11 L12	D5-S8 WeakPolarHBondContact O-CB 3.26Å; D5-S8 PolarHBondContact O-N 2.77Å; S8-N10 PolarHBondContact O-N 3.22Å; S8-V11 PolarHBondContact O-N 2.97Å; S8-V11 VanDerWaalsContact O-N 3.12Å; S8-L12 PolarHBondContact O-N 3.35Å
9	P	78.3	Confident	68.6	Low	63 Å²	63	97.6 Å²	97.6	41%	0.409	52%	0.518	S	S	.	.	H	α-helix	trans	-61.1	-28.7	-179.9	25.4	-34.2	0	0	0	112.3	L12 L13 F43	P9-L12 PolarHBondContact O-N 2.88Å; P9-L13 WeakPolarHBondContact O-CB 3.48Å; P9-L13 WeakPolarHBondContact O-CG 3.43Å; P9-L13 PolarHBondContact O-N 3.33Å; P9-F43 HydrophobicContact CB-CE2 4.49Å
10	N	80.8	Confident	69.5	Low	84 Å²	84	99.1 Å²	99.1	45%	0.449	53%	0.525	S	S	.	.	H	α-helix	trans	-69.6	-41	177.8	-63.4	-3.2	0	0	0	111.4	S8 L12 L13 Q14 F32	S8-N10 PolarHBondContact O-N 3.22Å; N10-L12 VanDerWaalsContact C-N 3.33Å; N10-L13 PolarHBondContact O-N 3.09Å; N10-Q14 PolarHBondContact O-N 3.25Å; N10-F32 HydrophobicContact CB-CZ 4.46Å; N10-F32 WeakPolarHBondContact O-CE2 3.5Å
11	V	83.3	Confident	70.2	Confident	38 Å²	38	98 Å²	98	23%	0.23	52%	0.519	C	S	.	.	H	α-helix	trans	-67.1	-36.9	175.3	178.2	0	0	0	0	110.5	S8 Q14 N15	S8-V11 PolarHBondContact O-N 2.97Å; S8-V11 VanDerWaalsContact O-N 3.12Å; V11-Q14 PolarHBondContact O-N 3.09Å; V11-N15 PolarHBondContact O-N 2.98Å; V11-N15 PolarHBondContact O-ND2 3.06Å
12	L	84.3	Confident	72.4	Confident	95 Å²	95	89.5 Å²	89.5	50%	0.497	50%	0.496	S	S	.	.	H	α-helix	trans	-67.9	-37.1	174.6	-66.8	170.7	0	0	0	112.5	S8 P9 N10 N15 L16	S8-L12 PolarHBondContact O-N 3.35Å; P9-L12 PolarHBondContact O-N 2.88Å; N10-L12 VanDerWaalsContact C-N 3.33Å; L12-N15 PolarHBondContact O-N 3.2Å; L12-L16 WeakPolarHBondContact O-CB 3.37Å; L12-L16 PolarHBondContact O-N 2.88Å
13	L	85.7	Confident	74.8	Confident	26 Å²	26	92.3 Å²	92.3	14%	0.136	49%	0.486	C	S	.	.	H	α-helix	trans	-65.3	-39.9	172.3	-77	170	0	0	0	112.3	P9 N10 L16 C17 F32 I39	P9-L13 WeakPolarHBondContact O-CB 3.48Å; P9-L13 WeakPolarHBondContact O-CG 3.43Å; P9-L13 PolarHBondContact O-N 3.33Å; N10-L13 PolarHBondContact O-N 3.09Å; L13-L16 PolarHBondContact O-N 2.72Å; L13-C17 PolarHBondContact O-N 2.95Å; L13-C17 PolarHBondContact O-SG 3.36Å; L13-F32 HydrophobicContact CB-CD2 4.44Å; L13-F32 HydrophobicContact CB-CE2 4.03Å; L13-I39 HydrophobicContact CD1-CB 4.04Å; L13-I39 HydrophobicContact CD1-CG1 4.19Å; L13-I39 HydrophobicContact CD1-CG2 4.02Å; L13-I39 HydrophobicContact CD2-CG1 4.12Å
14	Q	83.5	Confident	77	Confident	47 Å²	47	90 Å²	90	22%	0.22	48%	0.475	C	S	.	.	H	α-helix	trans	-62.4	-48	175.7	-164.8	-179.7	-10.3	0	0	110.7	N10 V11 L16 C17 C18 E25 F32	N10-Q14 PolarHBondContact O-N 3.25Å; V11-Q14 PolarHBondContact O-N 3.09Å; Q14-L16 VanDerWaalsContact C-N 3.32Å; Q14-L16 PolarHBondContact O-N 2.89Å; Q14-C17 PolarHBondContact O-N 2.76Å; Q14-C18 PolarHBondContact O-N 3Å; Q14-C18 PolarHBondContact O-SG 2.82Å; Q14-E25 HydrophobicContact CG-CG 4.43Å; Q14-E25 PolarHBondContact NE2-OE2 3.43Å; Q14-F32 HydrophobicContact CB-CD2 3.86Å; Q14-F32 HydrophobicContact CB-CE2 3.66Å; Q14-F32 HydrophobicContact CB-CG 4.4Å; Q14-F32 HydrophobicContact CB-CZ 4.02Å; Q14-F32 HydrophobicContact CG-CD1 4.44Å; Q14-F32 HydrophobicContact CG-CD2 4.26Å; Q14-F32 HydrophobicContact CG-CE2 4.36Å; Q14-F32 HydrophobicContact CG-CG 4.31Å; Q14-F32 HydrophobicContact CG-CZ 4.47Å
15	N	85	Confident	78.4	Confident	76 Å²	76	90.1 Å²	90.1	41%	0.406	47%	0.467	S	S	.	.	H	α-helix	trans	-57.6	-41.5	173.3	-81.1	-64	0	0	0	112.8	V11 L12 C18 R19	V11-N15 PolarHBondContact O-N 2.98Å; V11-N15 PolarHBondContact O-ND2 3.06Å; L12-N15 PolarHBondContact O-N 3.2Å; N15-C18 PolarHBondContact O-N 3.36Å; N15-R19 WeakPolarHBondContact O-CB 3.42Å; N15-R19 WeakPolarHBondContact O-CG 3.49Å; N15-R19 PolarHBondContact O-N 3.28Å
16	L	86.3	Confident	79.8	Confident	93 Å²	93	88.9 Å²	88.9	49%	0.487	47%	0.472	S	S	.	.	H	α-helix	trans	-63	-44.5	176.8	-178.7	63.7	0	0	0	111.7	L12 L13 Q14 C18 R19 I20	L12-L16 WeakPolarHBondContact O-CB 3.37Å; L12-L16 PolarHBondContact O-N 2.88Å; L13-L16 PolarHBondContact O-N 2.72Å; Q14-L16 VanDerWaalsContact C-N 3.32Å; Q14-L16 PolarHBondContact O-N 2.89Å; L16-C18 PolarHBondContact O-N 3.26Å; L16-R19 PolarHBondContact O-N 3.27Å; L16-I20 HydrophobicContact CD1-CD1 3.84Å; L16-I20 HydrophobicContact CD1-CG1 4.25Å; L16-I20 HydrophobicContact CG-CD1 3.88Å; L16-I20 WeakPolarHBondContact O-CG1 3.26Å; L16-I20 PolarHBondContact O-N 3.4Å
17	C	84.9	Confident	80.8	Confident	16 Å²	16	86.5 Å²	86.5	11%	0.108	47%	0.465	C	S	.	.	H	α-helix	trans	-64	-41.7	177.9	-61.9	0	0	0	0	111.5	L13 Q14 I20 L21 V28	L13-C17 PolarHBondContact O-N 2.95Å; L13-C17 PolarHBondContact O-SG 3.36Å; Q14-C17 PolarHBondContact O-N 2.76Å; C17-I20 PolarHBondContact O-N 2.83Å; C17-L21 WeakPolarHBondContact O-CB 3.44Å; C17-L21 WeakPolarHBondContact O-CG 3.49Å; C17-L21 PolarHBondContact O-N 3.02Å; C17-V28 HydrophobicContact CB-CG1 3.3Å
18	C	85.6	Confident	81.8	Confident	21 Å²	21	78.3 Å²	78.3	14%	0.142	43%	0.429	C	S	.	.	H	α-helix	trans	-63.8	-40.3	175	-59.6	0	0	0	0	112	Q14 N15 L16 G22 R23	Q14-C18 PolarHBondContact O-N 3Å; Q14-C18 PolarHBondContact O-SG 2.82Å; N15-C18 PolarHBondContact O-N 3.36Å; L16-C18 PolarHBondContact O-N 3.26Å; C18-G22 WeakPolarHBondContact O-CA 3.42Å; C18-G22 PolarHBondContact O-N 3.26Å; C18-R23 WeakPolarHBondContact CB-O 3.34Å
19	R	85.4	Confident	81.9	Confident	221 Å²	221	78.9 Å²	78.9	83%	0.834	44%	0.436	S	S	*	.	H	α-helix	trans	-65.9	-38.8	176.7	-82.3	-65.7	-157.6	164.5	5.1	113.9	N15 L16	N15-R19 WeakPolarHBondContact O-CB 3.42Å; N15-R19 WeakPolarHBondContact O-CG 3.49Å; N15-R19 PolarHBondContact O-N 3.28Å; L16-R19 PolarHBondContact O-N 3.27Å
20	I	86.4	Confident	82.1	Confident	126 Å²	126	82.4 Å²	82.4	65%	0.646	45%	0.447	S	S	*	.	H	α-helix	trans	-75.4	-40.1	179.1	-68.9	171.1	0	0	0	111.2	L16 C17	L16-I20 HydrophobicContact CD1-CD1 3.84Å; L16-I20 HydrophobicContact CD1-CG1 4.25Å; L16-I20 HydrophobicContact CG-CD1 3.88Å; L16-I20 WeakPolarHBondContact O-CG1 3.26Å; L16-I20 PolarHBondContact O-N 3.4Å; C17-I20 PolarHBondContact O-N 2.83Å
21	L	84.3	Confident	82.2	Confident	78 Å²	78	83.3 Å²	83.3	41%	0.408	45%	0.449	S	S	.	.	H	α-helix	trans	-90.7	-13.2	-173.7	-61.4	171.9	0	0	0	114	C17 R23 V28 Q31	C17-L21 WeakPolarHBondContact O-CB 3.44Å; C17-L21 WeakPolarHBondContact O-CG 3.49Å; C17-L21 PolarHBondContact O-N 3.02Å; L21-R23 VanDerWaalsContact C-N 3.28Å; L21-R23 PolarHBondContact O-N 2.9Å; L21-V28 HydrophobicContact CD1-CG1 4.19Å; L21-V28 HydrophobicContact CD1-CG2 4.24Å; L21-Q31 HydrophobicContact CD1-CB 4.02Å; L21-Q31 HydrophobicContact CD1-CG 3.94Å
22	G	83.4	Confident	82.3	Confident	72 Å²	72	83.7 Å²	83.7	74%	0.742	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.5	22.8	-179.1	0	0	0	0	0	114.3	C18	C18-G22 WeakPolarHBondContact O-CA 3.42Å; C18-G22 PolarHBondContact O-N 3.26Å
23	R	82.3	Confident	82.3	Confident	155 Å²	155	85.2 Å²	85.2	59%	0.585	45%	0.452	S	S	*	.			trans	-120.3	160.5	-173.4	-65.8	-175.7	-167.8	-158.3	0.3	112.5	C18 L21 D27 V28	C18-R23 WeakPolarHBondContact CB-O 3.34Å; L21-R23 VanDerWaalsContact C-N 3.28Å; L21-R23 PolarHBondContact O-N 2.9Å; R23-D27 HydrophobicContact CB-CB 4.1Å; R23-V28 HydrophobicContact CB-CG2 3.76Å
24	S	79.8	Confident	82.4	Confident	87 Å²	87	91.2 Å²	91.2	61%	0.608	47%	0.474	S	S	*	.			trans	-69.4	155.3	174.7	-170.6	0	0	0	0	111.8	A26 D27 V28	S24-A26 PolarHBondContact O-N 2.94Å; S24-A26 VanDerWaalsContact O-N 3.09Å; S24-D27 PolarHBondContact O-N 3.06Å; S24-D27 VanDerWaalsContact O-N 3.1Å; S24-V28 WeakPolarHBondContact O-CG2 3.48Å; S24-V28 PolarHBondContact O-N 3.12Å
25	E	73.8	Confident	82.5	Confident	103 Å²	103	89.9 Å²	89.9	48%	0.481	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-33.9	-174.7	-72.4	179.8	-155	0	0	114.1	Q14 V28	Q14-E25 HydrophobicContact CG-CG 4.43Å; Q14-E25 PolarHBondContact NE2-OE2 3.43Å; E25-V28 PolarHBondContact O-N 3.08Å
26	A	72.1	Confident	82.6	Confident	86 Å²	86	88.5 Å²	88.5	71%	0.711	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-41.2	179.4	0	0	0	0	0	113.3	S24 V28	S24-A26 PolarHBondContact O-N 2.94Å; S24-A26 VanDerWaalsContact O-N 3.09Å; A26-V28 PolarHBondContact O-N 3.18Å
27	D	74.1	Confident	82.6	Confident	114 Å²	114	93.7 Å²	93.7	61%	0.61	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-19	179.4	-82.6	-12.9	0	0	0	113	R23 S24	R23-D27 HydrophobicContact CB-CB 4.1Å; S24-D27 PolarHBondContact O-N 3.06Å; S24-D27 VanDerWaalsContact O-N 3.1Å
28	V	81	Confident	82.6	Confident	1 Å²	1	95.6 Å²	95.6	1%	0.006	49%	0.49	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-8.9	-169.9	173.7	0	0	0	0	112.1	C17 L21 R23 S24 E25 A26 Q30 Q31 F32	C17-V28 HydrophobicContact CB-CG1 3.3Å; L21-V28 HydrophobicContact CD1-CG1 4.19Å; L21-V28 HydrophobicContact CD1-CG2 4.24Å; R23-V28 HydrophobicContact CB-CG2 3.76Å; S24-V28 WeakPolarHBondContact O-CG2 3.48Å; S24-V28 PolarHBondContact O-N 3.12Å; E25-V28 PolarHBondContact O-N 3.08Å; A26-V28 PolarHBondContact O-N 3.18Å; V28-Q30 VanDerWaalsContact C-N 3.3Å; V28-Q30 PolarHBondContact O-N 3.3Å; V28-Q30 VanDerWaalsContact O-N 3.1Å; V28-Q31 PolarHBondContact O-N 2.86Å; V28-F32 HydrophobicContact CG1-CB 4.48Å; V28-F32 PolarHBondContact O-N 2.98Å
29	A	79.2	Confident	82.5	Confident	54 Å²	54	98.1 Å²	98.1	45%	0.446	50%	0.501	S	S	.	.	H	α-helix	trans	-48	-43.5	-173.2	0	0	0	0	0	114.7	F32 Q33	A29-F32 PolarHBondContact O-N 2.78Å; A29-Q33 WeakPolarHBondContact O-CB 3.07Å; A29-Q33 PolarHBondContact O-N 3.43Å
30	Q	82.8	Confident	82.3	Confident	137 Å²	137	90.3 Å²	90.3	64%	0.64	49%	0.489	S	S	*	.	H	α-helix	trans	-64.8	-41.2	179.9	-169.5	66.7	19.2	0	0	112.8	V28 Y34	V28-Q30 VanDerWaalsContact C-N 3.3Å; V28-Q30 PolarHBondContact O-N 3.3Å; V28-Q30 VanDerWaalsContact O-N 3.1Å; Q30-Y34 PolarHBondContact O-N 2.93Å
31	Q	83.5	Confident	81.9	Confident	103 Å²	103	88.5 Å²	88.5	48%	0.481	49%	0.488	S	S	.	.	H	α-helix	trans	-75.8	-35.4	179.1	-60.2	-60.1	-21.7	0	0	111	L21 V28 Y34 A35	L21-Q31 HydrophobicContact CD1-CB 4.02Å; L21-Q31 HydrophobicContact CD1-CG 3.94Å; V28-Q31 PolarHBondContact O-N 2.86Å; Q31-Y34 PolarHBondContact O-N 3.35Å; Q31-A35 WeakPolarHBondContact O-CB 3.29Å; Q31-A35 PolarHBondContact O-N 3.29Å
32	F	85.3	Confident	81.5	Confident	46 Å²	46	89.8 Å²	89.8	20%	0.202	50%	0.495	C	S	.	.	H	α-helix	trans	-62.3	-43.4	171.4	176.8	-120.7	0	0	0	112	N10 L13 Q14 V28 A29 Y34 A35 V36	N10-F32 HydrophobicContact CB-CZ 4.46Å; N10-F32 WeakPolarHBondContact O-CE2 3.5Å; L13-F32 HydrophobicContact CB-CD2 4.44Å; L13-F32 HydrophobicContact CB-CE2 4.03Å; Q14-F32 HydrophobicContact CB-CD2 3.86Å; Q14-F32 HydrophobicContact CB-CE2 3.66Å; Q14-F32 HydrophobicContact CB-CG 4.4Å; Q14-F32 HydrophobicContact CB-CZ 4.02Å; Q14-F32 HydrophobicContact CG-CD1 4.44Å; Q14-F32 HydrophobicContact CG-CD2 4.26Å; Q14-F32 HydrophobicContact CG-CE2 4.36Å; Q14-F32 HydrophobicContact CG-CG 4.31Å; Q14-F32 HydrophobicContact CG-CZ 4.47Å; V28-F32 HydrophobicContact CG1-CB 4.48Å; V28-F32 PolarHBondContact O-N 2.98Å; A29-F32 PolarHBondContact O-N 2.78Å; F32-Y34 VanDerWaalsContact C-N 3.32Å; F32-Y34 PolarHBondContact O-N 2.69Å; F32-A35 PolarHBondContact O-N 3.06Å; F32-V36 HydrophobicContact CD2-CG2 3.91Å; F32-V36 HydrophobicContact CE1-CG2 4.17Å; F32-V36 HydrophobicContact CE2-CG2 3.43Å; F32-V36 VanDerWaalsContact CE2-CG2 3.43Å; F32-V36 HydrophobicContact CG-CG2 4.44Å; F32-V36 HydrophobicContact CZ-CG2 3.6Å; F32-V36 WeakPolarHBondContact O-CB 3.37Å; F32-V36 WeakPolarHBondContact O-CG2 3.27Å; F32-V36 PolarHBondContact O-N 3.27Å
33	Q	84.8	Confident	81.2	Confident	128 Å²	128	93.5 Å²	93.5	60%	0.598	49%	0.491	S	S	*	.	H	α-helix	trans	-61.3	-39.5	175.8	-168.8	-177.4	20.1	0	0	112	A29 R37	A29-Q33 WeakPolarHBondContact O-CB 3.07Å; A29-Q33 PolarHBondContact O-N 3.43Å; Q33-R37 WeakPolarHBondContact O-CB 3.31Å; Q33-R37 PolarHBondContact O-N 3.48Å
34	Y	87.1	Confident	80.8	Confident	151 Å²	151	89.7 Å²	89.7	59%	0.592	49%	0.492	S	S	*	.	H	α-helix	trans	-64.5	-47.4	172.6	176.2	-104.3	0	0	0	112.1	Q30 Q31 F32 V36 R37 V38	Q30-Y34 PolarHBondContact O-N 2.93Å; Q31-Y34 PolarHBondContact O-N 3.35Å; F32-Y34 VanDerWaalsContact C-N 3.32Å; F32-Y34 PolarHBondContact O-N 2.69Å; Y34-V36 PolarHBondContact O-N 2.72Å; Y34-R37 WeakPolarHBondContact O-CB 3.32Å; Y34-R37 PolarHBondContact O-N 2.98Å; Y34-R37 VanDerWaalsContact O-N 3.17Å; Y34-V38 HydrophobicContact CD2-CG2 4.39Å; Y34-V38 HydrophobicContact CE1-CG2 4.15Å; Y34-V38 HydrophobicContact CE2-CG2 3.9Å; Y34-V38 PolarHBondContact O-N 3.18Å
35	A	84.8	Confident	80.5	Confident	20 Å²	20	87.3 Å²	87.3	17%	0.165	48%	0.475	C	S	.	.	H	α-helix	trans	-60	-43.6	177.8	0	0	0	0	0	112.4	Q31 F32 R37 V38 I39	Q31-A35 WeakPolarHBondContact O-CB 3.29Å; Q31-A35 PolarHBondContact O-N 3.29Å; F32-A35 PolarHBondContact O-N 3.06Å; A35-R37 VanDerWaalsContact C-N 3.34Å; A35-R37 PolarHBondContact O-N 3Å; A35-V38 PolarHBondContact O-N 2.95Å; A35-I39 WeakPolarHBondContact O-CB 3.3Å; A35-I39 WeakPolarHBondContact O-CG1 3.29Å; A35-I39 PolarHBondContact O-N 3.31Å
36	V	87.3	Confident	80.4	Confident	47 Å²	47	87 Å²	87	29%	0.285	48%	0.481	S	S	.	.	H	α-helix	trans	-63.3	-38.6	175.4	170.5	0	0	0	0	111.5	F32 Y34 G40	F32-V36 HydrophobicContact CD2-CG2 3.91Å; F32-V36 HydrophobicContact CE1-CG2 4.17Å; F32-V36 HydrophobicContact CE2-CG2 3.43Å; F32-V36 VanDerWaalsContact CE2-CG2 3.43Å; F32-V36 HydrophobicContact CG-CG2 4.44Å; F32-V36 HydrophobicContact CZ-CG2 3.6Å; F32-V36 WeakPolarHBondContact O-CB 3.37Å; F32-V36 WeakPolarHBondContact O-CG2 3.27Å; F32-V36 PolarHBondContact O-N 3.27Å; Y34-V36 PolarHBondContact O-N 2.72Å; V36-G40 WeakPolarHBondContact O-CA 3.33Å; V36-G40 PolarHBondContact O-N 3.34Å
37	R	86.5	Confident	80.6	Confident	201 Å²	201	84.5 Å²	84.5	76%	0.758	46%	0.456	S	S	*	.	H	α-helix	trans	-62.4	-45.6	175.7	-177.5	177.6	178.4	169.5	0.2	112.2	Q33 Y34 A35 S41	Q33-R37 WeakPolarHBondContact O-CB 3.31Å; Q33-R37 PolarHBondContact O-N 3.48Å; Y34-R37 WeakPolarHBondContact O-CB 3.32Å; Y34-R37 PolarHBondContact O-N 2.98Å; Y34-R37 VanDerWaalsContact O-N 3.17Å; A35-R37 VanDerWaalsContact C-N 3.34Å; A35-R37 PolarHBondContact O-N 3Å; R37-S41 PolarHBondContact O-N 3.41Å; R37-S41 PolarHBondContact O-OG 2.89Å
38	V	84.8	Confident	80.7	Confident	57 Å²	57	81.8 Å²	81.8	35%	0.345	44%	0.44	S	S	.	.	H	α-helix	trans	-71.7	-49.4	-178.8	176.6	0	0	0	0	111.3	Y34 A35 G40 S41 N42	Y34-V38 HydrophobicContact CD2-CG2 4.39Å; Y34-V38 HydrophobicContact CE1-CG2 4.15Å; Y34-V38 HydrophobicContact CE2-CG2 3.9Å; Y34-V38 PolarHBondContact O-N 3.18Å; A35-V38 PolarHBondContact O-N 2.95Å; V38-G40 VanDerWaalsContact C-N 3.35Å; V38-G40 PolarHBondContact O-N 3.3Å; V38-S41 PolarHBondContact O-N 3.32Å; V38-S41 PolarHBondContact O-OG 3.17Å; V38-N42 PolarHBondContact O-N 3.47Å; V38-N42 PolarHBondContact O-OD1 3.32Å
39	I	84.4	Confident	80.5	Confident	74 Å²	74	87.1 Å²	87.1	38%	0.379	46%	0.46	S	S	.	.	H	α-helix	trans	-70.2	-33.1	-179	-59.6	-62.4	0	0	0	111.7	L13 A35 N42 F43	L13-I39 HydrophobicContact CD1-CB 4.04Å; L13-I39 HydrophobicContact CD1-CG1 4.19Å; L13-I39 HydrophobicContact CD1-CG2 4.02Å; L13-I39 HydrophobicContact CD2-CG1 4.12Å; A35-I39 WeakPolarHBondContact O-CB 3.3Å; A35-I39 WeakPolarHBondContact O-CG1 3.29Å; A35-I39 PolarHBondContact O-N 3.31Å; I39-N42 CarbonylContact O-C 3.57Å; I39-N42 PolarHBondContact O-N 2.86Å; I39-F43 HydrophobicContact CG2-CD2 4.14Å; I39-F43 WeakPolarHBondContact O-CA 3.32Å; I39-F43 WeakPolarHBondContact O-CB 3.42Å; I39-F43 PolarHBondContact O-N 3.03Å
40	G	80.4	Confident	80.6	Confident	57 Å²	57	87.9 Å²	87.9	59%	0.588	46%	0.456	S	S	*	.	H	α-helix	trans	-67.1	-36.5	177.4	0	0	0	0	0	113.9	V36 V38	V36-G40 WeakPolarHBondContact O-CA 3.33Å; V36-G40 PolarHBondContact O-N 3.34Å; V38-G40 VanDerWaalsContact C-N 3.35Å; V38-G40 PolarHBondContact O-N 3.3Å
41	S	77.7	Confident	80.6	Confident	87 Å²	87	83.5 Å²	83.5	61%	0.608	44%	0.436	S	S	*	.	H	α-helix	trans	-79	-19.4	176.3	46.7	0	0	0	0	113.7	R37 V38	R37-S41 PolarHBondContact O-N 3.41Å; R37-S41 PolarHBondContact O-OG 2.89Å; V38-S41 PolarHBondContact O-N 3.32Å; V38-S41 PolarHBondContact O-OG 3.17Å
42	N	76.3	Confident	80.6	Confident	106 Å²	106	85.3 Å²	85.3	57%	0.567	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.8	29.2	-174.5	-67.8	88.4	0	0	0	113.4	V38 I39 A44	V38-N42 PolarHBondContact O-N 3.47Å; V38-N42 PolarHBondContact O-OD1 3.32Å; I39-N42 CarbonylContact O-C 3.57Å; I39-N42 PolarHBondContact O-N 2.86Å; N42-A44 VanDerWaalsContact C-N 3.29Å; N42-A44 PolarHBondContact O-N 2.94Å
43	F	77.4	Confident	80.5	Confident	150 Å²	150	84.5 Å²	84.5	66%	0.658	44%	0.44	S	S	*	.			trans	-68.1	-24.5	-174.2	-163.4	-102.6	0	0	0	114.2	P9 I39	P9-F43 HydrophobicContact CB-CE2 4.49Å; I39-F43 HydrophobicContact CG2-CD2 4.14Å; I39-F43 WeakPolarHBondContact O-CA 3.32Å; I39-F43 WeakPolarHBondContact O-CB 3.42Å; I39-F43 PolarHBondContact O-N 3.03Å
44	A	74.9	Confident	80.6	Confident	74 Å²	74	78.7 Å²	78.7	61%	0.612	41%	0.413	S	S	*	.	S	Bend	trans	-89.9	136.2	174.6	0	0	0	0	0	111	N42 T46	N42-A44 VanDerWaalsContact C-N 3.29Å; N42-A44 PolarHBondContact O-N 2.94Å; A44-T46 PolarHBondContact O-N 3.43Å
45	P	71.8	Confident	80.6	Confident	37 Å²	37	71.6 Å²	71.6	24%	0.24	39%	0.386	C	S	.	.			trans	-69.2	129.8	176.2	30	-35	0	0	0	110.6	W91 R124	P45-W91 HydrophobicContact CB-CH2 4.47Å; P45-W91 HydrophobicContact CB-CZ3 4.29Å; P45-R124 WeakPolarHBondContact O-CD 3.49Å
46	T	73	Confident	80.7	Confident	98 Å²	98	72.9 Å²	72.9	60%	0.601	39%	0.388	S	S	*	.	S	Bend	trans	-82.7	-14.3	-178.2	48.1	0	0	0	0	114.2	A44 R124	A44-T46 PolarHBondContact O-N 3.43Å; T46-R124 PolarHBondContact O-N 3.44Å
47	V	76.5	Confident	80.6	Confident	32 Å²	32	73.1 Å²	73.1	19%	0.194	39%	0.386	C	S	.	.	B	Isolated β-bridge	trans	-123.8	157.1	-179.7	-64.7	0	0	0	0	110.8	W91 A121 L122	V47-W91 HydrophobicContact CG2-CH2 3.91Å; V47-W91 HydrophobicContact CG2-CZ2 3.66Å; V47-A121 HydrophobicContact CB-CB 3.79Å; V47-A121 HydrophobicContact CG1-CB 4.29Å; V47-A121 HydrophobicContact CG2-CB 4.03Å; V47-L122 WeakPolarHBondContact CA-O 3.35Å
48	E	74.6	Confident	80.7	Confident	57 Å²	57	64.5 Å²	64.5	27%	0.266	36%	0.355	S	S	.	.			trans	-69.7	148.8	176	-82.9	-56.3	157.5	0	0	114.2	D50 L122 R124	E48-D50 VanDerWaalsContact C-N 3.34Å; E48-D50 PolarHBondContact O-N 2.87Å; E48-L122 PolarHBondContact N-O 3.34Å; E48-R124 HydrophobicContact CG-CG 4.01Å; E48-R124 WeakPolarHBondContact OE1-CG 3.39Å; E48-R124 IonicContact OE1-CZ 2.77Å; E48-R124 IonicContact OE1-NE 3.94Å; E48-R124 PolarHBondContact OE1-NE 3.4Å; E48-R124 IonicContact OE1-NH2 2.69Å; E48-R124 PolarHBondContact OE1-NH2 2.78Å; E48-R124 IonicContact OE2-CZ 3.1Å; E48-R124 IonicContact OE2-NE 3.59Å; E48-R124 PolarHBondContact OE2-NE 3.09Å; E48-R124 IonicContact OE2-NH2 3.28Å; E48-R124 PolarHBondContact OE2-NH2 3.45Å
49	R	78	Confident	80.8	Confident	114 Å²	114	64.1 Å²	64.1	43%	0.43	35%	0.348	S	S	.	.			trans	-87.3	58.9	-168.2	-60.7	-172.5	179.9	170.3	1.7	113.8	E51 N89 W91	R49-E51 PolarHBondContact O-N 2.9Å; R49-N89 PolarHBondContact NH1-OD1 2.76Å; R49-W91 HydrophobicContact CB-CB 4.3Å; R49-W91 HydrophobicContact CB-CD2 3.95Å; R49-W91 HydrophobicContact CB-CE3 4.2Å; R49-W91 HydrophobicContact CB-CG 3.95Å; R49-W91 HydrophobicContact CG-CD2 3.99Å; R49-W91 HydrophobicContact CG-CE3 3.74Å; R49-W91 HydrophobicContact CG-CG 4.48Å; R49-W91 HydrophobicContact CG-CZ3 4.17Å
50	D	80.6	Confident	80.9	Confident	69 Å²	69	66.5 Å²	66.5	37%	0.369	36%	0.356	S	S	.	.			trans	-79	101.7	178	-173.1	-17.3	0	0	0	112.3	E48 F52 L53 V54 W91	E48-D50 VanDerWaalsContact C-N 3.34Å; E48-D50 PolarHBondContact O-N 2.87Å; D50-F52 VanDerWaalsContact C-N 3.32Å; D50-F52 PolarHBondContact O-N 3.31Å; D50-F52 WeakPolarHBondContact OD1-CA 3.39Å; D50-F52 WeakPolarHBondContact OD1-CB 3.36Å; D50-F52 PolarHBondContact OD1-N 2.82Å; D50-L53 HydrophobicContact CB-CB 3.94Å; D50-L53 VanDerWaalsContact CG-CB 3.46Å; D50-L53 PolarHBondContact OD1-N 3.02Å; D50-L53 WeakPolarHBondContact OD2-CB 3.37Å; D50-V54 WeakPolarHBondContact O-CG2 3.49Å; D50-V54 PolarHBondContact O-N 3.02Å; D50-W91 VanDerWaalsContact C-CD1 3.46Å; D50-W91 VanDerWaalsContact O-CD1 3.23Å
51	E	82.6	Confident	81	Confident	45 Å²	45	66 Å²	66	21%	0.21	34%	0.338	C	S	.	.	H	α-helix	trans	-64.2	-32.2	175.8	-66.7	-165.9	163.5	0	0	113	R49 A55 H82 K90 W91	R49-E51 PolarHBondContact O-N 2.9Å; E51-A55 WeakPolarHBondContact O-CB 3.42Å; E51-A55 PolarHBondContact O-N 3.19Å; E51-A55 VanDerWaalsContact O-N 3.14Å; E51-H82 IonicContact OE2-NE2 3.8Å; E51-K90 VanDerWaalsContact OE1-CA 3.28Å; E51-K90 WeakPolarHBondContact OE1-CA 3.45Å; E51-K90 WeakPolarHBondContact OE1-CB 3.49Å; E51-K90 PolarHBondContact OE1-N 3.22Å; E51-K90 IonicContact OE2-NZ 3.29Å; E51-K90 PolarHBondContact OE2-NZ 3.08Å; E51-W91 HydrophobicContact CG-CB 3.69Å; E51-W91 PolarHBondContact OE1-N 2.98Å
52	F	84.2	Confident	81.4	Confident	141 Å²	141	63.2 Å²	63.2	62%	0.618	32%	0.316	S	S	*	.	H	α-helix	trans	-73.6	-45.4	-177.8	174.8	-101.3	0	0	0	111.3	D50 V54 A55 E56	D50-F52 VanDerWaalsContact C-N 3.32Å; D50-F52 PolarHBondContact O-N 3.31Å; D50-F52 WeakPolarHBondContact OD1-CA 3.39Å; D50-F52 WeakPolarHBondContact OD1-CB 3.36Å; D50-F52 PolarHBondContact OD1-N 2.82Å; F52-V54 VanDerWaalsContact C-N 3.29Å; F52-V54 PolarHBondContact O-N 3.41Å; F52-A55 PolarHBondContact O-N 2.93Å; F52-E56 HydrophobicContact CD1-CG 4.43Å; F52-E56 HydrophobicContact CD2-CG 4.43Å; F52-E56 HydrophobicContact CE1-CG 3.98Å; F52-E56 HydrophobicContact CE2-CG 3.97Å; F52-E56 HydrophobicContact CZ-CG 3.72Å; F52-E56 PolarHBondContact O-N 2.64Å
53	L	83.3	Confident	81.8	Confident	29 Å²	29	62.3 Å²	62.3	15%	0.152	31%	0.31	C	S	.	.	H	α-helix	trans	-58.8	-39.6	177.3	-178.3	65.3	0	0	0	112.5	D50 K57 A119 A121	D50-L53 HydrophobicContact CB-CB 3.94Å; D50-L53 VanDerWaalsContact CG-CB 3.46Å; D50-L53 PolarHBondContact OD1-N 3.02Å; D50-L53 WeakPolarHBondContact OD2-CB 3.37Å; L53-K57 WeakPolarHBondContact O-CG 3.26Å; L53-K57 PolarHBondContact O-N 3.48Å; L53-A119 HydrophobicContact CD1-CB 3.86Å; L53-A121 HydrophobicContact CD2-CB 4.14Å
54	V	86.4	Confident	82.1	Confident	6 Å²	6	60.7 Å²	60.7	4%	0.036	30%	0.3	C	S	.	.	H	α-helix	trans	-70.2	-42	177.2	179.3	0	0	0	0	111.1	D50 F52 E56 K57 I58 L94 Y95 L98	D50-V54 WeakPolarHBondContact O-CG2 3.49Å; D50-V54 PolarHBondContact O-N 3.02Å; F52-V54 VanDerWaalsContact C-N 3.29Å; F52-V54 PolarHBondContact O-N 3.41Å; V54-E56 VanDerWaalsContact C-N 3.35Å; V54-E56 PolarHBondContact O-N 2.67Å; V54-K57 PolarHBondContact O-N 3.34Å; V54-I58 HydrophobicContact CG1-CD1 4.13Å; V54-I58 WeakPolarHBondContact O-CG1 3.35Å; V54-I58 PolarHBondContact O-N 3.31Å; V54-L94 HydrophobicContact CG1-CB 3.77Å; V54-Y95 HydrophobicContact CG2-CD2 3.94Å; V54-L98 HydrophobicContact CG1-CD2 4.46Å
55	A	87.4	Confident	82.5	Confident	2 Å²	2	58 Å²	58	2%	0.017	28%	0.275	C	S	.	.	H	α-helix	trans	-61.6	-40.9	175.4	0	0	0	0	0	112.3	E51 F52 I58 K59 F74	E51-A55 WeakPolarHBondContact O-CB 3.42Å; E51-A55 PolarHBondContact O-N 3.19Å; E51-A55 VanDerWaalsContact O-N 3.14Å; F52-A55 PolarHBondContact O-N 2.93Å; A55-I58 PolarHBondContact O-N 3.37Å; A55-K59 WeakPolarHBondContact O-CG 3.32Å; A55-K59 PolarHBondContact O-N 2.63Å; A55-K59 VanDerWaalsContact O-N 3.08Å; A55-F74 HydrophobicContact CB-CE1 4.16Å; A55-F74 HydrophobicContact CB-CZ 4.4Å
56	E	86.8	Confident	83	Confident	47 Å²	47	66.5 Å²	66.5	22%	0.22	30%	0.302	C	S	.	.	H	α-helix	trans	-67.9	-34.8	174.9	-73.3	-56.6	126.4	0	0	112.9	F52 V54 K59 K60	F52-E56 HydrophobicContact CD1-CG 4.43Å; F52-E56 HydrophobicContact CD2-CG 4.43Å; F52-E56 HydrophobicContact CE1-CG 3.98Å; F52-E56 HydrophobicContact CE2-CG 3.97Å; F52-E56 HydrophobicContact CZ-CG 3.72Å; F52-E56 PolarHBondContact O-N 2.64Å; V54-E56 VanDerWaalsContact C-N 3.35Å; V54-E56 PolarHBondContact O-N 2.67Å; E56-K59 PolarHBondContact O-N 3.02Å; E56-K59 WeakPolarHBondContact OE1-CD 3.44Å; E56-K59 WeakPolarHBondContact OE1-CE 3.39Å; E56-K59 IonicContact OE1-NZ 2.72Å; E56-K59 PolarHBondContact OE1-NZ 3.45Å; E56-K60 WeakPolarHBondContact O-CB 3.42Å; E56-K60 VanDerWaalsContact O-CG 3.31Å; E56-K60 WeakPolarHBondContact O-CG 3.42Å; E56-K60 PolarHBondContact O-N 3.26Å
57	K	85.9	Confident	83.6	Confident	52 Å²	52	66.5 Å²	66.5	23%	0.226	29%	0.291	C	S	.	.	H	α-helix	trans	-62.8	-43.5	171.4	-79	-179.5	176.9	176.8	0	112.1	L53 V54 K60 E61 L98 A119	L53-K57 WeakPolarHBondContact O-CG 3.26Å; L53-K57 PolarHBondContact O-N 3.48Å; V54-K57 PolarHBondContact O-N 3.34Å; K57-K60 PolarHBondContact O-N 3.26Å; K57-E61 WeakPolarHBondContact O-CB 3.46Å; K57-E61 PolarHBondContact O-N 2.77Å; K57-L98 HydrophobicContact CB-CD2 3.88Å; K57-A119 WeakPolarHBondContact CE-O 3.5Å; K57-A119 PolarHBondContact NZ-O 2.98Å
58	I	87.9	Confident	84.1	Confident	21 Å²	21	71.5 Å²	71.5	11%	0.108	31%	0.312	C	S	.	.	H	α-helix	trans	-61.3	-45.1	176.6	-66.8	162.2	0	0	0	111.1	V54 A55 E61 L62 F74 L94 L98	V54-I58 HydrophobicContact CG1-CD1 4.13Å; V54-I58 WeakPolarHBondContact O-CG1 3.35Å; V54-I58 PolarHBondContact O-N 3.31Å; A55-I58 PolarHBondContact O-N 3.37Å; I58-E61 PolarHBondContact O-N 2.73Å; I58-L62 HydrophobicContact CG2-CD1 4.09Å; I58-L62 WeakPolarHBondContact O-CG 2.8Å; I58-L62 PolarHBondContact O-N 2.95Å; I58-F74 HydrophobicContact CB-CD1 4.49Å; I58-F74 HydrophobicContact CB-CE1 3.92Å; I58-F74 HydrophobicContact CB-CE2 4.44Å; I58-F74 HydrophobicContact CB-CZ 3.9Å; I58-F74 HydrophobicContact CD1-CE1 4.49Å; I58-F74 HydrophobicContact CD1-CE2 4.07Å; I58-F74 HydrophobicContact CD1-CZ 3.67Å; I58-F74 HydrophobicContact CG1-CZ 4.39Å; I58-F74 HydrophobicContact CG2-CD1 3.94Å; I58-F74 HydrophobicContact CG2-CD2 3.94Å; I58-F74 HydrophobicContact CG2-CE1 3.77Å; I58-F74 HydrophobicContact CG2-CE2 3.77Å; I58-F74 HydrophobicContact CG2-CG 4.03Å; I58-F74 HydrophobicContact CG2-CZ 3.69Å; I58-L94 HydrophobicContact CD1-CB 4.17Å; I58-L94 HydrophobicContact CD1-CD2 4.2Å; I58-L98 HydrophobicContact CD1-CB 4.46Å; I58-L98 HydrophobicContact CG1-CB 4.05Å; I58-L98 HydrophobicContact CG1-CD1 3.99Å; I58-L98 HydrophobicContact CG1-CD2 4.27Å; I58-L98 HydrophobicContact CG1-CG 4.32Å
59	K	86.9	Confident	84.7	Confident	48 Å²	48	72.6 Å²	72.6	21%	0.209	33%	0.331	C	S	.	.	H	α-helix	trans	-60.5	-47.9	175.5	-67.1	176.1	-161	176.7	0	112.1	A55 E56 E61 L62 I63 F74 S75	A55-K59 WeakPolarHBondContact O-CG 3.32Å; A55-K59 PolarHBondContact O-N 2.63Å; A55-K59 VanDerWaalsContact O-N 3.08Å; E56-K59 PolarHBondContact O-N 3.02Å; E56-K59 WeakPolarHBondContact OE1-CD 3.44Å; E56-K59 WeakPolarHBondContact OE1-CE 3.39Å; E56-K59 IonicContact OE1-NZ 2.72Å; E56-K59 PolarHBondContact OE1-NZ 3.45Å; K59-E61 VanDerWaalsContact C-N 3.3Å; K59-E61 PolarHBondContact O-N 3Å; K59-L62 PolarHBondContact O-N 3Å; K59-I63 VanDerWaalsContact O-CG1 3.27Å; K59-I63 WeakPolarHBondContact O-CG1 3.24Å; K59-I63 PolarHBondContact O-N 3.15Å; K59-F74 HydrophobicContact CG-CD1 3.88Å; K59-F74 HydrophobicContact CG-CE1 4.24Å; K59-S75 VanDerWaalsContact CE-OG 3.23Å; K59-S75 WeakPolarHBondContact CE-OG 3.31Å
60	K	85.6	Confident	85.2	Confident	124 Å²	124	69.7 Å²	69.7	54%	0.539	32%	0.324	S	S	.	.	H	α-helix	trans	-62.2	-37.3	180	-74.8	176	-178.9	-178.3	0	112.1	E56 K57 I63 R64	E56-K60 WeakPolarHBondContact O-CB 3.42Å; E56-K60 VanDerWaalsContact O-CG 3.31Å; E56-K60 WeakPolarHBondContact O-CG 3.42Å; E56-K60 PolarHBondContact O-N 3.26Å; K57-K60 PolarHBondContact O-N 3.26Å; K60-I63 PolarHBondContact O-N 2.97Å; K60-R64 WeakPolarHBondContact O-CB 3.34Å; K60-R64 PolarHBondContact O-N 3.45Å
61	E	83.4	Confident	85.6	Confident	48 Å²	48	66.8 Å²	66.8	22%	0.224	31%	0.31	C	S	.	.	H	α-helix	trans	-68.1	-42.9	175.7	-179.2	50.8	-147.4	0	0	112.2	K57 I58 K59 I63 R64 Q65	K57-E61 WeakPolarHBondContact O-CB 3.46Å; K57-E61 PolarHBondContact O-N 2.77Å; I58-E61 PolarHBondContact O-N 2.73Å; K59-E61 VanDerWaalsContact C-N 3.3Å; K59-E61 PolarHBondContact O-N 3Å; E61-I63 VanDerWaalsContact C-N 3.34Å; E61-I63 PolarHBondContact O-N 2.95Å; E61-R64 WeakPolarHBondContact O-CB 3.44Å; E61-R64 PolarHBondContact O-N 3.04Å; E61-R64 IonicContact OE1-CZ 2.62Å; E61-R64 VanDerWaalsContact OE1-CZ 3.32Å; E61-R64 IonicContact OE1-NE 3.62Å; E61-R64 PolarHBondContact OE1-NE 3.4Å; E61-R64 IonicContact OE1-NH2 2.72Å; E61-R64 PolarHBondContact OE1-NH2 3.06Å; E61-R64 IonicContact OE2-CZ 2.7Å; E61-R64 IonicContact OE2-NE 3.19Å; E61-R64 PolarHBondContact OE2-NE 3.48Å; E61-R64 IonicContact OE2-NH2 3.42Å; E61-Q65 WeakPolarHBondContact O-CG 3.27Å; E61-Q65 PolarHBondContact O-N 2.94Å; E61-Q65 PolarHBondContact OE1-NE2 3.12Å
62	L	86.4	Confident	85.9	Confident	28 Å²	28	67.6 Å²	67.6	15%	0.147	32%	0.324	C	S	.	.	H	α-helix	trans	-62.2	-40.2	173.2	-71.1	167.8	0	0	0	112.2	I58 K59 Q65 R66 R67 D70 A71 F74	I58-L62 HydrophobicContact CG2-CD1 4.09Å; I58-L62 WeakPolarHBondContact O-CG 2.8Å; I58-L62 PolarHBondContact O-N 2.95Å; K59-L62 PolarHBondContact O-N 3Å; L62-Q65 PolarHBondContact O-N 2.76Å; L62-R66 PolarHBondContact O-N 3.14Å; L62-R67 HydrophobicContact CD2-CB 4.49Å; L62-R67 WeakPolarHBondContact O-CA 3.36Å; L62-R67 WeakPolarHBondContact O-CB 3.13Å; L62-R67 PolarHBondContact O-N 3.31Å; L62-D70 HydrophobicContact CD1-CB 4.45Å; L62-D70 HydrophobicContact CD2-CB 4.25Å; L62-A71 HydrophobicContact CB-CB 3.98Å; L62-A71 HydrophobicContact CD1-CB 4.41Å; L62-F74 HydrophobicContact CD1-CB 4.16Å
63	I	84.9	Confident	86.3	Confident	86 Å²	86	64.9 Å²	64.9	44%	0.441	32%	0.315	S	S	.	.	H	α-helix	trans	-65.3	-41.7	173.9	-66	163.5	0	0	0	110.7	K59 K60 E61 Q65 R66 E68 A71	K59-I63 VanDerWaalsContact O-CG1 3.27Å; K59-I63 WeakPolarHBondContact O-CG1 3.24Å; K59-I63 PolarHBondContact O-N 3.15Å; K60-I63 PolarHBondContact O-N 2.97Å; E61-I63 VanDerWaalsContact C-N 3.34Å; E61-I63 PolarHBondContact O-N 2.95Å; I63-Q65 PolarHBondContact O-N 3.4Å; I63-R66 WeakPolarHBondContact O-CA 3.37Å; I63-R66 PolarHBondContact O-N 2.87Å; I63-E68 HydrophobicContact CG1-CG 4.46Å; I63-A71 HydrophobicContact CD1-CB 4.44Å; I63-A71 HydrophobicContact CG1-CB 4.01Å
64	R	82.9	Confident	86.8	Confident	117 Å²	117	65 Å²	65	44%	0.442	32%	0.315	S	S	.	.	H	α-helix	trans	-57	-35.8	174.3	-167.1	-165.5	68.3	68.8	2	112.2	K60 E61 R66 D103	K60-R64 WeakPolarHBondContact O-CB 3.34Å; K60-R64 PolarHBondContact O-N 3.45Å; E61-R64 WeakPolarHBondContact O-CB 3.44Å; E61-R64 PolarHBondContact O-N 3.04Å; E61-R64 IonicContact OE1-CZ 2.62Å; E61-R64 VanDerWaalsContact OE1-CZ 3.32Å; E61-R64 IonicContact OE1-NE 3.62Å; E61-R64 PolarHBondContact OE1-NE 3.4Å; E61-R64 IonicContact OE1-NH2 2.72Å; E61-R64 PolarHBondContact OE1-NH2 3.06Å; E61-R64 IonicContact OE2-CZ 2.7Å; E61-R64 IonicContact OE2-NE 3.19Å; E61-R64 PolarHBondContact OE2-NE 3.48Å; E61-R64 IonicContact OE2-NH2 3.42Å; R64-R66 PolarHBondContact O-N 3.37Å; R64-D103 IonicContact CZ-OD2 3.16Å; R64-D103 IonicContact NH1-OD2 3.69Å; R64-D103 IonicContact NH2-OD2 3.81Å; R64-D103 PolarHBondContact NH2-OD2 2.66Å
65	Q	83.7	Confident	87	Confident	17 Å²	17	66.8 Å²	66.8	8%	0.079	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	2.6	175.5	-65.1	175.1	18.6	0	0	114.1	E61 L62 I63 R67 R105	E61-Q65 WeakPolarHBondContact O-CG 3.27Å; E61-Q65 PolarHBondContact O-N 2.94Å; E61-Q65 PolarHBondContact OE1-NE2 3.12Å; L62-Q65 PolarHBondContact O-N 2.76Å; I63-Q65 PolarHBondContact O-N 3.4Å; Q65-R67 VanDerWaalsContact C-N 3.34Å; Q65-R67 HydrophobicContact CB-CG 4.2Å; Q65-R105 PolarHBondContact O-NH2 2.69Å
66	R	81.3	Confident	87.1	Confident	216 Å²	216	70.6 Å²	70.6	82%	0.815	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	38.4	-171.2	-53.5	-175.2	-177	-177.7	-0.2	113.2	L62 I63 R64	L62-R66 PolarHBondContact O-N 3.14Å; I63-R66 WeakPolarHBondContact O-CA 3.37Å; I63-R66 PolarHBondContact O-N 2.87Å; R64-R66 PolarHBondContact O-N 3.37Å
67	R	86.3	Confident	87.3	Confident	97 Å²	97	72.8 Å²	72.8	37%	0.366	36%	0.358	S	S	.	.			trans	-113.3	56.2	179.5	-66	-174.4	64.9	-176.4	-0.7	111.7	L62 Q65 A69 D70 A71	L62-R67 HydrophobicContact CD2-CB 4.49Å; L62-R67 WeakPolarHBondContact O-CA 3.36Å; L62-R67 WeakPolarHBondContact O-CB 3.13Å; L62-R67 PolarHBondContact O-N 3.31Å; Q65-R67 VanDerWaalsContact C-N 3.34Å; Q65-R67 HydrophobicContact CB-CG 4.2Å; R67-A69 PolarHBondContact O-N 3.37Å; R67-D70 HydrophobicContact CB-CB 4.19Å; R67-D70 IonicContact CZ-OD2 3.95Å; R67-D70 IonicContact NE-OD2 2.64Å; R67-D70 PolarHBondContact NE-OD2 3.44Å; R67-D70 IonicContact NH2-OD1 2.65Å; R67-D70 PolarHBondContact NH2-OD1 2.95Å; R67-D70 IonicContact NH2-OD2 2.86Å; R67-D70 PolarHBondContact NH2-OD2 3.06Å; R67-D70 PolarHBondContact O-N 3.07Å; R67-D70 VanDerWaalsContact O-N 3.15Å; R67-A71 PolarHBondContact O-N 3.11Å
68	E	87.1	Confident	87.4	Confident	137 Å²	137	71.8 Å²	71.8	64%	0.64	35%	0.354	S	S	*	.	H	α-helix	trans	-63.9	-37.4	-172.5	-63.7	175.6	-168.5	0	0	113.1	I63 D70 A71 A72	I63-E68 HydrophobicContact CG1-CG 4.46Å; E68-D70 VanDerWaalsContact C-N 3.3Å; E68-D70 PolarHBondContact O-N 3.4Å; E68-A71 WeakPolarHBondContact O-CB 3.36Å; E68-A71 PolarHBondContact O-N 3Å; E68-A71 VanDerWaalsContact O-N 3.16Å; E68-A72 PolarHBondContact O-N 3.07Å; E68-A72 VanDerWaalsContact O-N 3.09Å
69	A	87.6	Confident	87.4	Confident	81 Å²	81	78.9 Å²	78.9	67%	0.669	38%	0.379	S	S	*	.	H	α-helix	trans	-61	-37.3	174.4	0	0	0	0	0	112.6	R67 A72 L73	R67-A69 PolarHBondContact O-N 3.37Å; A69-A72 PolarHBondContact O-N 3.4Å; A69-L73 WeakPolarHBondContact O-CB 3.4Å; A69-L73 PolarHBondContact O-N 3.4Å
70	D	88.5	Confident	87.4	Confident	53 Å²	53	81.1 Å²	81.1	28%	0.283	39%	0.389	S	S	.	.	H	α-helix	trans	-71.9	-31.1	176	-65.1	-75.7	0	0	0	112.2	L62 R67 E68 L73 F74	L62-D70 HydrophobicContact CD1-CB 4.45Å; L62-D70 HydrophobicContact CD2-CB 4.25Å; R67-D70 HydrophobicContact CB-CB 4.19Å; R67-D70 IonicContact CZ-OD2 3.95Å; R67-D70 IonicContact NE-OD2 2.64Å; R67-D70 PolarHBondContact NE-OD2 3.44Å; R67-D70 IonicContact NH2-OD1 2.65Å; R67-D70 PolarHBondContact NH2-OD1 2.95Å; R67-D70 IonicContact NH2-OD2 2.86Å; R67-D70 PolarHBondContact NH2-OD2 3.06Å; R67-D70 PolarHBondContact O-N 3.07Å; R67-D70 VanDerWaalsContact O-N 3.15Å; E68-D70 VanDerWaalsContact C-N 3.3Å; E68-D70 PolarHBondContact O-N 3.4Å; D70-L73 PolarHBondContact O-N 2.91Å; D70-F74 VanDerWaalsContact O-CB 3.25Å; D70-F74 WeakPolarHBondContact O-CB 3.34Å; D70-F74 PolarHBondContact O-N 3.42Å
71	A	89.5	Confident	87.4	Confident	7 Å²	7	77.6 Å²	77.6	6%	0.058	38%	0.376	C	S	.	.	H	α-helix	trans	-68.2	-35.4	173.5	0	0	0	0	0	112.1	L62 I63 R67 E68 S75	L62-A71 HydrophobicContact CB-CB 3.98Å; L62-A71 HydrophobicContact CD1-CB 4.41Å; I63-A71 HydrophobicContact CD1-CB 4.44Å; I63-A71 HydrophobicContact CG1-CB 4.01Å; R67-A71 PolarHBondContact O-N 3.11Å; E68-A71 WeakPolarHBondContact O-CB 3.36Å; E68-A71 PolarHBondContact O-N 3Å; E68-A71 VanDerWaalsContact O-N 3.16Å; A71-S75 PolarHBondContact O-N 3.14Å; A71-S75 PolarHBondContact O-OG 3.16Å
72	A	88.1	Confident	87.3	Confident	62 Å²	62	79.4 Å²	79.4	51%	0.512	38%	0.384	S	S	.	.	H	α-helix	trans	-66.9	-48.5	170.3	0	0	0	0	0	111.4	E68 A69 F74 S75 E76	E68-A72 PolarHBondContact O-N 3.07Å; E68-A72 VanDerWaalsContact O-N 3.09Å; A69-A72 PolarHBondContact O-N 3.4Å; A72-F74 PolarHBondContact O-N 3.47Å; A72-S75 VanDerWaalsContact O-CB 3.29Å; A72-S75 WeakPolarHBondContact O-CB 3.43Å; A72-S75 PolarHBondContact O-N 2.94Å; A72-E76 PolarHBondContact O-N 3.2Å
73	L	92.6	Very high	87.2	Confident	84 Å²	84	83.1 Å²	83.1	44%	0.44	41%	0.412	S	S	.	.	H	α-helix	trans	-60.2	-42.2	176.8	-179.8	60.6	0	0	0	112.3	A69 D70 S75 E76 L77	A69-L73 WeakPolarHBondContact O-CB 3.4Å; A69-L73 PolarHBondContact O-N 3.4Å; D70-L73 PolarHBondContact O-N 2.91Å; L73-S75 PolarHBondContact O-N 3.49Å; L73-E76 WeakPolarHBondContact O-CB 3.4Å; L73-E76 PolarHBondContact O-N 3.27Å; L73-E76 VanDerWaalsContact O-N 3.11Å; L73-L77 HydrophobicContact CD1-CG 4.43Å; L73-L77 HydrophobicContact CG-CD1 4.09Å; L73-L77 HydrophobicContact CG-CG 4.44Å; L73-L77 WeakPolarHBondContact O-CG 3.31Å; L73-L77 PolarHBondContact O-N 3.07Å
74	F	93.3	Very high	87.1	Confident	31 Å²	31	85.4 Å²	85.4	14%	0.136	42%	0.421	C	S	.	.	H	α-helix	trans	-57.8	-38.5	173.5	173.1	-102	0	0	0	111.7	A55 I58 K59 L62 D70 A72 E76 L77 H78 L94	A55-F74 HydrophobicContact CB-CE1 4.16Å; A55-F74 HydrophobicContact CB-CZ 4.4Å; I58-F74 HydrophobicContact CB-CD1 4.49Å; I58-F74 HydrophobicContact CB-CE1 3.92Å; I58-F74 HydrophobicContact CB-CE2 4.44Å; I58-F74 HydrophobicContact CB-CZ 3.9Å; I58-F74 HydrophobicContact CD1-CE1 4.49Å; I58-F74 HydrophobicContact CD1-CE2 4.07Å; I58-F74 HydrophobicContact CD1-CZ 3.67Å; I58-F74 HydrophobicContact CG1-CZ 4.39Å; I58-F74 HydrophobicContact CG2-CD1 3.94Å; I58-F74 HydrophobicContact CG2-CD2 3.94Å; I58-F74 HydrophobicContact CG2-CE1 3.77Å; I58-F74 HydrophobicContact CG2-CE2 3.77Å; I58-F74 HydrophobicContact CG2-CG 4.03Å; I58-F74 HydrophobicContact CG2-CZ 3.69Å; K59-F74 HydrophobicContact CG-CD1 3.88Å; K59-F74 HydrophobicContact CG-CE1 4.24Å; L62-F74 HydrophobicContact CD1-CB 4.16Å; D70-F74 VanDerWaalsContact O-CB 3.25Å; D70-F74 WeakPolarHBondContact O-CB 3.34Å; D70-F74 PolarHBondContact O-N 3.42Å; A72-F74 PolarHBondContact O-N 3.47Å; F74-E76 VanDerWaalsContact C-N 3.33Å; F74-E76 PolarHBondContact O-N 3.06Å; F74-L77 PolarHBondContact O-N 3.11Å; F74-H78 VanDerWaalsContact O-CB 3.27Å; F74-H78 WeakPolarHBondContact O-CB 3.45Å; F74-H78 PolarHBondContact O-N 3.49Å; F74-L94 HydrophobicContact CE2-CD2 4.22Å; F74-L94 HydrophobicContact CZ-CD2 4.33Å
75	S	90.6	Very high	86.7	Confident	44 Å²	44	82.8 Å²	82.8	31%	0.308	43%	0.431	S	S	.	.	H	α-helix	trans	-64.1	-37.1	176.8	-57.5	0	0	0	0	112.1	K59 A71 A72 L73 R79	K59-S75 VanDerWaalsContact CE-OG 3.23Å; K59-S75 WeakPolarHBondContact CE-OG 3.31Å; A71-S75 PolarHBondContact O-N 3.14Å; A71-S75 PolarHBondContact O-OG 3.16Å; A72-S75 VanDerWaalsContact O-CB 3.29Å; A72-S75 WeakPolarHBondContact O-CB 3.43Å; A72-S75 PolarHBondContact O-N 2.94Å; L73-S75 PolarHBondContact O-N 3.49Å; S75-R79 PolarHBondContact O-N 3.16Å
76	E	90.7	Very high	86.4	Confident	83 Å²	83	87.6 Å²	87.6	39%	0.388	46%	0.461	S	S	.	.	H	α-helix	trans	-68.4	-43.9	170.9	-70.3	-156.3	177.4	0	0	113.5	A72 L73 F74 H78 R79 K80	A72-E76 PolarHBondContact O-N 3.2Å; L73-E76 WeakPolarHBondContact O-CB 3.4Å; L73-E76 PolarHBondContact O-N 3.27Å; L73-E76 VanDerWaalsContact O-N 3.11Å; F74-E76 VanDerWaalsContact C-N 3.33Å; F74-E76 PolarHBondContact O-N 3.06Å; E76-H78 VanDerWaalsContact C-N 3.3Å; E76-H78 PolarHBondContact O-N 2.94Å; E76-R79 WeakPolarHBondContact O-CB 3.43Å; E76-R79 PolarHBondContact O-N 3.15Å; E76-K80 WeakPolarHBondContact O-CG 3.42Å; E76-K80 PolarHBondContact O-N 2.87Å; E76-K80 IonicContact OE2-NZ 3.32Å; E76-K80 PolarHBondContact OE2-NZ 3.17Å
77	L	90.4	Very high	86.3	Confident	93 Å²	93	80.9 Å²	80.9	49%	0.487	44%	0.441	S	S	.	.	H	α-helix	trans	-63.7	-39.5	180	-68.9	172.7	0	0	0	110.7	L73 F74 R79 K80 L81	L73-L77 HydrophobicContact CD1-CG 4.43Å; L73-L77 HydrophobicContact CG-CD1 4.09Å; L73-L77 HydrophobicContact CG-CG 4.44Å; L73-L77 WeakPolarHBondContact O-CG 3.31Å; L73-L77 PolarHBondContact O-N 3.07Å; F74-L77 PolarHBondContact O-N 3.11Å; L77-R79 VanDerWaalsContact C-N 3.34Å; L77-R79 PolarHBondContact O-N 3.13Å; L77-K80 HydrophobicContact CD2-CD 4.4Å; L77-K80 PolarHBondContact O-N 3.39Å; L77-L81 WeakPolarHBondContact O-CB 3.47Å; L77-L81 PolarHBondContact O-N 3.24Å
78	H	88.3	Confident	85.8	Confident	31 Å²	31	85.8 Å²	85.8	14%	0.144	47%	0.465	C	S	.	.	H	α-helix	trans	-61.9	-39.8	173.3	-168.3	-120.1	0	0	0	111.9	F74 E76 L81 H82	F74-H78 VanDerWaalsContact O-CB 3.27Å; F74-H78 WeakPolarHBondContact O-CB 3.45Å; F74-H78 PolarHBondContact O-N 3.49Å; E76-H78 VanDerWaalsContact C-N 3.3Å; E76-H78 PolarHBondContact O-N 2.94Å; H78-L81 PolarHBondContact O-N 3.23Å; H78-H82 AromaticContact CE1-CE1 3.46Å; H78-H82 PolarHBondContact CE1-CE1 2.78Å; H78-H82 VanDerWaalsContact CE1-CE1 3.46Å; H78-H82 AromaticContact NE2-CE1 3.46Å; H78-H82 PolarHBondContact NE2-CE1 3.12Å; H78-H82 PolarHBondContact O-N 3.01Å; H78-H82 VanDerWaalsContact O-N 3.08Å; H78-H82 PolarHBondContact O-ND1 2.97Å
79	R	87.6	Confident	85.5	Confident	169 Å²	169	83.3 Å²	83.3	64%	0.638	46%	0.456	S	S	*	.	H	α-helix	trans	-66.5	-41.1	172.6	-175.4	-179.8	64.2	164.4	-3.7	112.3	S75 E76 L77 H82 S83	S75-R79 PolarHBondContact O-N 3.16Å; E76-R79 WeakPolarHBondContact O-CB 3.43Å; E76-R79 PolarHBondContact O-N 3.15Å; L77-R79 VanDerWaalsContact C-N 3.34Å; L77-R79 PolarHBondContact O-N 3.13Å; R79-H82 WeakPolarHBondContact O-CB 3.25Å; R79-H82 PolarHBondContact O-N 3.32Å; R79-S83 PolarHBondContact O-N 2.91Å
80	K	86.4	Confident	85.4	Confident	95 Å²	95	81 Å²	81	41%	0.413	43%	0.431	S	S	.	.	H	α-helix	trans	-62.8	-41.9	175	-74.5	159	174.2	156.3	0	111.1	E76 L77 H82 S83 Q84	E76-K80 WeakPolarHBondContact O-CG 3.42Å; E76-K80 PolarHBondContact O-N 2.87Å; E76-K80 IonicContact OE2-NZ 3.32Å; E76-K80 PolarHBondContact OE2-NZ 3.17Å; L77-K80 HydrophobicContact CD2-CD 4.4Å; L77-K80 PolarHBondContact O-N 3.39Å; K80-H82 VanDerWaalsContact C-N 3.3Å; K80-H82 PolarHBondContact O-N 2.87Å; K80-S83 WeakPolarHBondContact O-CB 3.27Å; K80-S83 PolarHBondContact O-N 3.48Å; K80-S83 VanDerWaalsContact O-N 3.14Å; K80-Q84 WeakPolarHBondContact O-CG 3.07Å; K80-Q84 PolarHBondContact O-N 3.12Å
81	L	85.6	Confident	85.3	Confident	51 Å²	51	79.6 Å²	79.6	27%	0.267	42%	0.422	S	S	.	.	H	α-helix	trans	-64.5	-31	175.1	-168.9	68.9	0	0	0	112.9	L77 H78 K90	L77-L81 WeakPolarHBondContact O-CB 3.47Å; L77-L81 PolarHBondContact O-N 3.24Å; H78-L81 PolarHBondContact O-N 3.23Å; L81-K90 HydrophobicContact CD2-CD 4.42Å; L81-K90 HydrophobicContact CG-CD 4.38Å
82	H	82.1	Confident	85.1	Confident	85 Å²	85	81.6 Å²	81.6	39%	0.394	44%	0.436	S	S	.	.	H	α-helix	trans	-70.1	-41.9	170.2	-82.5	70	0	0	0	112.4	E51 H78 R79 K80 Q84 K90	E51-H82 IonicContact OE2-NE2 3.8Å; H78-H82 AromaticContact CE1-CE1 3.46Å; H78-H82 PolarHBondContact CE1-CE1 2.78Å; H78-H82 VanDerWaalsContact CE1-CE1 3.46Å; H78-H82 AromaticContact NE2-CE1 3.46Å; H78-H82 PolarHBondContact NE2-CE1 3.12Å; H78-H82 PolarHBondContact O-N 3.01Å; H78-H82 VanDerWaalsContact O-N 3.08Å; H78-H82 PolarHBondContact O-ND1 2.97Å; R79-H82 WeakPolarHBondContact O-CB 3.25Å; R79-H82 PolarHBondContact O-N 3.32Å; K80-H82 VanDerWaalsContact C-N 3.3Å; K80-H82 PolarHBondContact O-N 2.87Å; H82-Q84 VanDerWaalsContact C-N 3.28Å; H82-Q84 PolarHBondContact O-N 3.09Å; H82-K90 PolarHBondContact CD2-NZ 3.15Å; H82-K90 PolarHBondContact NE2-NZ 3.36Å
83	S	84.6	Confident	85	Confident	106 Å²	106	81.7 Å²	81.7	74%	0.741	43%	0.427	S	S	*	.	H	α-helix	trans	-66	-24.8	-177.9	-168.5	0	0	0	0	114.4	R79 K80	R79-S83 PolarHBondContact O-N 2.91Å; K80-S83 WeakPolarHBondContact O-CB 3.27Å; K80-S83 PolarHBondContact O-N 3.48Å; K80-S83 VanDerWaalsContact O-N 3.14Å
84	Q	81.4	Confident	84.8	Confident	134 Å²	134	78.3 Å²	78.3	63%	0.626	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-15.8	-173	-72.8	175.1	-13.2	0	0	114.5	K80 H82 V86	K80-Q84 WeakPolarHBondContact O-CG 3.07Å; K80-Q84 PolarHBondContact O-N 3.12Å; H82-Q84 VanDerWaalsContact C-N 3.28Å; H82-Q84 PolarHBondContact O-N 3.09Å; Q84-V86 PolarHBondContact O-N 3.34Å
85	G	74.6	Confident	84.5	Confident	63 Å²	63	82 Å²	82	65%	0.649	42%	0.423	S	S	*	.			trans	66	-15.2	171.4	0	0	0	0	0	118.2	L87	G85-L87 VanDerWaalsContact C-N 3.27Å; G85-L87 PolarHBondContact O-N 3.17Å
86	V	77.6	Confident	84.3	Confident	118 Å²	118	84.2 Å²	84.2	72%	0.715	43%	0.431	S	S	*	.			trans	-66.1	-18.5	-171.7	-67.3	0	0	0	0	115.6	Q84	Q84-V86 PolarHBondContact O-N 3.34Å
87	L	79.6	Confident	84.2	Confident	75 Å²	75	85.1 Å²	85.1	39%	0.393	44%	0.438	S	S	.	.			trans	-111.3	111.3	-170.4	-143.3	78.4	0	0	0	112.4	G85 I93	G85-L87 VanDerWaalsContact C-N 3.27Å; G85-L87 PolarHBondContact O-N 3.17Å; L87-I93 HydrophobicContact CD2-CG2 3.59Å
88	K	76.3	Confident	84.1	Confident	200 Å²	200	82.6 Å²	82.6	87%	0.87	42%	0.424	S	S	*	.	S	Bend	trans	-75.1	-31.4	-174.2	-72.3	-171.5	175	-175.2	0	115.6
89	N	80.7	Confident	83.8	Confident	84 Å²	84	85.4 Å²	85.4	45%	0.449	45%	0.448	S	S	.	.			trans	-124.7	83.3	179.5	-67	-49.9	0	0	0	108.7	R49 W91	R49-N89 PolarHBondContact NH1-OD1 2.76Å; N89-W91 VanDerWaalsContact C-N 3.35Å
90	K	85.4	Confident	83.6	Confident	34 Å²	34	83.4 Å²	83.4	15%	0.148	45%	0.449	C	S	.	.	H	α-helix	trans	-74.6	-32.5	-179.3	-34.3	-174.1	-147.2	86.5	0	110.5	E51 L81 H82 S92 I93 L94	E51-K90 VanDerWaalsContact OE1-CA 3.28Å; E51-K90 WeakPolarHBondContact OE1-CA 3.45Å; E51-K90 WeakPolarHBondContact OE1-CB 3.49Å; E51-K90 PolarHBondContact OE1-N 3.22Å; E51-K90 IonicContact OE2-NZ 3.29Å; E51-K90 PolarHBondContact OE2-NZ 3.08Å; L81-K90 HydrophobicContact CD2-CD 4.42Å; L81-K90 HydrophobicContact CG-CD 4.38Å; H82-K90 PolarHBondContact CD2-NZ 3.15Å; H82-K90 PolarHBondContact NE2-NZ 3.36Å; K90-S92 VanDerWaalsContact C-N 3.33Å; K90-S92 PolarHBondContact O-N 3.23Å; K90-I93 WeakPolarHBondContact O-CG2 3.41Å; K90-I93 PolarHBondContact O-N 3.01Å; K90-L94 HydrophobicContact CB-CD1 4.46Å; K90-L94 WeakPolarHBondContact O-CG 3.11Å; K90-L94 PolarHBondContact O-N 3.42Å
91	W	87	Confident	83.6	Confident	22 Å²	22	82 Å²	82	8%	0.083	45%	0.451	C	S	.	.	H	α-helix	trans	-45.2	-55.1	172.9	-178.8	73.6	0	0	0	112.5	P45 V47 R49 D50 E51 N89 I93 L94 Y95	P45-W91 HydrophobicContact CB-CH2 4.47Å; P45-W91 HydrophobicContact CB-CZ3 4.29Å; V47-W91 HydrophobicContact CG2-CH2 3.91Å; V47-W91 HydrophobicContact CG2-CZ2 3.66Å; R49-W91 HydrophobicContact CB-CB 4.3Å; R49-W91 HydrophobicContact CB-CD2 3.95Å; R49-W91 HydrophobicContact CB-CE3 4.2Å; R49-W91 HydrophobicContact CB-CG 3.95Å; R49-W91 HydrophobicContact CG-CD2 3.99Å; R49-W91 HydrophobicContact CG-CE3 3.74Å; R49-W91 HydrophobicContact CG-CG 4.48Å; R49-W91 HydrophobicContact CG-CZ3 4.17Å; D50-W91 VanDerWaalsContact C-CD1 3.46Å; D50-W91 VanDerWaalsContact O-CD1 3.23Å; E51-W91 HydrophobicContact CG-CB 3.69Å; E51-W91 PolarHBondContact OE1-N 2.98Å; N89-W91 VanDerWaalsContact C-N 3.35Å; W91-I93 PolarHBondContact O-N 2.94Å; W91-L94 PolarHBondContact O-N 3.29Å; W91-Y95 AromaticContact CZ2-CD2 4Å; W91-Y95 HydrophobicContact CZ2-CD2 4Å; W91-Y95 HydrophobicContact CZ2-CE2 4.45Å; W91-Y95 HydrophobicContact CZ2-CG 4.25Å; W91-Y95 VanDerWaalsContact O-CB 3.28Å; W91-Y95 WeakPolarHBondContact O-CB 3.28Å; W91-Y95 PolarHBondContact O-N 3.24Å
92	S	83.3	Confident	83.2	Confident	50 Å²	50	86.9 Å²	86.9	35%	0.35	47%	0.472	S	S	.	.	H	α-helix	trans	-64.1	-38.8	-173.5	-58.9	0	0	0	0	113.2	K90 L96	K90-S92 VanDerWaalsContact C-N 3.33Å; K90-S92 PolarHBondContact O-N 3.23Å; S92-L96 WeakPolarHBondContact O-CB 3.41Å; S92-L96 PolarHBondContact O-N 2.89Å; S92-L96 VanDerWaalsContact O-N 3.08Å
93	I	86.9	Confident	82.9	Confident	64 Å²	64	83.8 Å²	83.8	33%	0.328	46%	0.459	S	S	.	.	H	α-helix	trans	-75.4	-38.3	178.9	-171.2	59.7	0	0	0	111.6	L87 K90 W91 L96 L97	L87-I93 HydrophobicContact CD2-CG2 3.59Å; K90-I93 WeakPolarHBondContact O-CG2 3.41Å; K90-I93 PolarHBondContact O-N 3.01Å; W91-I93 PolarHBondContact O-N 2.94Å; I93-L96 PolarHBondContact O-N 3.44Å; I93-L97 HydrophobicContact CD1-CD1 4.36Å; I93-L97 HydrophobicContact CD1-CG 4.27Å; I93-L97 HydrophobicContact CG1-CD1 3.97Å; I93-L97 HydrophobicContact CG1-CG 4.35Å; I93-L97 WeakPolarHBondContact O-CB 3.24Å; I93-L97 VanDerWaalsContact O-CG 3.24Å; I93-L97 WeakPolarHBondContact O-CG 3.28Å; I93-L97 PolarHBondContact O-N 3.35Å
94	L	88.7	Confident	81.9	Confident	12 Å²	12	84.2 Å²	84.2	6%	0.063	46%	0.459	C	S	.	.	H	α-helix	trans	-66.8	-39.7	176.5	-67.6	172.7	0	0	0	111.3	V54 I58 F74 K90 W91 L97 L98	V54-L94 HydrophobicContact CG1-CB 3.77Å; I58-L94 HydrophobicContact CD1-CB 4.17Å; I58-L94 HydrophobicContact CD1-CD2 4.2Å; F74-L94 HydrophobicContact CE2-CD2 4.22Å; F74-L94 HydrophobicContact CZ-CD2 4.33Å; K90-L94 HydrophobicContact CB-CD1 4.46Å; K90-L94 WeakPolarHBondContact O-CG 3.11Å; K90-L94 PolarHBondContact O-N 3.42Å; W91-L94 PolarHBondContact O-N 3.29Å; L94-L97 PolarHBondContact O-N 3.06Å; L94-L98 WeakPolarHBondContact O-CB 3.28Å; L94-L98 PolarHBondContact O-N 3.41Å
95	Y	86.9	Confident	81	Confident	109 Å²	109	86 Å²	86	43%	0.427	46%	0.46	S	S	.	.	H	α-helix	trans	-65.6	-42.7	176.2	-167.6	-84.5	0	0	0	111.6	V54 W91 L98 S99	V54-Y95 HydrophobicContact CG2-CD2 3.94Å; W91-Y95 AromaticContact CZ2-CD2 4Å; W91-Y95 HydrophobicContact CZ2-CD2 4Å; W91-Y95 HydrophobicContact CZ2-CE2 4.45Å; W91-Y95 HydrophobicContact CZ2-CG 4.25Å; W91-Y95 VanDerWaalsContact O-CB 3.28Å; W91-Y95 WeakPolarHBondContact O-CB 3.28Å; W91-Y95 PolarHBondContact O-N 3.24Å; Y95-L98 PolarHBondContact O-N 3.34Å; Y95-S99 WeakPolarHBondContact O-CB 3.34Å; Y95-S99 PolarHBondContact O-N 3.05Å
96	L	87.1	Confident	80.2	Confident	91 Å²	91	89.3 Å²	89.3	48%	0.476	45%	0.453	S	S	.	.	H	α-helix	trans	-63.8	-46.3	175.2	-178.2	63.1	0	0	0	111.8	S92 I93 L98 S99 L100	S92-L96 WeakPolarHBondContact O-CB 3.41Å; S92-L96 PolarHBondContact O-N 2.89Å; S92-L96 VanDerWaalsContact O-N 3.08Å; I93-L96 PolarHBondContact O-N 3.44Å; L96-L98 VanDerWaalsContact C-N 3.35Å; L96-L98 PolarHBondContact O-N 3.47Å; L96-S99 CarbonylContact O-C 3.56Å; L96-S99 PolarHBondContact O-N 2.77Å; L96-L100 HydrophobicContact CD1-CD1 3.91Å; L96-L100 HydrophobicContact CD1-CG 4.23Å; L96-L100 HydrophobicContact CG-CD1 3.91Å; L96-L100 WeakPolarHBondContact O-CB 3.37Å; L96-L100 VanDerWaalsContact O-CG 3.32Å; L96-L100 WeakPolarHBondContact O-CG 3.29Å; L96-L100 PolarHBondContact O-N 2.73Å
97	L	87.9	Confident	78.6	Confident	101 Å²	101	88.5 Å²	88.5	53%	0.529	45%	0.45	S	S	.	.	H	α-helix	trans	-64	-37.6	178.6	-72.5	170.6	0	0	0	112.4	I93 L94 L100 S101	I93-L97 HydrophobicContact CD1-CD1 4.36Å; I93-L97 HydrophobicContact CD1-CG 4.27Å; I93-L97 HydrophobicContact CG1-CD1 3.97Å; I93-L97 HydrophobicContact CG1-CG 4.35Å; I93-L97 WeakPolarHBondContact O-CB 3.24Å; I93-L97 VanDerWaalsContact O-CG 3.24Å; I93-L97 WeakPolarHBondContact O-CG 3.28Å; I93-L97 PolarHBondContact O-N 3.35Å; L94-L97 PolarHBondContact O-N 3.06Å; L97-L100 PolarHBondContact O-N 2.85Å; L97-S101 PolarHBondContact O-N 3.18Å
98	L	87.4	Confident	76.8	Confident	40 Å²	40	90.5 Å²	90.5	21%	0.209	47%	0.468	C	S	.	.	H	α-helix	trans	-63.9	-44.3	171.8	177.8	61.9	0	0	0	111.3	V54 K57 I58 L94 Y95 L96 L100 S101	V54-L98 HydrophobicContact CG1-CD2 4.46Å; K57-L98 HydrophobicContact CB-CD2 3.88Å; I58-L98 HydrophobicContact CD1-CB 4.46Å; I58-L98 HydrophobicContact CG1-CB 4.05Å; I58-L98 HydrophobicContact CG1-CD1 3.99Å; I58-L98 HydrophobicContact CG1-CD2 4.27Å; I58-L98 HydrophobicContact CG1-CG 4.32Å; L94-L98 WeakPolarHBondContact O-CB 3.28Å; L94-L98 PolarHBondContact O-N 3.41Å; Y95-L98 PolarHBondContact O-N 3.34Å; L96-L98 VanDerWaalsContact C-N 3.35Å; L96-L98 PolarHBondContact O-N 3.47Å; L98-L100 PolarHBondContact O-N 3.1Å; L98-S101 PolarHBondContact O-N 3.35Å; L98-S101 PolarHBondContact O-OG 3.47Å
99	S	82.5	Confident	74.7	Confident	90 Å²	90	85 Å²	85	63%	0.629	45%	0.454	S	S	*	.	H	α-helix	trans	-69.7	-14	178.1	-169.6	0	0	0	0	114.4	Y95 L96	Y95-S99 WeakPolarHBondContact O-CB 3.34Å; Y95-S99 PolarHBondContact O-N 3.05Å; L96-S99 CarbonylContact O-C 3.56Å; L96-S99 PolarHBondContact O-N 2.77Å
100	L	84.3	Confident	73	Confident	128 Å²	128	90.5 Å²	90.5	67%	0.67	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.3	0.9	175	-66	175.3	0	0	0	112.8	L96 L97 L98	L96-L100 HydrophobicContact CD1-CD1 3.91Å; L96-L100 HydrophobicContact CD1-CG 4.23Å; L96-L100 HydrophobicContact CG-CD1 3.91Å; L96-L100 WeakPolarHBondContact O-CB 3.37Å; L96-L100 VanDerWaalsContact O-CG 3.32Å; L96-L100 WeakPolarHBondContact O-CG 3.29Å; L96-L100 PolarHBondContact O-N 2.73Å; L97-L100 PolarHBondContact O-N 2.85Å; L98-L100 PolarHBondContact O-N 3.1Å
101	S	84.8	Confident	70.7	Confident	66 Å²	66	95.7 Å²	95.7	46%	0.462	51%	0.509	S	S	.	.			trans	-81.2	120.3	178.8	67.4	0	0	0	0	111.1	L97 L98	L97-S101 PolarHBondContact O-N 3.18Å; L98-S101 PolarHBondContact O-N 3.35Å; L98-S101 PolarHBondContact O-OG 3.47Å
102	E	77.8	Confident	68.1	Low	152 Å²	152	99.5 Å²	99.5	71%	0.71	54%	0.538	S	S	*	.			trans	-106.6	141.3	178.7	-169	165.1	-143.6	0	0	110.4	P104	E102-P104 WeakPolarHBondContact O-CD 3.3Å
103	D	75.6	Confident	66.1	Low	21 Å²	21	100.8 Å²	100.8	11%	0.112	55%	0.548	C	S	.	.			trans	-87.8	107.6	178.9	-178	-17.2	0	0	0	108.7	R64 R105 R106	R64-D103 IonicContact CZ-OD2 3.16Å; R64-D103 IonicContact NH1-OD2 3.69Å; R64-D103 IonicContact NH2-OD2 3.81Å; R64-D103 PolarHBondContact NH2-OD2 2.66Å; D103-R105 PolarHBondContact O-N 3.24Å; D103-R105 PolarHBondContact OD1-N 3.05Å; D103-R106 HydrophobicContact CB-CB 4.42Å; D103-R106 PolarHBondContact O-N 3.26Å
104	P	63.7	Low	64.1	Low	114 Å²	114	106.4 Å²	106.4	74%	0.74	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	1.9	-171.2	29.7	-37.1	0	0	0	114	E102	E102-P104 WeakPolarHBondContact O-CD 3.3Å
105	R	62.6	Low	62	Low	171 Å²	171	108.5 Å²	108.5	65%	0.645	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.1	-1.7	174.8	-48.5	-172.3	-152.6	152.7	18.8	113.2	Q65 D103	Q65-R105 PolarHBondContact O-NH2 2.69Å; D103-R105 PolarHBondContact O-N 3.24Å; D103-R105 PolarHBondContact OD1-N 3.05Å
106	R	58.3	Low	59.8	Low	133 Å²	133	109.6 Å²	109.6	50%	0.502	60%	0.603	S	S	.	*	S	Bend	trans	-105.4	134.2	174.6	-85.7	-176.7	156.7	-172.5	-7.7	111	D103	D103-R106 HydrophobicContact CB-CB 4.42Å; D103-R106 PolarHBondContact O-N 3.26Å
107	P	44.8	Very low	57.3	Low	102 Å²	102	111.9 Å²	111.9	66%	0.662	62%	0.615	S	S	*	*			trans	-68.3	156.6	162.5	31.8	-34.3	0	0	0	110.1	S109	P107-S109 VanDerWaalsContact C-N 3.27Å; P107-S109 PolarHBondContact O-N 2.85Å
108	P	41.1	Very low	55.3	Low	116 Å²	116	113.3 Å²	113.3	75%	0.753	62%	0.618	S	S	*	*			trans	-74.6	72.5	-175.4	30.2	-36.5	0	0	0	112.9
109	S	31.4	Very low	53.3	Low	84 Å²	84	114.8 Å²	114.8	59%	0.587	64%	0.635	S	S	*	*			trans	-78.3	127.1	172.6	59.6	0	0	0	0	111.4	P107	P107-S109 VanDerWaalsContact C-N 3.27Å; P107-S109 PolarHBondContact O-N 2.85Å
110	K	46.2	Very low	52.2	Low	200 Å²	200	115.3 Å²	115.3	87%	0.87	63%	0.628	S	S	*	*	S	Bend	trans	-67.8	157.2	165.2	-68.9	178.8	178.5	176.2	0	110.4
111	V	35.8	Very low	50.6	Low	144 Å²	144	110 Å²	110	87%	0.873	60%	0.603	S	S	*	*	S	Bend	trans	74.2	120.7	-171.9	-168.1	0	0	0	0	112.8
112	S	33.8	Very low	49	Very low	101 Å²	101	113 Å²	113	71%	0.706	61%	0.613	S	S	*	*			trans	-108.7	143.7	-179.6	-171.8	0	0	0	0	111.2
113	S	40.1	Very low	47.9	Very low	78 Å²	78	109.5 Å²	109.5	55%	0.545	60%	0.603	S	S	.	*			trans	-75.4	133.8	-176.2	-48.1	0	0	0	0	112.9	A115	S113-A115 VanDerWaalsContact C-N 3.29Å; S113-A115 PolarHBondContact O-N 3.37Å
114	Y	45	Very low	46.8	Very low	181 Å²	181	112.7 Å²	112.7	71%	0.71	61%	0.614	S	S	*	*			trans	41.1	38.1	150.5	-57.9	-62.3	0	0	0	119	T116 L117	Y114-T116 PolarHBondContact O-N 3.45Å; Y114-T116 VanDerWaalsContact O-N 3.1Å; Y114-L117 HydrophobicContact CG-CD1 4.32Å; Y114-L117 PolarHBondContact O-N 3.46Å
115	A	46	Very low	46.1	Very low	56 Å²	56	114.4 Å²	114.4	46%	0.463	62%	0.617	S	S	.	*	G	3₁₀ helix	trans	-56.6	-28.5	174.5	0	0	0	0	0	112.7	S113 L117 F118 Q120	S113-A115 VanDerWaalsContact C-N 3.29Å; S113-A115 PolarHBondContact O-N 3.37Å; A115-L117 PolarHBondContact O-N 3.33Å; A115-F118 PolarHBondContact O-N 2.89Å; A115-Q120 PolarHBondContact O-NE2 2.96Å
116	T	39.4	Very low	45.2	Very low	133 Å²	133	110.2 Å²	110.2	82%	0.816	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-63.7	-21.7	-178.9	-24.9	0	0	0	0	114.4	Y114 F118	Y114-T116 PolarHBondContact O-N 3.45Å; Y114-T116 VanDerWaalsContact O-N 3.1Å; T116-F118 VanDerWaalsContact C-N 3.3Å; T116-F118 PolarHBondContact O-N 2.94Å
117	L	34.4	Very low	44.4	Very low	138 Å²	138	109.8 Å²	109.8	72%	0.723	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-79.1	-11.6	179.9	-63.4	179.7	0	0	0	113.6	Y114 A115	Y114-L117 HydrophobicContact CG-CD1 4.32Å; Y114-L117 PolarHBondContact O-N 3.46Å; A115-L117 PolarHBondContact O-N 3.33Å
118	F	47.1	Very low	44	Very low	132 Å²	132	111.2 Å²	111.2	58%	0.579	64%	0.635	S	S	*	*	S	Bend	trans	-111.3	141.4	179.8	-62.5	-74.4	0	0	0	111	A115 T116 Q120	A115-F118 PolarHBondContact O-N 2.89Å; T116-F118 VanDerWaalsContact C-N 3.3Å; T116-F118 PolarHBondContact O-N 2.94Å; F118-Q120 WeakPolarHBondContact O-CG 3.48Å; F118-Q120 PolarHBondContact O-N 3.48Å
119	A	44.4	Very low	43.8	Very low	71 Å²	71	111 Å²	111	59%	0.587	63%	0.631	S	S	*	*			trans	-42	113.7	-179	0	0	0	0	0	112.3	L53 K57	L53-A119 HydrophobicContact CD1-CB 3.86Å; K57-A119 WeakPolarHBondContact CE-O 3.5Å; K57-A119 PolarHBondContact NZ-O 2.98Å
120	Q	58.8	Low	43.9	Very low	100 Å²	100	112.7 Å²	112.7	47%	0.467	64%	0.64	S	S	.	*	P	Polyproline II helix	trans	-90.2	156.2	176.4	-66.6	-58.3	-13.5	0	0	111	A115 F118	A115-Q120 PolarHBondContact O-NE2 2.96Å; F118-Q120 WeakPolarHBondContact O-CG 3.48Å; F118-Q120 PolarHBondContact O-N 3.48Å
121	A	52	Low	43.1	Very low	18 Å²	18	113.1 Å²	113.1	15%	0.149	64%	0.638	C	S	.	*	P	Polyproline II helix	trans	-65.1	138.1	171.8	0	0	0	0	0	108.4	V47 L53	V47-A121 HydrophobicContact CB-CB 3.79Å; V47-A121 HydrophobicContact CG1-CB 4.29Å; V47-A121 HydrophobicContact CG2-CB 4.03Å; L53-A121 HydrophobicContact CD2-CB 4.14Å
122	L	50.8	Low	42.6	Very low	129 Å²	129	116.9 Å²	116.9	68%	0.675	64%	0.638	S	S	*	*	P	Polyproline II helix	trans	-61.7	132.5	-174.7	-67.3	172	0	0	0	110.5	V47 E48	V47-L122 WeakPolarHBondContact CA-O 3.35Å; E48-L122 PolarHBondContact N-O 3.34Å
123	P	55.6	Low	42.3	Very low	78 Å²	78	121.6 Å²	121.6	51%	0.506	64%	0.642	S	S	.	*	B	Isolated β-bridge	trans	-59.6	136.2	169.7	-21.4	32.8	0	0	0	110.4	D125	P123-D125 WeakPolarHBondContact CB-OD2 3.3Å; P123-D125 PolarHBondContact O-N 3.36Å
124	R	51.8	Low	41.7	Very low	88 Å²	88	122.3 Å²	122.3	33%	0.332	65%	0.653	S	S	.	*	G	3₁₀ helix	trans	-70.4	-13.3	-179.5	-88.9	-176.5	150.7	-150	-13.4	114.5	P45 T46 E48 A126 H127	P45-R124 WeakPolarHBondContact O-CD 3.49Å; T46-R124 PolarHBondContact O-N 3.44Å; E48-R124 HydrophobicContact CG-CG 4.01Å; E48-R124 WeakPolarHBondContact OE1-CG 3.39Å; E48-R124 IonicContact OE1-CZ 2.77Å; E48-R124 IonicContact OE1-NE 3.94Å; E48-R124 PolarHBondContact OE1-NE 3.4Å; E48-R124 IonicContact OE1-NH2 2.69Å; E48-R124 PolarHBondContact OE1-NH2 2.78Å; E48-R124 IonicContact OE2-CZ 3.1Å; E48-R124 IonicContact OE2-NE 3.59Å; E48-R124 PolarHBondContact OE2-NE 3.09Å; E48-R124 IonicContact OE2-NH2 3.28Å; E48-R124 PolarHBondContact OE2-NH2 3.45Å; R124-A126 PolarHBondContact O-N 3.22Å; R124-H127 PolarHBondContact O-N 3.02Å
125	D	48.1	Very low	40.8	Very low	149 Å²	149	124.3 Å²	124.3	80%	0.797	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-63.1	-13.4	-177.8	-44.5	-68.7	0	0	0	113.7	P123 H127	P123-D125 WeakPolarHBondContact CB-OD2 3.3Å; P123-D125 PolarHBondContact O-N 3.36Å; D125-H127 VanDerWaalsContact C-N 3.26Å; D125-H127 PolarHBondContact O-N 3Å
126	A	44.3	Very low	40	Very low	84 Å²	84	126.9 Å²	126.9	69%	0.694	67%	0.671	S	S	*	*	G	3₁₀ helix	trans	-75.5	-6.2	172.4	0	0	0	0	0	114.4	R124	R124-A126 PolarHBondContact O-N 3.22Å
127	H	40.7	Very low	39.4	Very low	123 Å²	123	129.4 Å²	129.4	57%	0.569	67%	0.674	S	S	*	*	S	Bend	trans	-122.6	131.9	-179.7	-68.6	-33.8	0	0	0	111.9	R124 D125 T129	R124-H127 PolarHBondContact O-N 3.02Å; D125-H127 VanDerWaalsContact C-N 3.26Å; D125-H127 PolarHBondContact O-N 3Å; H127-T129 VanDerWaalsContact C-N 3.28Å; H127-T129 PolarHBondContact O-N 3.27Å
128	S	37.5	Very low	39.1	Very low	133 Å²	133	129.2 Å²	129.2	93%	0.93	68%	0.678	S	S	*	*			trans	-74.5	64.9	-171.3	-50.2	0	0	0	0	114.5
129	T	36.4	Very low	38	Very low	110 Å²	110	130.8 Å²	130.8	68%	0.675	69%	0.692	S	S	*	*			trans	-85.6	129.9	166	50.6	0	0	0	0	110.9	H127 Y131	H127-T129 VanDerWaalsContact C-N 3.28Å; H127-T129 PolarHBondContact O-N 3.27Å; T129-Y131 PolarHBondContact O-N 3.15Å
130	P	33.8	Very low	37.3	Very low	120 Å²	120	132.5 Å²	132.5	78%	0.779	70%	0.697	S	S	*	*			trans	-67.5	117.7	-176.1	-19.4	31.8	0	0	0	112.8	Y132	P130-Y132 PolarHBondContact O-N 3.06Å
131	Y	29	Very low	35.7	Very low	210 Å²	210	135.4 Å²	135.4	82%	0.824	72%	0.715	S	S	*	*			trans	-81.4	106.6	175.1	-149.7	-83.5	0	0	0	109.9	T129 Y133	T129-Y131 PolarHBondContact O-N 3.15Å; Y131-Y133 PolarHBondContact O-N 2.96Å; Y131-Y133 VanDerWaalsContact O-N 3.07Å
132	Y	26.4	Very low	34.3	Very low	223 Å²	223	140.4 Å²	140.4	88%	0.875	75%	0.749	S	S	*	*			trans	-73	100.1	-177.7	-116.1	-88.2	0	0	0	111.3	P130 A134	P130-Y132 PolarHBondContact O-N 3.06Å; Y132-A134 PolarHBondContact O-N 3.07Å
133	Y	27.8	Very low	33.1	Very low	199 Å²	199	144.3 Å²	144.3	78%	0.78	76%	0.756	S	S	*	*			trans	-81.8	95.9	-179.2	-135	-80.6	0	0	0	111.3	Y131 R135	Y131-Y133 PolarHBondContact O-N 2.96Å; Y131-Y133 VanDerWaalsContact O-N 3.07Å; Y133-R135 PolarHBondContact O-N 3.29Å; Y133-R135 VanDerWaalsContact O-N 3.14Å
134	A	27.4	Very low	31.7	Very low	94 Å²	94	150 Å²	150	78%	0.777	78%	0.776	S	S	*	*			trans	-71.8	103.5	171.7	0	0	0	0	0	110.2	Y132 P136	Y132-A134 PolarHBondContact O-N 3.07Å; A134-P136 WeakPolarHBondContact O-CD 3.46Å
135	R	26	Very low	30.2	Very low	222 Å²	222	151.9 Å²	151.9	84%	0.838	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-76.3	118.7	-175.3	-172.1	-173.5	-165.3	-179.2	5.9	111.4	Y133	Y133-R135 PolarHBondContact O-N 3.29Å; Y133-R135 VanDerWaalsContact O-N 3.14Å
136	P	27.7	Very low	29.1	Very low	111 Å²	111	155.2 Å²	155.2	72%	0.721	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-67.5	135.4	167.3	28.7	-32.7	0	0	0	109.7	A134	A134-P136 WeakPolarHBondContact O-CD 3.46Å
137	Q	28.5	Very low	28	Very low	186 Å²	186	156.8 Å²	156.8	87%	0.869	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-82.3	137.6	176.2	-70.1	179.5	-18.1	0	0	110.7
138	T	26.6	Very low	27.1	Very low	134 Å²	134	155 Å²	155	82%	0.822	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-95.3	124.6	171.2	49.8	0	0	0	0	110.5
139	L	25.3	Very low	26.4	Very low	164 Å²	164	157.3 Å²	157.3	86%	0.859	80%	0.803	S	S	*	*			trans	-130.9	155.6	158.7	-79.1	175.9	0	0	0	109.3
140	P	28.1	Very low	25.7	Very low	107 Å²	107	158 Å²	158	70%	0.695	81%	0.811	S	S	*	*			trans	-111	159.9	-140.9	39.8	-35.1	0	0	0	116.4
141	L	26.2	Very low	25.2	Very low	161 Å²	161	156.2 Å²	156.2	84%	0.843	81%	0.807	S	S	*	*			trans	27.2	115.3	145.3	-66.4	166.6	0	0	0	119.1
142	S	22.9	Very low	24.9	Very low	124 Å²	124	154.7 Å²	154.7	87%	0.867	81%	0.807	S	S	*	*			trans	-133.3	147.7	133.9	63.1	0	0	0	0	109.9
143	Y	25.5	Very low	24.7	Very low	211 Å²	211	148.8 Å²	148.8	83%	0.827	80%	0.799	S	S	*	*			trans	-112.7	134.1	178.4	-128.8	-93.9	0	0	0	107.1
144	Q	26.3	Very low	24.7	Very low	197 Å²	197	145 Å²	145	92%	0.921	80%	0.802	S	S	*	*			trans	-153.4	159.9	154.2	-125.8	171.3	4.9	0	0	113.8
145	D	20.7	Very low	24.6	Very low	128 Å²	128	143.8 Å²	143.8	68%	0.684	80%	0.798	S	S	*	*			trans	-94.9	156.2	-148	-119.1	-57.4	0	0	0	115.2
146	R	23.5	Very low	24.6	Very low	218 Å²	218	139 Å²	139	82%	0.823	80%	0.799	S	S	*	*			trans	43	153.4	142	-81.3	165.5	168.7	-144.8	-4.1	123.4
147	S	21.4	Very low	24.8	Very low	118 Å²	118	140.5 Å²	140.5	83%	0.825	81%	0.806	S	S	*	*			trans	76.3	158.6	150.3	78.1	0	0	0	0	118
148	A	22.9	Very low	24.6	Very low	85 Å²	85	135.1 Å²	135.1	70%	0.702	80%	0.8	S	S	*	*			cis	-165.6	141.6	-36.9	0	0	0	0	0	110.3
149	Q	22.7	Very low	24.5	Very low	182 Å²	182	134.2 Å²	134.2	85%	0.85	80%	0.799	S	S	*	*			trans	53.2	152.2	153.5	-67.5	-176.4	-16.9	0	0	122
150	S	21.5	Very low	24.6	Very low	123 Å²	123	131.9 Å²	131.9	86%	0.86	80%	0.797	S	S	*	*			trans	71.2	156.2	158.9	78.2	0	0	0	0	118.7
151	A	22	Very low	24.5	Very low	83 Å²	83	130.4 Å²	130.4	69%	0.686	80%	0.801	S	S	*	*			cis	-166.9	168.8	-33.2	0	0	0	0	0	110.5
152	Q	24.4	Very low	24.5	Very low	178 Å²	178	130.5 Å²	130.5	83%	0.832	80%	0.8	S	S	*	*			trans	69	108.3	158	-71.5	174.9	-0.3	0	0	120.8
153	S	22.3	Very low	24.6	Very low	100 Å²	100	129.2 Å²	129.2	70%	0.699	79%	0.791	S	S	*	*				29.8	141	120.5	61.8	0	0	0	0	120.7
154	S	25.9	Very low	24.6	Very low	119 Å²	119	123.9 Å²	123.9	83%	0.832	79%	0.785	S	S	*	*			cis	-165.5	162.3	42.9	-47.9	0	0	0	0	114.3
155	G	25.6	Very low	24.6	Very low	69 Å²	69	122.6 Å²	122.6	71%	0.711	78%	0.783	S	S	*	*			trans	110.8	108.3	167.2	0	0	0	0	0	113.9
156	S	27.7	Very low	24.8	Very low	121 Å²	121	119.4 Å²	119.4	85%	0.846	78%	0.78	S	S	*	*				71.6	122.1	60.2	-153	0	0	0	0	112.1
157	V	30.1	Very low	24.8	Very low	143 Å²	143	117.8 Å²	117.8	87%	0.867	79%	0.787	S	S	*	*			cis	-141.8	153.3	16	-179.6	0	0	0	0	110
158	G	24.5	Very low	24.9	Very low	72 Å²	72	118.5 Å²	118.5	74%	0.742	79%	0.79	S	S	*	*			trans	163.5	90	159.7	0	0	0	0	0	120.2
159	S	25.3	Very low	24.9	Very low	115 Å²	115	118.8 Å²	118.8	80%	0.804	79%	0.792	S	S	*	*			trans	41.1	118	155.6	-166.6	0	0	0	0	122.4
160	S	27.6	Very low	25	Very low	116 Å²	116	117.9 Å²	117.9	81%	0.811	79%	0.793	S	S	*	*			trans	-10	157.1	136.9	-44.8	0	0	0	0	119.8
161	G	25.6	Very low	25.1	Very low	76 Å²	76	117.6 Å²	117.6	78%	0.784	79%	0.79	S	S	*	*			cis	159.4	114.6	0.6	0	0	0	0	0	113.2
162	I	26.3	Very low	25.2	Very low	162 Å²	162	117.3 Å²	117.3	83%	0.831	80%	0.796	S	S	*	*			trans	-60.6	141	-177	34.5	168.3	0	0	0	117.2
163	S	24.7	Very low	25.8	Very low	97 Å²	97	115.2 Å²	115.2	68%	0.678	80%	0.798	S	S	*	*				65.4	120.9	129.1	-57.2	0	0	0	0	123.9
164	S	26.4	Very low	25.8	Very low	99 Å²	99	114.8 Å²	114.8	69%	0.692	80%	0.8	S	S	*	*				89	144.6	117.3	74.2	0	0	0	0	123.1
165	I	25.6	Very low	26.4	Very low	171 Å²	171	115.3 Å²	115.3	88%	0.877	80%	0.801	S	S	*	*			trans	72.1	131.1	156.8	-65.5	158.3	0	0	0	118.4
166	G	24.2	Very low	26.3	Very low	60 Å²	60	116.4 Å²	116.4	62%	0.619	80%	0.803	S	S	*	*			trans	134.4	99.4	142.3	0	0	0	0	0	117.4
167	L	24.1	Very low	26.7	Very low	185 Å²	185	115.8 Å²	115.8	97%	0.969	80%	0.796	S	S	*	*			trans	55	142.6	145.8	-67.6	154.1	0	0	0	120.2
168	C	24.3	Very low	26.6	Very low	132 Å²	132	117.7 Å²	117.7	89%	0.892	80%	0.795	S	S	*	*			trans	-148.1	127.9	163.7	-162.1	0	0	0	0	110.3
169	A	22.3	Very low	26.6	Very low	91 Å²	91	119 Å²	119	75%	0.752	79%	0.793	S	S	*	*			trans	-146.6	121.4	177.8	0	0	0	0	0	111.4
170	L	25.4	Very low	26.5	Very low	164 Å²	164	121.6 Å²	121.6	86%	0.859	80%	0.797	S	S	*	*			trans	48.2	121.1	149.7	-74.2	160.9	0	0	0	121.9
171	S	23.6	Very low	26.5	Very low	116 Å²	116	123.6 Å²	123.6	81%	0.811	80%	0.798	S	S	*	*				108.8	99	119.2	68.9	0	0	0	0	122.2
172	G	23.6	Very low	27	Very low	78 Å²	78	126 Å²	126	80%	0.804	80%	0.8	S	S	*	*			trans	73.3	175.5	140.4	0	0	0	0	0	120
173	P	36.5	Very low	26.9	Very low	134 Å²	134	121.6 Å²	121.6	87%	0.87	79%	0.794	S	S	*	*			cis	-125.2	-158.7	-18.1	40.2	-23.3	0	0	0	113.3
174	A	22.2	Very low	27.1	Very low	90 Å²	90	126.3 Å²	126.3	74%	0.744	81%	0.805	S	S	*	*			trans	-81.9	180	-175.6	0	0	0	0	0	113.6
175	P	37.9	Very low	27	Very low	131 Å²	131	125.2 Å²	125.2	85%	0.851	80%	0.797	S	S	*	*			cis	-142.4	-166.4	39.8	42	-19.8	0	0	0	117.5
176	A	23.8	Very low	27	Very low	91 Å²	91	125.1 Å²	125.1	75%	0.752	79%	0.793	S	S	*	*			trans	-89.4	-177.3	-175.7	0	0	0	0	0	113.9
177	P	37.3	Very low	27	Very low	109 Å²	109	131.1 Å²	131.1	71%	0.708	81%	0.805	S	S	*	*				-152.4	160.9	67.6	42.4	-22.8	0	0	0	119.2
178	Q	27.4	Very low	26.9	Very low	183 Å²	183	126.3 Å²	126.3	86%	0.855	79%	0.792	S	S	*	*			trans	50.4	153.8	136.3	-68.7	-179	3.9	0	0	122.9
179	S	24.5	Very low	27.6	Very low	100 Å²	100	126.2 Å²	126.2	70%	0.699	79%	0.79	S	S	*	*			cis	-169.5	166.3	-12.2	53.5	0	0	0	0	111
180	L	23.4	Very low	27.7	Very low	168 Å²	168	125 Å²	125	88%	0.88	79%	0.786	S	S	*	*			trans	-177.6	161.8	140.4	-101.5	165.3	0	0	0	113.4
181	L	26.8	Very low	28	Very low	159 Å²	159	124.3 Å²	124.3	83%	0.832	79%	0.788	S	S	*	*			trans	-149.3	-174.2	-175.8	-88.1	172.3	0	0	0	108.2
182	P	37.3	Very low	28.1	Very low	126 Å²	126	121.7 Å²	121.7	82%	0.818	78%	0.78	S	S	*	*			cis	-144.6	-170.3	12.9	44.8	-24.1	0	0	0	118
183	G	24.2	Very low	28.1	Very low	69 Å²	69	125.6 Å²	125.6	71%	0.711	78%	0.782	S	S	*	*			trans	111.3	125.1	161.8	0	0	0	0	0	115
184	Q	28.4	Very low	27.5	Very low	197 Å²	197	124.2 Å²	124.2	92%	0.921	78%	0.775	S	S	*	*			cis	81.9	139.6	38	-74.8	-162.6	-4.2	0	0	115.6
185	S	25	Very low	27.7	Very low	75 Å²	75	127.1 Å²	127.1	52%	0.524	78%	0.777	S	S	.	*			cis	-159.4	177.3	9.3	37.3	0	0	0	0	115.5
186	H	25.5	Very low	27.1	Very low	169 Å²	169	130.7 Å²	130.7	78%	0.782	77%	0.773	S	S	*	*			trans	87.3	158.4	166.9	-47.4	-68.8	0	0	0	116.5
187	Q	23.8	Very low	27.4	Very low	187 Å²	187	132.6 Å²	132.6	87%	0.874	77%	0.766	S	S	*	*			cis	-145.8	-174.8	5.3	-147.7	168.8	1.1	0	0	112.9
188	A	21.9	Very low	26.9	Very low	84 Å²	84	134.5 Å²	134.5	69%	0.694	77%	0.766	S	S	*	*			trans	-157.9	-171.6	-177.3	0	0	0	0	0	108.7
189	P	39	Very low	26.9	Very low	130 Å²	130	133.7 Å²	133.7	84%	0.844	77%	0.767	S	S	*	*			cis	-143.7	-170.6	13.5	44.9	-24.4	0	0	0	117.6
190	G	25	Very low	27	Very low	66 Å²	66	132.1 Å²	132.1	68%	0.68	77%	0.766	S	S	*	*			trans	134.7	75	165.6	0	0	0	0	0	114.6
191	V	30.6	Very low	27.3	Very low	148 Å²	148	129.4 Å²	129.4	90%	0.897	76%	0.762	S	S	*	*				67.2	120.1	81.6	-178	0	0	0	0	113.9
192	G	25.5	Very low	27.3	Very low	61 Å²	61	133 Å²	133	63%	0.629	76%	0.764	S	S	*	*			cis	173.8	167.7	-6.2	0	0	0	0	0	115.2
193	D	24.7	Very low	26.9	Very low	161 Å²	161	134.3 Å²	134.3	86%	0.861	76%	0.763	S	S	*	*			trans	46.4	152.6	142.9	-63.4	-32.7	0	0	0	124.8
194	C	22.9	Very low	27	Very low	105 Å²	105	135.2 Å²	135.2	71%	0.709	76%	0.764	S	S	*	*			cis	-172.8	175.8	-28.3	-159.9	0	0	0	0	110.9
195	L	26.6	Very low	27.1	Very low	151 Å²	151	137 Å²	137	79%	0.791	76%	0.763	S	S	*	*			trans	86.5	125.7	156.9	-62.4	173.2	0	0	0	122.9
196	R	26.1	Very low	27.2	Very low	205 Å²	205	139.8 Å²	139.8	77%	0.774	78%	0.777	S	S	*	*				106.7	102.1	127.7	-100.1	-171.5	161.1	151.2	0.4	123.5
197	Q	29.1	Very low	27.3	Very low	131 Å²	131	139.3 Å²	139.3	61%	0.612	78%	0.779	S	S	*	*				58.5	109.7	122.9	-73.5	-176	-89.3	0	0	123
198	Q	26.6	Very low	27.4	Very low	149 Å²	149	137.4 Å²	137.4	70%	0.696	78%	0.78	S	S	*	*				86	150.1	109.8	-153.7	175.5	-19.5	0	0	120.7
199	L	28.6	Very low	27.6	Very low	166 Å²	166	137.6 Å²	137.6	87%	0.869	78%	0.782	S	S	*	*			trans	72.5	152	176.1	-51	175.2	0	0	0	115.8
200	G	26	Very low	27	Very low	67 Å²	67	138.8 Å²	138.8	69%	0.691	78%	0.781	S	S	*	*			cis	160.4	106.2	-5.3	0	0	0	0	0	113.3
201	S	28.9	Very low	26.9	Very low	112 Å²	112	143.9 Å²	143.9	78%	0.783	79%	0.787	S	S	*	*			trans	10.7	141.4	159	63.7	0	0	0	0	123.6
202	R	26.8	Very low	27.2	Very low	233 Å²	233	142.3 Å²	142.3	88%	0.879	78%	0.78	S	S	*	*			trans	82.3	162.3	142	-82.5	-178	175.6	-165.4	0.3	121.3
203	L	29.5	Very low	27.2	Very low	154 Å²	154	143.9 Å²	143.9	81%	0.806	78%	0.781	S	S	*	*			trans	98.7	117.5	167.9	-53.5	178.7	0	0	0	114
204	A	26.8	Very low	27.3	Very low	88 Å²	88	141.1 Å²	141.1	73%	0.727	78%	0.775	S	S	*	*			cis	75.7	119.6	45.3	0	0	0	0	0	112.8
205	W	30.5	Very low	27.6	Very low	235 Å²	235	145.1 Å²	145.1	89%	0.89	78%	0.783	S	S	*	*			trans	-126.7	131.9	-179.7	-83.7	106	0	0	0	111.3
206	T	26.9	Very low	27.6	Very low	134 Å²	134	140.9 Å²	140.9	82%	0.822	77%	0.77	S	S	*	*			trans	-131.8	147.1	167.2	48.7	0	0	0	0	107.1
207	L	27.8	Very low	27.6	Very low	159 Å²	159	137.6 Å²	137.6	83%	0.832	77%	0.773	S	S	*	*			trans	-123.6	129.3	179	-75.8	173.1	0	0	0	110.6
208	T	25.5	Very low	27.6	Very low	146 Å²	146	137.7 Å²	137.7	90%	0.896	78%	0.782	S	S	*	*			trans	-137.7	147.2	164.7	47.6	0	0	0	0	108.2
209	A	26.1	Very low	27.8	Very low	88 Å²	88	135.5 Å²	135.5	73%	0.727	78%	0.784	S	S	*	*			trans	-95.1	148.3	-166.3	0	0	0	0	0	114
210	N	26.1	Very low	28	Very low	156 Å²	156	137.1 Å²	137.1	83%	0.834	78%	0.784	S	S	*	*				-174.3	155.8	106.4	-98.9	-33.2	0	0	0	115.7
211	Q	23.8	Very low	28	Very low	173 Å²	173	137.3 Å²	137.3	81%	0.808	79%	0.786	S	S	*	*			trans	-34	174.9	168.7	-64	-176.1	0.5	0	0	119.1
212	P	37.3	Very low	28.1	Very low	115 Å²	115	138.8 Å²	138.8	75%	0.747	79%	0.79	S	S	*	*			cis	-121.4	-143.4	0.3	42.8	-25.9	0	0	0	110.9
213	S	24.8	Very low	28.9	Very low	93 Å²	93	133.3 Å²	133.3	65%	0.65	78%	0.784	S	S	*	*			cis	-164.3	144.1	-4.6	40.4	0	0	0	0	110.3
214	S	26.5	Very low	28.9	Very low	104 Å²	104	133.3 Å²	133.3	73%	0.727	79%	0.785	S	S	*	*			trans	57.2	148.3	153	52.4	0	0	0	0	120
215	Q	28.9	Very low	29	Very low	188 Å²	188	133.6 Å²	133.6	88%	0.879	79%	0.788	S	S	*	*			cis	-169.6	168.5	-7.4	-107	-169.8	25.7	0	0	106.6
216	A	26.3	Very low	29.1	Very low	62 Å²	62	128.5 Å²	128.5	51%	0.512	78%	0.782	S	S	.	*			cis	-165.6	157.2	-11.2	0	0	0	0	0	110.4
217	T	27.8	Very low	29.4	Very low	137 Å²	137	127.7 Å²	127.7	84%	0.84	78%	0.782	S	S	*	*			trans	66	152.2	157.7	55	0	0	0	0	118.9
218	T	28.6	Very low	29.6	Very low	132 Å²	132	131.5 Å²	131.5	81%	0.81	79%	0.785	S	S	*	*			cis	-124.7	175.5	21.3	47	0	0	0	0	115.9
219	S	29.8	Very low	29.9	Very low	104 Å²	104	132.7 Å²	132.7	73%	0.727	79%	0.786	S	S	*	*			trans	-70.5	165	-172.3	49.5	0	0	0	0	114.4
220	K	33.4	Very low	30.2	Very low	200 Å²	200	137.2 Å²	137.2	87%	0.87	80%	0.795	S	S	*	*			cis	-147.6	147.9	41.1	-57	169.2	-176.1	174.7	0	113.5
221	G	26.8	Very low	30.4	Very low	71 Å²	71	136.3 Å²	136.3	73%	0.732	80%	0.795	S	S	*	*			trans	-96.1	-156.8	166.1	0	0	0	0	0	111.9
222	V	30.4	Very low	30.9	Very low	143 Å²	143	140.1 Å²	140.1	87%	0.867	80%	0.802	S	S	*	*			cis	-164.1	-168.5	2.5	-129.3	0	0	0	0	105.9
223	P	43	Very low	30.6	Very low	117 Å²	117	140 Å²	140	76%	0.76	80%	0.803	S	S	*	*			cis	-131.1	-167.8	-29.5	37.9	-18.1	0	0	0	114
224	N	30.3	Very low	30.8	Very low	154 Å²	154	144.9 Å²	144.9	82%	0.824	81%	0.808	S	S	*	*			trans	-46.7	152.6	177.4	-58.7	-19.5	0	0	0	119.5
225	A	29	Very low	31	Very low	95 Å²	95	151.4 Å²	151.4	79%	0.785	82%	0.816	S	S	*	*			trans	-139.5	127	137.4	0	0	0	0	0	106.9
226	V	31.7	Very low	31.1	Very low	128 Å²	128	149.8 Å²	149.8	78%	0.776	81%	0.809	S	S	*	*			cis	65.5	113.3	46.2	-171.9	0	0	0	0	112.2
227	S	34.5	Very low	31.3	Very low	117 Å²	117	150.4 Å²	150.4	82%	0.818	82%	0.821	S	S	*	*			trans	-62.3	138.7	-172.2	-51.9	0	0	0	0	114.2
228	R	31.7	Very low	31.3	Very low	238 Å²	238	151.9 Å²	151.9	90%	0.898	82%	0.824	S	S	*	*			trans	-132.8	81.6	159.8	-80.7	-173.2	169.5	174.5	-2.5	110.7	M230	R228-M230 PolarHBondContact O-N 3.08Å
229	N	31.2	Very low	32	Very low	172 Å²	172	152.4 Å²	152.4	92%	0.92	83%	0.827	S	S	*	*			trans	-72.9	104.1	157.8	-86.2	-3.6	0	0	0	107.8
230	M	32.1	Very low	32.1	Very low	183 Å²	183	150.2 Å²	150.2	90%	0.901	82%	0.82	S	S	*	*			trans	-90.4	123.7	178.7	-169.1	155.8	165.6	0	0	109.7	R228	R228-M230 PolarHBondContact O-N 3.08Å
231	T	31.4	Very low	32.3	Very low	136 Å²	136	147.1 Å²	147.1	83%	0.834	82%	0.823	S	S	*	*			trans	-63.1	139.5	-173.6	34.2	0	0	0	0	113.6
232	R	32.9	Very low	32.9	Very low	254 Å²	254	148.4 Å²	148.4	96%	0.958	82%	0.816	S	S	*	*			trans	-123	117.9	155.5	-156.8	175.7	-166.9	-177.7	4	108.2
233	S	31.1	Very low	33.7	Very low	112 Å²	112	149 Å²	149	78%	0.783	81%	0.812	S	S	*	*			trans	-100.7	155	-164.9	-170.3	0	0	0	0	113.7
234	R	29.1	Very low	34.3	Very low	195 Å²	195	151.6 Å²	151.6	74%	0.736	81%	0.814	S	S	*	*			trans	83.8	103	150	-154.6	171.5	-159.8	-178.2	7.9	119.3	E236	R234-E236 IonicContact CZ-OE2 3.69Å; R234-E236 IonicContact NE-OE2 2.99Å; R234-E236 PolarHBondContact NE-OE2 3.34Å; R234-E236 IonicContact NH2-OE1 3.97Å; R234-E236 IonicContact NH2-OE2 3.45Å; R234-E236 PolarHBondContact NH2-OE2 3.05Å
235	R	31.5	Very low	35.8	Very low	242 Å²	242	146 Å²	146	91%	0.913	78%	0.783	S	S	*	*				-141.8	149.3	92.9	-94.9	179.6	-176.7	-173.1	-0.1	110.2
236	E	31.4	Very low	37.7	Very low	154 Å²	154	145.9 Å²	145.9	72%	0.72	77%	0.773	S	S	*	*			trans	-79.1	145.1	180	-66.4	124.3	101.3	0	0	111.2	R234	R234-E236 IonicContact CZ-OE2 3.69Å; R234-E236 IonicContact NE-OE2 2.99Å; R234-E236 PolarHBondContact NE-OE2 3.34Å; R234-E236 IonicContact NH2-OE1 3.97Å; R234-E236 IonicContact NH2-OE2 3.45Å; R234-E236 PolarHBondContact NH2-OE2 3.05Å
237	G	29.2	Very low	39.7	Very low	74 Å²	74	143.5 Å²	143.5	76%	0.763	75%	0.754	S	S	*	*			trans	176	103.3	-179.6	0	0	0	0	0	114.2
238	D	28.6	Very low	41.6	Very low	169 Å²	169	140.2 Å²	140.2	90%	0.904	73%	0.733	S	S	*	*			trans	63.9	129.2	166.2	-115.7	-15.1	0	0	0	121
239	T	42.6	Very low	43.7	Very low	142 Å²	142	130.2 Å²	130.2	87%	0.871	70%	0.701	S	S	*	*			trans	-98.9	88.9	178.1	46.7	0	0	0	0	111.6
240	G	32.8	Very low	45.9	Very low	58 Å²	58	122.1 Å²	122.1	60%	0.598	66%	0.658	S	S	*	*			trans	-92.5	131.7	165.7	0	0	0	0	0	111.5	T242	G240-T242 VanDerWaalsContact C-N 3.31Å; G240-T242 PolarHBondContact O-N 3.09Å
241	C	37.9	Very low	48.2	Very low	136 Å²	136	113.6 Å²	113.6	92%	0.919	62%	0.616	S	S	*	*			trans	-77.5	77.5	-179.6	-156.7	0	0	0	0	111.4	M243	C241-M243 PolarHBondContact O-N 2.62Å; C241-M243 VanDerWaalsContact O-N 3.13Å
242	T	38.4	Very low	50.6	Low	97 Å²	97	111.2 Å²	111.2	60%	0.595	59%	0.592	S	S	*	*			trans	-77.3	94.5	-177.1	54	0	0	0	0	111.7	G240 E244 N282	G240-T242 VanDerWaalsContact C-N 3.31Å; G240-T242 PolarHBondContact O-N 3.09Å; T242-E244 PolarHBondContact O-N 3.45Å; T242-N282 WeakPolarHBondContact CG2-ND2 3.28Å
243	M	47.8	Very low	53	Low	157 Å²	157	99.3 Å²	99.3	77%	0.773	55%	0.548	S	S	*	.	P	Polyproline II helix	trans	-66.8	118.8	167.4	-70.4	-175.8	75.8	0	0	110.4	C241	C241-M243 PolarHBondContact O-N 2.62Å; C241-M243 VanDerWaalsContact O-N 3.13Å
244	E	55	Low	55.5	Low	171 Å²	171	94 Å²	94	80%	0.799	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-71.9	125.3	162.5	-63.4	-169	153.6	0	0	108.8	T242	T242-E244 PolarHBondContact O-N 3.45Å
245	I	62.2	Low	58.1	Low	35 Å²	35	85.1 Å²	85.1	18%	0.179	48%	0.477	C	S	.	.	P	Polyproline II helix	trans	-86.2	122.5	-178	-53.7	172.4	0	0	0	108.8	A249 L250 N265 A281 L283	I245-A249 HydrophobicContact CG2-CB 3.92Å; I245-L250 HydrophobicContact CB-CD2 4.45Å; I245-L250 HydrophobicContact CG2-CD2 3.73Å; I245-L250 HydrophobicContact CG2-CG 3.89Å; I245-N265 HydrophobicContact CD1-CB 4.35Å; I245-N265 VanDerWaalsContact CD1-OD1 3.31Å; I245-N265 WeakPolarHBondContact CD1-OD1 3.39Å; I245-A281 HydrophobicContact CD1-CB 3.53Å; I245-L283 HydrophobicContact CB-CD2 4.28Å; I245-L283 HydrophobicContact CD1-CD1 4.21Å; I245-L283 HydrophobicContact CD1-CG 4.31Å
246	T	68.1	Low	60.6	Low	93 Å²	93	78.4 Å²	78.4	57%	0.571	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-67.7	147.8	177.4	58.1	0	0	0	0	111.7	A248 A249 L250	T246-A248 VanDerWaalsContact C-N 3.26Å; T246-A248 PolarHBondContact O-N 3.18Å; T246-A249 WeakPolarHBondContact O-CB 3.46Å; T246-A249 PolarHBondContact O-N 2.81Å; T246-L250 PolarHBondContact O-N 3.16Å
247	E	74.2	Confident	63.2	Low	79 Å²	79	71 Å²	71	37%	0.369	42%	0.418	S	S	.	.	H	α-helix	trans	-57.6	-39.9	-179	-173.4	167.9	167.9	0	0	111.9	A249 L250 V251 L364	E247-A249 VanDerWaalsContact C-N 3.31Å; E247-A249 PolarHBondContact O-N 3.41Å; E247-L250 WeakPolarHBondContact O-CB 3.41Å; E247-L250 PolarHBondContact O-N 2.8Å; E247-L250 VanDerWaalsContact O-N 3.13Å; E247-V251 WeakPolarHBondContact O-CG2 3.43Å; E247-V251 PolarHBondContact O-N 3.23Å; E247-L364 HydrophobicContact CG-CD1 3.76Å; E247-L364 HydrophobicContact CG-CG 3.78Å; E247-L364 WeakPolarHBondContact OE1-CB 3.4Å; E247-L364 WeakPolarHBondContact OE1-CG 3.43Å; E247-L364 PolarHBondContact OE1-N 2.84Å
248	A	74	Confident	65.9	Low	48 Å²	48	67.5 Å²	67.5	40%	0.397	38%	0.382	S	S	.	.	H	α-helix	trans	-57.5	-39.3	174.3	0	0	0	0	0	113.1	T246 V251 R252	T246-A248 VanDerWaalsContact C-N 3.26Å; T246-A248 PolarHBondContact O-N 3.18Å; A248-V251 PolarHBondContact O-N 3.12Å; A248-R252 VanDerWaalsContact O-CG 3.3Å; A248-R252 WeakPolarHBondContact O-CG 3.42Å; A248-R252 PolarHBondContact O-N 3.38Å
249	A	76.5	Confident	68.5	Low	27 Å²	27	62.5 Å²	62.5	22%	0.223	35%	0.353	C	S	.	.	H	α-helix	trans	-66.8	-37.1	177.3	0	0	0	0	0	112.2	I245 T246 E247 D253	I245-A249 HydrophobicContact CG2-CB 3.92Å; T246-A249 WeakPolarHBondContact O-CB 3.46Å; T246-A249 PolarHBondContact O-N 2.81Å; E247-A249 VanDerWaalsContact C-N 3.31Å; E247-A249 PolarHBondContact O-N 3.41Å; A249-D253 PolarHBondContact O-N 3.33Å; A249-D253 VanDerWaalsContact O-N 3.13Å
250	L	77.5	Confident	70.2	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.01	32%	0.32	C	S	.	.	H	α-helix	trans	-66.4	-39.7	172.7	-59.2	171.4	0	0	0	111.7	I245 T246 E247 D253 I254 L283 L364	I245-L250 HydrophobicContact CB-CD2 4.45Å; I245-L250 HydrophobicContact CG2-CD2 3.73Å; I245-L250 HydrophobicContact CG2-CG 3.89Å; T246-L250 PolarHBondContact O-N 3.16Å; E247-L250 WeakPolarHBondContact O-CB 3.41Å; E247-L250 PolarHBondContact O-N 2.8Å; E247-L250 VanDerWaalsContact O-N 3.13Å; L250-D253 PolarHBondContact O-N 2.92Å; L250-I254 WeakPolarHBondContact O-CB 3.28Å; L250-I254 WeakPolarHBondContact O-CD1 3.24Å; L250-I254 VanDerWaalsContact O-CG1 3.23Å; L250-I254 WeakPolarHBondContact O-CG1 3.18Å; L250-I254 PolarHBondContact O-N 3.3Å; L250-L283 HydrophobicContact CD1-CD2 3.58Å; L250-L283 HydrophobicContact CD2-CD1 3.96Å; L250-L283 HydrophobicContact CD2-CD2 3.98Å; L250-L283 HydrophobicContact CG-CD2 4.32Å; L250-L364 HydrophobicContact CB-CD1 4.49Å; L250-L364 HydrophobicContact CD1-CD1 4.22Å
251	V	80.5	Confident	72.6	Confident	4 Å²	4	57.9 Å²	57.9	2%	0.024	31%	0.313	C	S	.	.	H	α-helix	trans	-61.3	-45.8	176.4	167.2	0	0	0	0	110.9	E247 A248 D253 I254 L255 L346 L362 L364	E247-V251 WeakPolarHBondContact O-CG2 3.43Å; E247-V251 PolarHBondContact O-N 3.23Å; A248-V251 PolarHBondContact O-N 3.12Å; V251-D253 PolarHBondContact O-N 2.61Å; V251-I254 PolarHBondContact O-N 3.48Å; V251-L255 HydrophobicContact CG1-CD1 4.42Å; V251-L255 WeakPolarHBondContact O-CG 3.1Å; V251-L255 PolarHBondContact O-N 2.88Å; V251-L255 VanDerWaalsContact O-N 3.12Å; V251-L346 HydrophobicContact CG1-CD1 4.48Å; V251-L362 HydrophobicContact CG1-CD2 3.82Å; V251-L364 HydrophobicContact CG2-CD2 3.68Å; V251-L364 HydrophobicContact CG2-CG 4Å
252	R	81.2	Confident	74.7	Confident	86 Å²	86	55.8 Å²	55.8	33%	0.325	29%	0.292	S	S	.	.	H	α-helix	trans	-61.2	-44.8	175.5	-52.6	-147.8	-166.3	79.3	-4.4	111.6	A248 I254 L255 Y256 L346 D350	A248-R252 VanDerWaalsContact O-CG 3.3Å; A248-R252 WeakPolarHBondContact O-CG 3.42Å; A248-R252 PolarHBondContact O-N 3.38Å; R252-I254 PolarHBondContact O-N 2.87Å; R252-L255 PolarHBondContact O-N 2.82Å; R252-Y256 WeakPolarHBondContact O-CD2 3.31Å; R252-Y256 PolarHBondContact O-N 3.16Å; R252-L346 HydrophobicContact CB-CD2 4.4Å; R252-L346 HydrophobicContact CG-CD1 4.09Å; R252-L346 HydrophobicContact CG-CD2 3.75Å; R252-L346 HydrophobicContact CG-CG 4.5Å; R252-D350 IonicContact CZ-OD1 3.39Å; R252-D350 IonicContact CZ-OD2 3.85Å; R252-D350 IonicContact NE-OD1 3.84Å; R252-D350 IonicContact NE-OD2 3.91Å; R252-D350 PolarHBondContact NE-OD2 3.31Å; R252-D350 IonicContact NH2-OD1 2.62Å; R252-D350 PolarHBondContact NH2-OD1 2.92Å; R252-D350 IonicContact NH2-OD2 3.72Å; R252-D350 PolarHBondContact NH2-OD2 3.1Å
253	D	82.7	Confident	76.4	Confident	5 Å²	5	51.5 Å²	51.5	3%	0.027	27%	0.267	C	S	.	.	H	α-helix	trans	-62	-40.8	176.8	-87.4	-12.6	0	0	0	113.3	A249 L250 V251 L255 Y256 V257 K264 N265	A249-D253 PolarHBondContact O-N 3.33Å; A249-D253 VanDerWaalsContact O-N 3.13Å; L250-D253 PolarHBondContact O-N 2.92Å; V251-D253 PolarHBondContact O-N 2.61Å; D253-L255 VanDerWaalsContact C-N 3.31Å; D253-L255 PolarHBondContact O-N 3.07Å; D253-Y256 PolarHBondContact O-N 3.05Å; D253-V257 WeakPolarHBondContact O-CG2 3.49Å; D253-V257 PolarHBondContact O-N 2.93Å; D253-K264 VanDerWaalsContact CG-N 3.32Å; D253-K264 WeakPolarHBondContact OD1-CB 3.44Å; D253-K264 PolarHBondContact OD1-N 3.38Å; D253-K264 PolarHBondContact OD2-N 3.42Å; D253-N265 VanDerWaalsContact OD2-CB 3.29Å; D253-N265 WeakPolarHBondContact OD2-CB 3.39Å; D253-N265 PolarHBondContact OD2-N 2.9Å; D253-N265 PolarHBondContact OD2-ND2 3.16Å
254	I	84.1	Confident	77.7	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-67.1	-33.3	179.3	-72.4	166	0	0	0	111.3	L250 V251 R252 V257 F258 I266 A291 L294 L364 L367	L250-I254 WeakPolarHBondContact O-CB 3.28Å; L250-I254 WeakPolarHBondContact O-CD1 3.24Å; L250-I254 VanDerWaalsContact O-CG1 3.23Å; L250-I254 WeakPolarHBondContact O-CG1 3.18Å; L250-I254 PolarHBondContact O-N 3.3Å; V251-I254 PolarHBondContact O-N 3.48Å; R252-I254 PolarHBondContact O-N 2.87Å; I254-V257 PolarHBondContact O-N 3.22Å; I254-F258 HydrophobicContact CG2-CD1 4.03Å; I254-F258 HydrophobicContact CG2-CE1 3.44Å; I254-F258 VanDerWaalsContact CG2-CE1 3.44Å; I254-F258 HydrophobicContact CG2-CE2 4.11Å; I254-F258 HydrophobicContact CG2-CZ 3.49Å; I254-F258 VanDerWaalsContact CG2-CZ 3.49Å; I254-F258 WeakPolarHBondContact O-CD1 3.36Å; I254-F258 VanDerWaalsContact O-CG 3.28Å; I254-F258 WeakPolarHBondContact O-CG 3.44Å; I254-F258 PolarHBondContact O-N 3.09Å; I254-I266 HydrophobicContact CD1-CD1 4.26Å; I254-I266 HydrophobicContact CG1-CD1 3.6Å; I254-A291 HydrophobicContact CD1-CB 4.17Å; I254-L294 HydrophobicContact CD1-CD1 3.93Å; I254-L294 HydrophobicContact CG2-CB 4.02Å; I254-L294 HydrophobicContact CG2-CD1 4.39Å; I254-L364 HydrophobicContact CD1-CD2 3.56Å; I254-L367 HydrophobicContact CG2-CD2 3.95Å
255	L	84	Confident	78.5	Confident	8 Å²	8	46 Å²	46	4%	0.042	24%	0.238	C	C	.	.	H	α-helix	trans	-69.4	-31.5	174.3	-69.3	172.5	0	0	0	112.8	V251 R252 D253 F258 Q259 L342 L346	V251-L255 HydrophobicContact CG1-CD1 4.42Å; V251-L255 WeakPolarHBondContact O-CG 3.1Å; V251-L255 PolarHBondContact O-N 2.88Å; V251-L255 VanDerWaalsContact O-N 3.12Å; R252-L255 PolarHBondContact O-N 2.82Å; D253-L255 VanDerWaalsContact C-N 3.31Å; D253-L255 PolarHBondContact O-N 3.07Å; L255-F258 HydrophobicContact CD2-CD2 3.95Å; L255-F258 HydrophobicContact CD2-CE2 4.37Å; L255-F258 PolarHBondContact O-N 3.17Å; L255-Q259 WeakPolarHBondContact O-CG 3.48Å; L255-Q259 PolarHBondContact O-N 2.98Å; L255-L342 HydrophobicContact CD2-CB 3.96Å; L255-L342 HydrophobicContact CD2-CD1 4.19Å; L255-L346 HydrophobicContact CD1-CB 4.46Å; L255-L346 HydrophobicContact CD1-CD2 3.78Å
256	Y	84.8	Confident	79.2	Confident	101 Å²	101	44.4 Å²	44.4	40%	0.396	23%	0.23	S	C	.	.	H	α-helix	trans	-67.7	-43.6	168.6	-65.5	-56.8	0	0	0	111.5	R252 D253 F258 Q259 G260 I261	R252-Y256 WeakPolarHBondContact O-CD2 3.31Å; R252-Y256 PolarHBondContact O-N 3.16Å; D253-Y256 PolarHBondContact O-N 3.05Å; Y256-F258 PolarHBondContact O-N 3.34Å; Y256-Q259 CarbonylContact O-C 3.54Å; Y256-Q259 WeakPolarHBondContact O-CA 3.43Å; Y256-Q259 WeakPolarHBondContact O-CB 3.4Å; Y256-Q259 PolarHBondContact O-N 3.13Å; Y256-G260 PolarHBondContact O-N 2.88Å; Y256-I261 CarbonylContact C-O 3.53Å; Y256-I261 PolarHBondContact O-N 3.11Å; Y256-I261 VanDerWaalsContact O-O 3.13Å
257	V	85.1	Confident	79.7	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-58.9	-35.7	174.9	166.8	0	0	0	0	111.9	D253 I254 G260 I261 I266 Y275 G298	D253-V257 WeakPolarHBondContact O-CG2 3.49Å; D253-V257 PolarHBondContact O-N 2.93Å; I254-V257 PolarHBondContact O-N 3.22Å; V257-G260 PolarHBondContact O-N 3.34Å; V257-I261 WeakPolarHBondContact CA-O 3.5Å; V257-I261 PolarHBondContact N-O 2.96Å; V257-I266 HydrophobicContact CG2-CB 4.04Å; V257-I266 HydrophobicContact CG2-CG2 3.93Å; V257-Y275 HydrophobicContact CB-CE1 4.37Å; V257-Y275 HydrophobicContact CG1-CD1 3.91Å; V257-Y275 HydrophobicContact CG1-CD2 3.87Å; V257-Y275 HydrophobicContact CG1-CE1 3.9Å; V257-Y275 HydrophobicContact CG1-CE2 3.83Å; V257-Y275 HydrophobicContact CG1-CG 3.9Å; V257-Y275 HydrophobicContact CG2-CD1 4.01Å; V257-Y275 HydrophobicContact CG2-CE1 3.97Å; V257-G298 WeakPolarHBondContact O-CA 3.19Å
258	F	86.5	Confident	79.8	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-66.2	-33.4	173.6	-74.1	4.2	0	0	0	113.4	I254 L255 Y256 G260 L294 L297 Y335 L339 L367 T371	I254-F258 HydrophobicContact CG2-CD1 4.03Å; I254-F258 HydrophobicContact CG2-CE1 3.44Å; I254-F258 VanDerWaalsContact CG2-CE1 3.44Å; I254-F258 HydrophobicContact CG2-CE2 4.11Å; I254-F258 HydrophobicContact CG2-CZ 3.49Å; I254-F258 VanDerWaalsContact CG2-CZ 3.49Å; I254-F258 WeakPolarHBondContact O-CD1 3.36Å; I254-F258 VanDerWaalsContact O-CG 3.28Å; I254-F258 WeakPolarHBondContact O-CG 3.44Å; I254-F258 PolarHBondContact O-N 3.09Å; L255-F258 HydrophobicContact CD2-CD2 3.95Å; L255-F258 HydrophobicContact CD2-CE2 4.37Å; L255-F258 PolarHBondContact O-N 3.17Å; Y256-F258 PolarHBondContact O-N 3.34Å; F258-G260 PolarHBondContact O-N 3.17Å; F258-L294 HydrophobicContact CE1-CB 4.15Å; F258-L294 WeakPolarHBondContact CE1-O 3.29Å; F258-L294 HydrophobicContact CZ-CB 4.21Å; F258-L294 HydrophobicContact CZ-CD2 4.16Å; F258-L297 HydrophobicContact CD1-CB 4.26Å; F258-L297 HydrophobicContact CD1-CD2 4.01Å; F258-L297 HydrophobicContact CD2-CD2 4.17Å; F258-L297 HydrophobicContact CE1-CB 4.02Å; F258-L297 HydrophobicContact CE1-CD2 3.76Å; F258-L297 HydrophobicContact CE1-CG 4.46Å; F258-L297 HydrophobicContact CE2-CD2 3.94Å; F258-L297 HydrophobicContact CG-CD2 4.21Å; F258-L297 HydrophobicContact CZ-CD2 3.73Å; F258-Y335 WeakPolarHBondContact CB-OH 3.41Å; F258-Y335 WeakPolarHBondContact O-CE1 3.28Å; F258-Y335 PolarHBondContact O-OH 3.46Å; F258-L339 HydrophobicContact CB-CD1 4.12Å; F258-L339 HydrophobicContact CB-CD2 3.78Å; F258-L339 HydrophobicContact CD2-CD2 3.69Å; F258-L339 HydrophobicContact CG-CD2 4.2Å; F258-L367 HydrophobicContact CE2-CD1 4.12Å; F258-L367 HydrophobicContact CE2-CD2 4.37Å; F258-L367 HydrophobicContact CE2-CG 4.36Å; F258-L367 HydrophobicContact CZ-CD2 4.43Å; F258-T371 HydrophobicContact CE2-CG2 3.57Å; F258-T371 HydrophobicContact CZ-CG2 3.76Å
259	Q	83.4	Confident	79.8	Confident	63 Å²	63	41.4 Å²	41.4	29%	0.294	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-0.4	171.5	-64.2	173.3	8.1	0	0	112.9	L255 Y256 I261 L339	L255-Q259 WeakPolarHBondContact O-CG 3.48Å; L255-Q259 PolarHBondContact O-N 2.98Å; Y256-Q259 CarbonylContact O-C 3.54Å; Y256-Q259 WeakPolarHBondContact O-CA 3.43Å; Y256-Q259 WeakPolarHBondContact O-CB 3.4Å; Y256-Q259 PolarHBondContact O-N 3.13Å; Q259-I261 HydrophobicContact CB-CD1 4.16Å; Q259-I261 HydrophobicContact CB-CG1 4.28Å; Q259-L339 HydrophobicContact CG-CD1 4.02Å
260	G	78.4	Confident	79.4	Confident	17 Å²	17	45.7 Å²	45.7	18%	0.175	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.1	8.9	-177.5	0	0	0	0	0	114.9	Y256 V257 F258 Y275 N302	Y256-G260 PolarHBondContact O-N 2.88Å; V257-G260 PolarHBondContact O-N 3.34Å; F258-G260 PolarHBondContact O-N 3.17Å; G260-Y275 PolarHBondContact O-OH 3.28Å; G260-N302 WeakPolarHBondContact CA-ND2 3.32Å; G260-N302 WeakPolarHBondContact CA-OD1 3.44Å; G260-N302 PolarHBondContact O-ND2 3.34Å
261	I	83.2	Confident	79	Confident	87 Å²	87	51.4 Å²	51.4	45%	0.446	26%	0.256	S	S	.	.			trans	-100.9	139.8	-174.4	-56	173	0	0	0	109.5	Y256 V257 Q259 G263	Y256-I261 CarbonylContact C-O 3.53Å; Y256-I261 PolarHBondContact O-N 3.11Å; Y256-I261 VanDerWaalsContact O-O 3.13Å; V257-I261 WeakPolarHBondContact CA-O 3.5Å; V257-I261 PolarHBondContact N-O 2.96Å; Q259-I261 HydrophobicContact CB-CD1 4.16Å; Q259-I261 HydrophobicContact CB-CG1 4.28Å; I261-G263 PolarHBondContact O-N 3.32Å
262	D	80.6	Confident	78.2	Confident	91 Å²	91	56.4 Å²	56.4	49%	0.487	28%	0.279	S	S	.	.			trans	-65.6	126.4	174.9	-75.5	-40.9	0	0	0	111.9	K267 M268	D262-K267 HydrophobicContact CB-CB 4.48Å; D262-K267 HydrophobicContact CB-CG 4.23Å; D262-K267 VanDerWaalsContact OD1-CA 3.29Å; D262-K267 WeakPolarHBondContact OD1-CA 3.48Å; D262-M268 PolarHBondContact OD1-N 3Å
263	G	75.6	Confident	77.6	Confident	7 Å²	7	56.1 Å²	56.1	7%	0.072	28%	0.284	C	S	.	.			trans	-81.6	176.3	174.5	0	0	0	0	0	112.8	I261 I266	I261-G263 PolarHBondContact O-N 3.32Å; G263-I266 WeakPolarHBondContact CA-O 3.5Å; G263-I266 PolarHBondContact N-O 3.4Å
264	K	74.1	Confident	77.1	Confident	170 Å²	170	58 Å²	58	74%	0.739	30%	0.297	S	S	*	.	S	Bend	trans	-68	-43	179.9	-63.8	179	-178.6	177.7	0	111.6	D253	D253-K264 VanDerWaalsContact CG-N 3.32Å; D253-K264 WeakPolarHBondContact OD1-CB 3.44Å; D253-K264 PolarHBondContact OD1-N 3.38Å; D253-K264 PolarHBondContact OD2-N 3.42Å
265	N	71.5	Confident	76.8	Confident	43 Å²	43	58.5 Å²	58.5	23%	0.23	30%	0.299	C	S	.	.	S	Bend	trans	-105.5	-13.2	-177	-57.4	-76.8	0	0	0	114.2	I245 D253 V277 E278	I245-N265 HydrophobicContact CD1-CB 4.35Å; I245-N265 VanDerWaalsContact CD1-OD1 3.31Å; I245-N265 WeakPolarHBondContact CD1-OD1 3.39Å; D253-N265 VanDerWaalsContact OD2-CB 3.29Å; D253-N265 WeakPolarHBondContact OD2-CB 3.39Å; D253-N265 PolarHBondContact OD2-N 2.9Å; D253-N265 PolarHBondContact OD2-ND2 3.16Å; N265-V277 WeakPolarHBondContact O-CA 3.41Å; N265-E278 PolarHBondContact O-N 2.97Å
266	I	77.2	Confident	76.3	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.005	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	119.7	-176.4	-49.3	-178.2	0	0	0	109.1	I254 V257 G263 Y275 K276 V277 A291	I254-I266 HydrophobicContact CD1-CD1 4.26Å; I254-I266 HydrophobicContact CG1-CD1 3.6Å; V257-I266 HydrophobicContact CG2-CB 4.04Å; V257-I266 HydrophobicContact CG2-CG2 3.93Å; G263-I266 WeakPolarHBondContact CA-O 3.5Å; G263-I266 PolarHBondContact N-O 3.4Å; I266-Y275 HydrophobicContact CG2-CD1 4.29Å; I266-K276 WeakPolarHBondContact CA-O 3.42Å; I266-V277 HydrophobicContact CG1-CG2 4.28Å; I266-A291 HydrophobicContact CD1-CB 4.18Å
267	K	78.3	Confident	75.7	Confident	84 Å²	84	58.3 Å²	58.3	37%	0.365	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	150.9	-175.5	-58.6	-178.8	-175.3	160.5	0	111.8	D262 N269 Y275 K276 E278	D262-K267 HydrophobicContact CB-CB 4.48Å; D262-K267 HydrophobicContact CB-CG 4.23Å; D262-K267 VanDerWaalsContact OD1-CA 3.29Å; D262-K267 WeakPolarHBondContact OD1-CA 3.48Å; K267-N269 PolarHBondContact O-N 2.96Å; K267-Y275 CarbonylContact O-C 3.6Å; K267-Y275 WeakPolarHBondContact O-CA 3.29Å; K267-K276 PolarHBondContact N-O 3.32Å; K267-K276 PolarHBondContact O-N 3.35Å; K267-E278 WeakPolarHBondContact CD-OE1 3.23Å; K267-E278 WeakPolarHBondContact CE-OE1 3.45Å; K267-E278 IonicContact NZ-OE1 2.99Å; K267-E278 PolarHBondContact NZ-OE1 2.75Å
268	M	76.1	Confident	74.8	Confident	31 Å²	31	61.9 Å²	61.9	15%	0.153	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	113.3	176.6	-178.3	65.5	82.2	0	0	110.1	D262 N270 Y275	D262-M268 PolarHBondContact OD1-N 3Å; M268-N270 PolarHBondContact O-N 3.28Å; M268-Y275 HydrophobicContact CB-CD1 4.09Å; M268-Y275 HydrophobicContact CB-CE1 3.85Å; M268-Y275 HydrophobicContact CE-CD2 3.78Å; M268-Y275 HydrophobicContact CE-CE1 4.24Å; M268-Y275 HydrophobicContact CE-CE2 3.3Å; M268-Y275 HydrophobicContact CE-CG 4.44Å; M268-Y275 HydrophobicContact SD-CD2 4.3Å; M268-Y275 HydrophobicContact SD-CE2 4.34Å
269	N	74.8	Confident	73.4	Confident	43 Å²	43	65.5 Å²	65.5	23%	0.23	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	105.5	166.4	-177.7	17.3	0	0	0	109.7	K267 T271 E272 N273 C274 K276	K267-N269 PolarHBondContact O-N 2.96Å; N269-T271 PolarHBondContact ND2-OG1 3.39Å; N269-T271 PolarHBondContact O-N 3.1Å; N269-T271 PolarHBondContact OD1-N 3.17Å; N269-T271 PolarHBondContact OD1-OG1 3.19Å; N269-E272 PolarHBondContact ND2-OE1 3.1Å; N269-E272 PolarHBondContact O-N 3.09Å; N269-N273 WeakPolarHBondContact O-CA 3.35Å; N269-N273 PolarHBondContact O-N 2.9Å; N269-C274 WeakPolarHBondContact CB-O 3.47Å; N269-C274 PolarHBondContact N-O 3.13Å; N269-C274 PolarHBondContact O-N 2.95Å; N269-K276 HydrophobicContact CB-CD 4.41Å; N269-K276 HydrophobicContact CB-CG 4.43Å
270	N	67.9	Low	72.1	Confident	116 Å²	116	71.5 Å²	71.5	62%	0.62	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-16.3	-178.3	-158.1	55.4	0	0	0	113.9	M268	M268-N270 PolarHBondContact O-N 3.28Å
271	T	68	Low	71.1	Confident	122 Å²	122	71 Å²	71	75%	0.748	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-29.9	176.4	63.6	0	0	0	0	113.5	N269	N269-T271 PolarHBondContact ND2-OG1 3.39Å; N269-T271 PolarHBondContact O-N 3.1Å; N269-T271 PolarHBondContact OD1-N 3.17Å; N269-T271 PolarHBondContact OD1-OG1 3.19Å
272	E	64.4	Low	69.9	Low	110 Å²	110	72.2 Å²	72.2	51%	0.514	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	2.7	179.2	-71.4	171.6	-101.5	0	0	112.8	N269 C274 K276	N269-E272 PolarHBondContact ND2-OE1 3.1Å; N269-E272 PolarHBondContact O-N 3.09Å; E272-C274 PolarHBondContact O-N 3.37Å; E272-C274 VanDerWaalsContact O-N 3.16Å; E272-K276 WeakPolarHBondContact OE1-CE 3.37Å; E272-K276 IonicContact OE1-NZ 3.18Å; E272-K276 PolarHBondContact OE1-NZ 3.01Å; E272-K276 VanDerWaalsContact OE2-CE 3.27Å; E272-K276 WeakPolarHBondContact OE2-CE 3.49Å; E272-K276 IonicContact OE2-NZ 2.72Å; E272-K276 PolarHBondContact OE2-NZ 3.29Å
273	N	68.9	Low	69.3	Low	80 Å²	80	68.7 Å²	68.7	43%	0.428	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.9	41.2	-174.7	-88.7	-61.6	0	0	0	113	N269 W299	N269-N273 WeakPolarHBondContact O-CA 3.35Å; N269-N273 PolarHBondContact O-N 2.9Å; N273-W299 PolarHBondContact O-NE1 3.01Å
274	C	72.9	Confident	69.3	Low	44 Å²	44	71 Å²	71	30%	0.297	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	147.5	177.6	62.1	0	0	0	0	112.2	N269 E272 K276	N269-C274 WeakPolarHBondContact CB-O 3.47Å; N269-C274 PolarHBondContact N-O 3.13Å; N269-C274 PolarHBondContact O-N 2.95Å; E272-C274 PolarHBondContact O-N 3.37Å; E272-C274 VanDerWaalsContact O-N 3.16Å; C274-K276 PolarHBondContact O-N 3.09Å
275	Y	77.4	Confident	69.4	Low	10 Å²	10	72.7 Å²	72.7	4%	0.039	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	127.4	171.5	-76.8	-79.2	0	0	0	110.6	V257 G260 I266 K267 M268 S295 W299 N302	V257-Y275 HydrophobicContact CB-CE1 4.37Å; V257-Y275 HydrophobicContact CG1-CD1 3.91Å; V257-Y275 HydrophobicContact CG1-CD2 3.87Å; V257-Y275 HydrophobicContact CG1-CE1 3.9Å; V257-Y275 HydrophobicContact CG1-CE2 3.83Å; V257-Y275 HydrophobicContact CG1-CG 3.9Å; V257-Y275 HydrophobicContact CG2-CD1 4.01Å; V257-Y275 HydrophobicContact CG2-CE1 3.97Å; G260-Y275 PolarHBondContact O-OH 3.28Å; I266-Y275 HydrophobicContact CG2-CD1 4.29Å; K267-Y275 CarbonylContact O-C 3.6Å; K267-Y275 WeakPolarHBondContact O-CA 3.29Å; M268-Y275 HydrophobicContact CB-CD1 4.09Å; M268-Y275 HydrophobicContact CB-CE1 3.85Å; M268-Y275 HydrophobicContact CE-CD2 3.78Å; M268-Y275 HydrophobicContact CE-CE1 4.24Å; M268-Y275 HydrophobicContact CE-CE2 3.3Å; M268-Y275 HydrophobicContact CE-CG 4.44Å; M268-Y275 HydrophobicContact SD-CD2 4.3Å; M268-Y275 HydrophobicContact SD-CE2 4.34Å; Y275-S295 WeakPolarHBondContact CD2-O 3.49Å; Y275-W299 HydrophobicContact CD2-CB 4.32Å; Y275-W299 HydrophobicContact CE2-CB 4.43Å; Y275-N302 PolarHBondContact OH-ND2 3.07Å
276	K	73.3	Confident	69.7	Low	90 Å²	90	73.8 Å²	73.8	39%	0.391	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	141.2	174.4	-71.2	-167.2	171.5	-175	0	111	I266 K267 N269 E272 C274	I266-K276 WeakPolarHBondContact CA-O 3.42Å; K267-K276 PolarHBondContact N-O 3.32Å; K267-K276 PolarHBondContact O-N 3.35Å; N269-K276 HydrophobicContact CB-CD 4.41Å; N269-K276 HydrophobicContact CB-CG 4.43Å; E272-K276 WeakPolarHBondContact OE1-CE 3.37Å; E272-K276 IonicContact OE1-NZ 3.18Å; E272-K276 PolarHBondContact OE1-NZ 3.01Å; E272-K276 VanDerWaalsContact OE2-CE 3.27Å; E272-K276 WeakPolarHBondContact OE2-CE 3.49Å; E272-K276 IonicContact OE2-NZ 2.72Å; E272-K276 PolarHBondContact OE2-NZ 3.29Å; C274-K276 PolarHBondContact O-N 3.09Å
277	V	72.1	Confident	69.6	Low	16 Å²	16	76 Å²	76	10%	0.097	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	126.9	167.4	-176.2	0	0	0	0	107.7	N265 I266 G279 A281 L283 R288 A291 V292	N265-V277 WeakPolarHBondContact O-CA 3.41Å; I266-V277 HydrophobicContact CG1-CG2 4.28Å; V277-G279 PolarHBondContact O-N 3.5Å; V277-A281 HydrophobicContact CG1-CB 4.36Å; V277-L283 HydrophobicContact CG1-CD1 3.51Å; V277-R288 HydrophobicContact CG2-CG 4.43Å; V277-A291 HydrophobicContact CG2-CB 4.26Å; V277-V292 HydrophobicContact CG2-CG2 4.48Å
278	E	65.2	Low	69.6	Low	75 Å²	75	75.8 Å²	75.8	35%	0.35	40%	0.4	S	S	.	.			trans	-60.9	139.1	-178.8	-85	-161.7	-157.5	0	0	112.2	N265 K267 K280 A281	N265-E278 PolarHBondContact O-N 2.97Å; K267-E278 WeakPolarHBondContact CD-OE1 3.23Å; K267-E278 WeakPolarHBondContact CE-OE1 3.45Å; K267-E278 IonicContact NZ-OE1 2.99Å; K267-E278 PolarHBondContact NZ-OE1 2.75Å; E278-K280 PolarHBondContact O-N 3.3Å; E278-A281 PolarHBondContact O-N 3.21Å
279	G	57.8	Low	69.8	Low	75 Å²	75	77.5 Å²	77.5	77%	0.773	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-8.2	-174.1	0	0	0	0	0	115.6	V277 A281	V277-G279 PolarHBondContact O-N 3.5Å; G279-A281 VanDerWaalsContact C-N 3.34Å
280	K	56	Low	70.1	Confident	189 Å²	189	75.6 Å²	75.6	82%	0.822	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.3	-8.8	178.6	-62.9	176	-179.3	173.2	0	113.5	E278	E278-K280 PolarHBondContact O-N 3.3Å
281	A	58.3	Low	70.7	Confident	8 Å²	8	70.1 Å²	70.1	7%	0.066	37%	0.37	C	S	.	.			trans	-88.2	118.4	-179.3	0	0	0	0	0	112.3	I245 V277 E278 G279 L283 R288	I245-A281 HydrophobicContact CD1-CB 3.53Å; V277-A281 HydrophobicContact CG1-CB 4.36Å; E278-A281 PolarHBondContact O-N 3.21Å; G279-A281 VanDerWaalsContact C-N 3.34Å; A281-L283 HydrophobicContact CB-CD1 3.71Å; A281-L283 HydrophobicContact CB-CG 4.02Å; A281-L283 PolarHBondContact O-N 3.27Å; A281-R288 PolarHBondContact O-NH2 3.29Å
282	N	58.7	Low	71.4	Confident	111 Å²	111	67.9 Å²	67.9	59%	0.594	36%	0.356	S	S	*	.			trans	-74.5	61.5	171.6	-84.8	-3.6	0	0	0	111.6	T242	T242-N282 WeakPolarHBondContact CG2-ND2 3.28Å
283	L	67.8	Low	72.2	Confident	17 Å²	17	69 Å²	69	9%	0.089	36%	0.356	C	S	.	.			trans	-92.3	131.6	177.5	-73.2	163.4	0	0	0	111.2	I245 L250 V277 A281 L287 R288	I245-L283 HydrophobicContact CB-CD2 4.28Å; I245-L283 HydrophobicContact CD1-CD1 4.21Å; I245-L283 HydrophobicContact CD1-CG 4.31Å; L250-L283 HydrophobicContact CD1-CD2 3.58Å; L250-L283 HydrophobicContact CD2-CD1 3.96Å; L250-L283 HydrophobicContact CD2-CD2 3.98Å; L250-L283 HydrophobicContact CG-CD2 4.32Å; V277-L283 HydrophobicContact CG1-CD1 3.51Å; A281-L283 HydrophobicContact CB-CD1 3.71Å; A281-L283 HydrophobicContact CB-CG 4.02Å; A281-L283 PolarHBondContact O-N 3.27Å; L283-L287 HydrophobicContact CD2-CD1 4.47Å; L283-R288 PolarHBondContact O-NH2 2.91Å
284	S	74.1	Confident	72.9	Confident	56 Å²	56	65.3 Å²	65.3	39%	0.392	34%	0.336	S	S	.	.			trans	-57	148.5	174.1	74.5	0	0	0	0	111	S286 L287 R288	S284-S286 VanDerWaalsContact C-N 3.25Å; S284-S286 PolarHBondContact O-N 3.45Å; S284-S286 PolarHBondContact OG-OG 3.1Å; S284-L287 PolarHBondContact O-N 3.25Å; S284-L287 VanDerWaalsContact O-N 3.11Å; S284-L287 WeakPolarHBondContact OG-CD1 3.38Å; S284-L287 VanDerWaalsContact OG-CG 3.31Å; S284-L287 WeakPolarHBondContact OG-CG 3.42Å; S284-L287 PolarHBondContact OG-N 2.84Å; S284-R288 PolarHBondContact O-N 3.4Å
285	R	77	Confident	73.4	Confident	206 Å²	206	63.4 Å²	63.4	78%	0.777	32%	0.323	S	S	*	.	H	α-helix	trans	-56.7	-40.6	-175.2	-171.7	173.7	-179	167.2	1.7	112.1	R288 D289	R285-R288 PolarHBondContact O-N 2.94Å; R285-D289 WeakPolarHBondContact O-CB 3.28Å; R285-D289 PolarHBondContact O-N 3.44Å
286	S	76.8	Confident	73.7	Confident	65 Å²	65	65.8 Å²	65.8	46%	0.455	33%	0.334	S	S	.	.	H	α-helix	trans	-64.3	-41.9	177.1	48.4	0	0	0	0	113.4	S284 D289 T290	S284-S286 VanDerWaalsContact C-N 3.25Å; S284-S286 PolarHBondContact O-N 3.45Å; S284-S286 PolarHBondContact OG-OG 3.1Å; S286-D289 PolarHBondContact O-N 2.92Å; S286-T290 PolarHBondContact O-N 3.02Å; S286-T290 VanDerWaalsContact O-N 3.07Å; S286-T290 PolarHBondContact O-OG1 2.87Å; S286-T290 VanDerWaalsContact O-OG1 3.1Å
287	L	75.8	Confident	74.3	Confident	49 Å²	49	61.6 Å²	61.6	26%	0.257	32%	0.316	S	S	.	.	H	α-helix	trans	-66.3	-42.6	175.8	-72.3	173.2	0	0	0	111.5	L283 S284 T290 A291 L364	L283-L287 HydrophobicContact CD2-CD1 4.47Å; S284-L287 PolarHBondContact O-N 3.25Å; S284-L287 VanDerWaalsContact O-N 3.11Å; S284-L287 WeakPolarHBondContact OG-CD1 3.38Å; S284-L287 VanDerWaalsContact OG-CG 3.31Å; S284-L287 WeakPolarHBondContact OG-CG 3.42Å; S284-L287 PolarHBondContact OG-N 2.84Å; L287-T290 WeakPolarHBondContact CA-OG1 3.49Å; L287-T290 PolarHBondContact O-N 3.22Å; L287-T290 PolarHBondContact O-OG1 2.87Å; L287-A291 WeakPolarHBondContact O-CB 2.95Å; L287-A291 PolarHBondContact O-N 3.12Å; L287-L364 HydrophobicContact CD2-CD1 3.69Å
288	R	78.5	Confident	74.9	Confident	79 Å²	79	60.9 Å²	60.9	30%	0.298	31%	0.312	S	S	.	.	H	α-helix	trans	-60.2	-46.5	175	-165.8	-179.3	-59.5	-108.8	-3.5	111.3	V277 A281 L283 S284 R285 T290 A291 V292	V277-R288 HydrophobicContact CG2-CG 4.43Å; A281-R288 PolarHBondContact O-NH2 3.29Å; L283-R288 PolarHBondContact O-NH2 2.91Å; S284-R288 PolarHBondContact O-N 3.4Å; R285-R288 PolarHBondContact O-N 2.94Å; R288-T290 VanDerWaalsContact C-N 3.29Å; R288-T290 PolarHBondContact O-N 3.36Å; R288-A291 PolarHBondContact O-N 2.97Å; R288-V292 WeakPolarHBondContact O-CG2 3.32Å; R288-V292 PolarHBondContact O-N 3.35Å
289	D	80.5	Confident	75.9	Confident	67 Å²	67	61 Å²	61	36%	0.358	31%	0.309	S	S	.	.	H	α-helix	trans	-67.1	-25.1	178.6	-67.7	-10.8	0	0	0	113.2	R285 S286 R293	R285-D289 WeakPolarHBondContact O-CB 3.28Å; R285-D289 PolarHBondContact O-N 3.44Å; S286-D289 PolarHBondContact O-N 2.92Å; D289-R293 WeakPolarHBondContact O-CB 3.42Å; D289-R293 WeakPolarHBondContact O-CG 3.27Å; D289-R293 PolarHBondContact O-NE 3.38Å
290	T	80.4	Confident	77.4	Confident	3 Å²	3	57.7 Å²	57.7	2%	0.018	27%	0.274	C	S	.	.	H	α-helix	trans	-80.1	-42.8	169.6	43.1	0	0	0	0	112.4	S286 L287 R288 V292 R293 L294 L368	S286-T290 PolarHBondContact O-N 3.02Å; S286-T290 VanDerWaalsContact O-N 3.07Å; S286-T290 PolarHBondContact O-OG1 2.87Å; S286-T290 VanDerWaalsContact O-OG1 3.1Å; L287-T290 WeakPolarHBondContact CA-OG1 3.49Å; L287-T290 PolarHBondContact O-N 3.22Å; L287-T290 PolarHBondContact O-OG1 2.87Å; R288-T290 VanDerWaalsContact C-N 3.29Å; R288-T290 PolarHBondContact O-N 3.36Å; T290-V292 PolarHBondContact O-N 3.25Å; T290-R293 PolarHBondContact O-N 2.93Å; T290-L294 WeakPolarHBondContact O-CG 3.39Å; T290-L294 PolarHBondContact O-N 2.94Å; T290-L368 HydrophobicContact CG2-CD2 4.43Å
291	A	80.6	Confident	79	Confident	1 Å²	1	48.7 Å²	48.7	1%	0.008	23%	0.234	C	C	.	.	H	α-helix	trans	-60.9	-43.1	179.1	0	0	0	0	0	111.8	I254 I266 V277 L287 R288 L294 S295	I254-A291 HydrophobicContact CD1-CB 4.17Å; I266-A291 HydrophobicContact CD1-CB 4.18Å; V277-A291 HydrophobicContact CG2-CB 4.26Å; L287-A291 WeakPolarHBondContact O-CB 2.95Å; L287-A291 PolarHBondContact O-N 3.12Å; R288-A291 PolarHBondContact O-N 2.97Å; A291-L294 PolarHBondContact O-N 3.3Å; A291-S295 WeakPolarHBondContact O-CB 3.33Å; A291-S295 PolarHBondContact O-N 3Å; A291-S295 PolarHBondContact O-OG 2.89Å
292	V	82.3	Confident	80.4	Confident	75 Å²	75	49.3 Å²	49.3	46%	0.455	24%	0.237	S	C	.	.	H	α-helix	trans	-63.4	-43.2	174.6	173.2	0	0	0	0	111.5	V277 R288 T290 L294 S295 E296	V277-V292 HydrophobicContact CG2-CG2 4.48Å; R288-V292 WeakPolarHBondContact O-CG2 3.32Å; R288-V292 PolarHBondContact O-N 3.35Å; T290-V292 PolarHBondContact O-N 3.25Å; V292-L294 VanDerWaalsContact C-N 3.3Å; V292-L294 PolarHBondContact O-N 3.09Å; V292-S295 PolarHBondContact O-N 2.94Å; V292-E296 PolarHBondContact O-N 3.1Å
293	R	82	Confident	81.8	Confident	134 Å²	134	46.3 Å²	46.3	51%	0.506	22%	0.218	S	C	.	.	H	α-helix	trans	-64.8	-30.4	177.8	-87.7	-176.5	-92.9	-154.3	-10.6	113.9	D289 T290 K375	D289-R293 WeakPolarHBondContact O-CB 3.42Å; D289-R293 WeakPolarHBondContact O-CG 3.27Å; D289-R293 PolarHBondContact O-NE 3.38Å; T290-R293 PolarHBondContact O-N 2.93Å; R293-K375 PolarHBondContact O-NZ 3.37Å
294	L	84	Confident	82.8	Confident	2 Å²	2	45.5 Å²	45.5	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-75.6	-43.3	172.1	-68.5	163.5	0	0	0	110.3	I254 F258 T290 A291 V292 E296 L297 L364 L367 L368 T371	I254-L294 HydrophobicContact CD1-CD1 3.93Å; I254-L294 HydrophobicContact CG2-CB 4.02Å; I254-L294 HydrophobicContact CG2-CD1 4.39Å; F258-L294 HydrophobicContact CE1-CB 4.15Å; F258-L294 WeakPolarHBondContact CE1-O 3.29Å; F258-L294 HydrophobicContact CZ-CB 4.21Å; F258-L294 HydrophobicContact CZ-CD2 4.16Å; T290-L294 WeakPolarHBondContact O-CG 3.39Å; T290-L294 PolarHBondContact O-N 2.94Å; A291-L294 PolarHBondContact O-N 3.3Å; V292-L294 VanDerWaalsContact C-N 3.3Å; V292-L294 PolarHBondContact O-N 3.09Å; L294-E296 PolarHBondContact O-N 3.28Å; L294-E296 VanDerWaalsContact O-N 3.15Å; L294-L297 WeakPolarHBondContact O-CB 3.25Å; L294-L297 PolarHBondContact O-N 3.03Å; L294-L364 HydrophobicContact CD1-CD2 4.03Å; L294-L367 HydrophobicContact CD1-CD2 4.27Å; L294-L367 HydrophobicContact CD2-CG 4.28Å; L294-L368 HydrophobicContact CD2-CB 4.23Å; L294-L368 HydrophobicContact CD2-CD1 3.95Å; L294-L368 HydrophobicContact CG-CD1 4.34Å; L294-T371 WeakPolarHBondContact CD2-OG1 3.49Å
295	S	82.8	Confident	83.5	Confident	3 Å²	3	47.5 Å²	47.5	2%	0.021	21%	0.213	C	C	.	.	H	α-helix	trans	-65.3	-18.7	-176.4	-51.8	0	0	0	0	114.6	Y275 A291 V292 L297 G298 W299	Y275-S295 WeakPolarHBondContact CD2-O 3.49Å; A291-S295 WeakPolarHBondContact O-CB 3.33Å; A291-S295 PolarHBondContact O-N 3Å; A291-S295 PolarHBondContact O-OG 2.89Å; V292-S295 PolarHBondContact O-N 2.94Å; S295-L297 PolarHBondContact O-N 3.49Å; S295-G298 PolarHBondContact O-N 2.97Å; S295-W299 PolarHBondContact O-N 3.2Å
296	E	84.4	Confident	84	Confident	61 Å²	61	43.2 Å²	43.2	29%	0.285	20%	0.197	S	C	.	.	H	α-helix	trans	-52	-36.1	165.8	-173.4	-177	158.3	0	0	111.6	V292 L294 W299 L300 K375 K379	V292-E296 PolarHBondContact O-N 3.1Å; L294-E296 PolarHBondContact O-N 3.28Å; L294-E296 VanDerWaalsContact O-N 3.15Å; E296-W299 PolarHBondContact O-N 2.62Å; E296-L300 HydrophobicContact CG-CD1 4.31Å; E296-L300 WeakPolarHBondContact O-CG 3.41Å; E296-L300 PolarHBondContact O-N 3.16Å; E296-K375 WeakPolarHBondContact OE1-CE 3.32Å; E296-K375 IonicContact OE1-NZ 2.88Å; E296-K375 WeakPolarHBondContact OE2-CE 3.3Å; E296-K375 IonicContact OE2-NZ 3.68Å; E296-K375 PolarHBondContact OE2-NZ 2.7Å; E296-K379 IonicContact OE1-NZ 3.94Å; E296-K379 PolarHBondContact OE1-NZ 2.89Å
297	L	85.1	Confident	84.4	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-64.9	-43.4	179.3	-167.3	70.3	0	0	0	112.1	F258 L294 S295 W299 L300 H301 Y335 T371 K375 L378	F258-L297 HydrophobicContact CD1-CB 4.26Å; F258-L297 HydrophobicContact CD1-CD2 4.01Å; F258-L297 HydrophobicContact CD2-CD2 4.17Å; F258-L297 HydrophobicContact CE1-CB 4.02Å; F258-L297 HydrophobicContact CE1-CD2 3.76Å; F258-L297 HydrophobicContact CE1-CG 4.46Å; F258-L297 HydrophobicContact CE2-CD2 3.94Å; F258-L297 HydrophobicContact CG-CD2 4.21Å; F258-L297 HydrophobicContact CZ-CD2 3.73Å; L294-L297 WeakPolarHBondContact O-CB 3.25Å; L294-L297 PolarHBondContact O-N 3.03Å; S295-L297 PolarHBondContact O-N 3.49Å; L297-W299 VanDerWaalsContact C-N 3.28Å; L297-W299 PolarHBondContact O-N 3.19Å; L297-L300 PolarHBondContact O-N 3.32Å; L297-H301 WeakPolarHBondContact O-CB 3.5Å; L297-H301 PolarHBondContact O-N 3.49Å; L297-Y335 HydrophobicContact CD1-CE2 4.3Å; L297-Y335 HydrophobicContact CD2-CE2 3.86Å; L297-Y335 WeakPolarHBondContact CD2-OH 3.15Å; L297-Y335 HydrophobicContact CG-CE2 4.05Å; L297-Y335 WeakPolarHBondContact CG-OH 3.38Å; L297-T371 HydrophobicContact CD2-CG2 3.82Å; L297-K375 HydrophobicContact CD1-CB 3.92Å; L297-K375 HydrophobicContact CD1-CG 4.35Å; L297-L378 HydrophobicContact CD1-CB 4.41Å; L297-L378 HydrophobicContact CD1-CD2 3.78Å; L297-L378 HydrophobicContact CG-CD2 4.25Å; L297-L378 WeakPolarHBondContact O-CD2 3.47Å
298	G	84	Confident	84.9	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-65.8	-29.3	175.5	0	0	0	0	0	113.1	V257 S295 N302	V257-G298 WeakPolarHBondContact O-CA 3.19Å; S295-G298 PolarHBondContact O-N 2.97Å; G298-N302 WeakPolarHBondContact O-CB 3.19Å; G298-N302 PolarHBondContact O-N 3.09Å
299	W	87.2	Confident	85.2	Confident	79 Å²	79	38.4 Å²	38.4	30%	0.299	17%	0.171	S	C	.	.	H	α-helix	trans	-72.8	-46.3	173.9	176.5	82.9	0	0	0	111.6	N273 Y275 S295 E296 L297 H301 N302 K303	N273-W299 PolarHBondContact O-NE1 3.01Å; Y275-W299 HydrophobicContact CD2-CB 4.32Å; Y275-W299 HydrophobicContact CE2-CB 4.43Å; S295-W299 PolarHBondContact O-N 3.2Å; E296-W299 PolarHBondContact O-N 2.62Å; L297-W299 VanDerWaalsContact C-N 3.28Å; L297-W299 PolarHBondContact O-N 3.19Å; W299-H301 VanDerWaalsContact C-N 3.27Å; W299-H301 PolarHBondContact O-N 3.5Å; W299-N302 PolarHBondContact O-N 2.99Å; W299-K303 HydrophobicContact CH2-CD 3.72Å; W299-K303 HydrophobicContact CZ2-CD 3.91Å; W299-K303 HydrophobicContact CZ3-CD 4.21Å; W299-K303 WeakPolarHBondContact O-CB 3.41Å; W299-K303 PolarHBondContact O-N 3.47Å
300	L	88.8	Confident	85.3	Confident	5 Å²	5	41.5 Å²	41.5	3%	0.026	18%	0.184	C	C	.	.	H	α-helix	trans	-57.2	-42.9	174.3	-68.5	168.4	0	0	0	111	E296 L297 K303 I304 L378 K379 A382	E296-L300 HydrophobicContact CG-CD1 4.31Å; E296-L300 WeakPolarHBondContact O-CG 3.41Å; E296-L300 PolarHBondContact O-N 3.16Å; L297-L300 PolarHBondContact O-N 3.32Å; L300-K303 PolarHBondContact O-N 3.19Å; L300-I304 WeakPolarHBondContact O-CG1 3.48Å; L300-I304 PolarHBondContact O-N 3.07Å; L300-I304 VanDerWaalsContact O-N 3.13Å; L300-L378 HydrophobicContact CB-CB 4.39Å; L300-L378 HydrophobicContact CB-CD2 3.78Å; L300-L378 HydrophobicContact CB-CG 3.86Å; L300-K379 HydrophobicContact CD1-CB 4.05Å; L300-A382 HydrophobicContact CD2-CB 3.5Å; L300-A382 VanDerWaalsContact CD2-CB 3.5Å
301	H	89.1	Confident	85.3	Confident	0 Å²	0	44.7 Å²	44.7	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-56.8	-57	173.3	180	80.7	0	0	0	111.8	L297 W299 K303 I304 R305 L332 Y335 Y336 L378	L297-H301 WeakPolarHBondContact O-CB 3.5Å; L297-H301 PolarHBondContact O-N 3.49Å; W299-H301 VanDerWaalsContact C-N 3.27Å; W299-H301 PolarHBondContact O-N 3.5Å; H301-K303 PolarHBondContact O-N 3.34Å; H301-I304 PolarHBondContact O-N 2.88Å; H301-R305 VanDerWaalsContact O-CB 3.3Å; H301-R305 WeakPolarHBondContact O-CB 3.48Å; H301-R305 PolarHBondContact O-N 3.35Å; H301-L332 WeakPolarHBondContact ND1-CD1 3.3Å; H301-Y335 HydrophobicContact CB-CE1 4.24Å; H301-Y335 AromaticContact CG-CE1 3.93Å; H301-Y335 AromaticContact ND1-CD1 3.47Å; H301-Y335 WeakPolarHBondContact ND1-CD1 3.21Å; H301-Y335 AromaticContact ND1-CE1 3.32Å; H301-Y335 VanDerWaalsContact ND1-CE1 3.32Å; H301-Y335 WeakPolarHBondContact ND1-CE1 3.37Å; H301-Y336 AromaticContact CE1-CE1 3.46Å; H301-Y336 VanDerWaalsContact CE1-CE1 3.46Å; H301-Y336 WeakPolarHBondContact CE1-CE1 3.3Å; H301-Y336 AromaticContact CE1-CZ 3.57Å; H301-Y336 PolarHBondContact CE1-OH 2.73Å; H301-Y336 AromaticContact NE2-CE1 3.99Å; H301-Y336 PolarHBondContact NE2-OH 3.29Å; H301-L378 HydrophobicContact CB-CD2 4.11Å
302	N	87.8	Confident	84.9	Confident	21 Å²	21	47.1 Å²	47.1	11%	0.112	21%	0.212	C	C	.	.	H	α-helix	trans	-62.4	-30.1	-179.2	-87.6	-9.5	0	0	0	113.2	G260 Y275 G298 W299 R306	G260-N302 WeakPolarHBondContact CA-ND2 3.32Å; G260-N302 WeakPolarHBondContact CA-OD1 3.44Å; G260-N302 PolarHBondContact O-ND2 3.34Å; Y275-N302 PolarHBondContact OH-ND2 3.07Å; G298-N302 WeakPolarHBondContact O-CB 3.19Å; G298-N302 PolarHBondContact O-N 3.09Å; W299-N302 PolarHBondContact O-N 2.99Å; N302-R306 VanDerWaalsContact O-CB 3.28Å; N302-R306 WeakPolarHBondContact O-CB 3.41Å; N302-R306 WeakPolarHBondContact O-CD 3.4Å; N302-R306 WeakPolarHBondContact O-CG 3.36Å; N302-R306 PolarHBondContact O-N 3.16Å
303	K	87.9	Confident	84.4	Confident	48 Å²	48	50.5 Å²	50.5	21%	0.209	23%	0.227	C	C	.	.	H	α-helix	trans	-67.1	-50.2	175.5	-179.3	169.4	179.9	173.3	0	112.2	W299 L300 H301 Y307 A382 D386	W299-K303 HydrophobicContact CH2-CD 3.72Å; W299-K303 HydrophobicContact CZ2-CD 3.91Å; W299-K303 HydrophobicContact CZ3-CD 4.21Å; W299-K303 WeakPolarHBondContact O-CB 3.41Å; W299-K303 PolarHBondContact O-N 3.47Å; L300-K303 PolarHBondContact O-N 3.19Å; H301-K303 PolarHBondContact O-N 3.34Å; K303-Y307 PolarHBondContact O-N 2.89Å; K303-A382 HydrophobicContact CD-CB 4.44Å; K303-D386 WeakPolarHBondContact CE-OD1 3.46Å; K303-D386 IonicContact NZ-OD1 3.33Å; K303-D386 PolarHBondContact NZ-OD1 2.93Å; K303-D386 IonicContact NZ-OD2 2.74Å; K303-D386 PolarHBondContact NZ-OD2 3.14Å
304	I	89.3	Confident	84.1	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-65.7	-43.3	178.8	-66.2	159.3	0	0	0	110.4	L300 H301 Y307 T308 L328 L378 L381 A382 V385	L300-I304 WeakPolarHBondContact O-CG1 3.48Å; L300-I304 PolarHBondContact O-N 3.07Å; L300-I304 VanDerWaalsContact O-N 3.13Å; H301-I304 PolarHBondContact O-N 2.88Å; I304-Y307 PolarHBondContact O-N 3.23Å; I304-T308 WeakPolarHBondContact O-CB 3.3Å; I304-T308 PolarHBondContact O-N 3.32Å; I304-T308 PolarHBondContact O-OG1 2.97Å; I304-L328 HydrophobicContact CG2-CB 4.42Å; I304-L328 HydrophobicContact CG2-CD2 4.3Å; I304-L378 HydrophobicContact CD1-CD1 3.49Å; I304-L378 VanDerWaalsContact CD1-CD1 3.49Å; I304-L378 HydrophobicContact CD1-CG 3.79Å; I304-L381 HydrophobicContact CD1-CB 3.55Å; I304-L381 HydrophobicContact CD1-CD1 4.46Å; I304-L381 HydrophobicContact CG1-CB 4.36Å; I304-A382 HydrophobicContact CD1-CB 4.38Å; I304-A382 HydrophobicContact CG1-CB 4.39Å; I304-V385 HydrophobicContact CG1-CG2 4.45Å
305	R	88.9	Confident	83.4	Confident	97 Å²	97	55.7 Å²	55.7	37%	0.366	25%	0.25	S	S	.	.	H	α-helix	trans	-59.4	-51.3	176.8	-179.5	173.2	174	-179.5	-0.5	111.8	H301 Y307 T308 D309 L332	H301-R305 VanDerWaalsContact O-CB 3.3Å; H301-R305 WeakPolarHBondContact O-CB 3.48Å; H301-R305 PolarHBondContact O-N 3.35Å; R305-Y307 VanDerWaalsContact C-N 3.32Å; R305-Y307 PolarHBondContact O-N 3.04Å; R305-T308 PolarHBondContact O-N 2.97Å; R305-T308 VanDerWaalsContact O-N 3.11Å; R305-D309 VanDerWaalsContact CG-OD2 3.31Å; R305-D309 WeakPolarHBondContact CG-OD2 3.48Å; R305-D309 IonicContact NE-OD2 2.63Å; R305-D309 WeakPolarHBondContact O-CB 3.49Å; R305-D309 VanDerWaalsContact O-CG 3.23Å; R305-D309 PolarHBondContact O-N 3.12Å; R305-L332 HydrophobicContact CB-CD2 4.49Å
306	R	87.6	Confident	83	Confident	116 Å²	116	59 Å²	59	44%	0.438	27%	0.274	S	S	.	.	H	α-helix	trans	-55.7	-43.4	177	-77.7	170.7	179.3	-172	-0.4	112.7	N302 Q310	N302-R306 VanDerWaalsContact O-CB 3.28Å; N302-R306 WeakPolarHBondContact O-CB 3.41Å; N302-R306 WeakPolarHBondContact O-CD 3.4Å; N302-R306 WeakPolarHBondContact O-CG 3.36Å; N302-R306 PolarHBondContact O-N 3.16Å; R306-Q310 WeakPolarHBondContact O-CB 3.42Å; R306-Q310 WeakPolarHBondContact O-CG 3.43Å; R306-Q310 PolarHBondContact O-N 3.42Å; R306-Q310 VanDerWaalsContact O-N 3.1Å
307	Y	86.3	Confident	82.5	Confident	14 Å²	14	56.6 Å²	56.6	6%	0.055	26%	0.262	C	S	.	.	H	α-helix	trans	-63	-44.3	177	178.9	-92.6	0	0	0	111.9	K303 I304 R305 Q310 R311 F317 F324 L328 V385 Q389	K303-Y307 PolarHBondContact O-N 2.89Å; I304-Y307 PolarHBondContact O-N 3.23Å; R305-Y307 VanDerWaalsContact C-N 3.32Å; R305-Y307 PolarHBondContact O-N 3.04Å; Y307-Q310 PolarHBondContact O-N 3.15Å; Y307-R311 HydrophobicContact CD2-CG 4.48Å; Y307-R311 HydrophobicContact CE1-CG 4.29Å; Y307-R311 HydrophobicContact CE2-CG 4.25Å; Y307-R311 WeakPolarHBondContact O-CB 3.26Å; Y307-R311 WeakPolarHBondContact O-CG 3.25Å; Y307-R311 PolarHBondContact O-N 3.35Å; Y307-F317 WeakPolarHBondContact OH-CZ 3.5Å; Y307-F324 HydrophobicContact CE1-CD1 4.06Å; Y307-F324 AromaticContact CE1-CE1 3.72Å; Y307-F324 HydrophobicContact CE1-CE1 3.72Å; Y307-L328 HydrophobicContact CD1-CD1 3.97Å; Y307-L328 HydrophobicContact CE1-CD1 4.07Å; Y307-V385 HydrophobicContact CD1-CG1 3.99Å; Y307-V385 HydrophobicContact CD1-CG2 4.06Å; Y307-V385 HydrophobicContact CD2-CG1 3.64Å; Y307-V385 HydrophobicContact CE1-CG1 4.46Å; Y307-V385 HydrophobicContact CE1-CG2 4.36Å; Y307-V385 HydrophobicContact CE2-CG1 4.13Å; Y307-V385 HydrophobicContact CG-CG1 3.55Å; Y307-V385 HydrophobicContact CG-CG2 4.43Å; Y307-Q389 HydrophobicContact CD2-CG 4.38Å; Y307-Q389 HydrophobicContact CE2-CG 3.95Å
308	T	85.9	Confident	82.5	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.006	26%	0.262	C	S	.	.	H	α-helix	trans	-69.8	-43.3	-178.1	-55.3	0	0	0	0	112	I304 R305 Q310 R311 S312 C325 H329	I304-T308 WeakPolarHBondContact O-CB 3.3Å; I304-T308 PolarHBondContact O-N 3.32Å; I304-T308 PolarHBondContact O-OG1 2.97Å; R305-T308 PolarHBondContact O-N 2.97Å; R305-T308 VanDerWaalsContact O-N 3.11Å; T308-Q310 VanDerWaalsContact C-N 3.3Å; T308-Q310 PolarHBondContact O-N 3.2Å; T308-R311 PolarHBondContact O-N 3.08Å; T308-S312 VanDerWaalsContact O-CB 3.23Å; T308-S312 WeakPolarHBondContact O-CB 3.15Å; T308-S312 PolarHBondContact O-N 3Å; T308-S312 PolarHBondContact O-OG 3.04Å; T308-C325 HydrophobicContact CG2-CB 4.35Å; T308-H329 WeakPolarHBondContact CG2-CE1 3.35Å; T308-H329 VanDerWaalsContact CG2-ND1 3.34Å; T308-H329 WeakPolarHBondContact CG2-ND1 3.48Å
309	D	84.8	Confident	82.6	Confident	78 Å²	78	59.9 Å²	59.9	42%	0.417	28%	0.28	S	S	.	.	H	α-helix	trans	-62.6	-36.6	175.8	-67.7	-12.3	0	0	0	111	R305 S312	R305-D309 VanDerWaalsContact CG-OD2 3.31Å; R305-D309 WeakPolarHBondContact CG-OD2 3.48Å; R305-D309 IonicContact NE-OD2 2.63Å; R305-D309 WeakPolarHBondContact O-CB 3.49Å; R305-D309 VanDerWaalsContact O-CG 3.23Å; R305-D309 PolarHBondContact O-N 3.12Å; D309-S312 PolarHBondContact O-OG 2.83Å
310	Q	82.8	Confident	82.6	Confident	131 Å²	131	56.2 Å²	56.2	61%	0.612	27%	0.266	S	S	*	.	H	α-helix	trans	-71.5	-48	174.7	-73.8	168.8	0	0	0	112.7	R306 Y307 T308	R306-Q310 WeakPolarHBondContact O-CB 3.42Å; R306-Q310 WeakPolarHBondContact O-CG 3.43Å; R306-Q310 PolarHBondContact O-N 3.42Å; R306-Q310 VanDerWaalsContact O-N 3.1Å; Y307-Q310 PolarHBondContact O-N 3.15Å; T308-Q310 VanDerWaalsContact C-N 3.3Å; T308-Q310 PolarHBondContact O-N 3.2Å
311	R	79.3	Confident	82.5	Confident	71 Å²	71	56 Å²	56	27%	0.268	26%	0.264	S	S	.	.	H	α-helix	trans	-84.6	-18.7	-170.5	-69.8	-54.8	-167	-171.5	2.9	115.3	Y307 T308 L313 D314 F317	Y307-R311 HydrophobicContact CD2-CG 4.48Å; Y307-R311 HydrophobicContact CE1-CG 4.29Å; Y307-R311 HydrophobicContact CE2-CG 4.25Å; Y307-R311 WeakPolarHBondContact O-CB 3.26Å; Y307-R311 WeakPolarHBondContact O-CG 3.25Å; Y307-R311 PolarHBondContact O-N 3.35Å; T308-R311 PolarHBondContact O-N 3.08Å; R311-L313 PolarHBondContact O-N 3.39Å; R311-D314 VanDerWaalsContact CD-OD2 3.27Å; R311-D314 WeakPolarHBondContact CD-OD2 3.36Å; R311-D314 IonicContact CZ-OD2 3.92Å; R311-D314 IonicContact NE-OD2 3.21Å; R311-D314 IonicContact NH1-OD2 2.33Å; R311-D314 PolarHBondContact NH1-OD2 3.18Å; R311-D314 PolarHBondContact O-N 3.34Å; R311-F317 HydrophobicContact CB-CD1 3.73Å; R311-F317 HydrophobicContact CB-CE1 3.8Å; R311-F317 HydrophobicContact CB-CG 4.45Å; R311-F317 HydrophobicContact CG-CD1 4.18Å; R311-F317 HydrophobicContact CG-CE1 4.07Å; R311-F317 HydrophobicContact CG-CZ 4.38Å
312	S	73.6	Confident	82.4	Confident	51 Å²	51	59 Å²	59	36%	0.357	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-23.9	177.4	53.7	0	0	0	0	114.1	T308 D309	T308-S312 VanDerWaalsContact O-CB 3.23Å; T308-S312 WeakPolarHBondContact O-CB 3.15Å; T308-S312 PolarHBondContact O-N 3Å; T308-S312 PolarHBondContact O-OG 3.04Å; D309-S312 PolarHBondContact O-OG 2.83Å
313	L	70.7	Confident	82.5	Confident	147 Å²	147	59.3 Å²	59.3	77%	0.77	28%	0.283	S	S	*	.	S	Bend	trans	-95.1	-16.7	177.9	-62.1	174	0	0	0	113.4	R311 R315	R311-L313 PolarHBondContact O-N 3.39Å; L313-R315 PolarHBondContact O-N 3Å
314	D	75.6	Confident	82.5	Confident	53 Å²	53	57 Å²	57	28%	0.283	27%	0.273	S	S	.	.			trans	-73.8	95	-179	-86.8	-25.9	0	0	0	111.6	R311 S316 F317	R311-D314 VanDerWaalsContact CD-OD2 3.27Å; R311-D314 WeakPolarHBondContact CD-OD2 3.36Å; R311-D314 IonicContact CZ-OD2 3.92Å; R311-D314 IonicContact NE-OD2 3.21Å; R311-D314 IonicContact NH1-OD2 2.33Å; R311-D314 PolarHBondContact NH1-OD2 3.18Å; R311-D314 PolarHBondContact O-N 3.34Å; D314-S316 PolarHBondContact O-N 3.18Å; D314-F317 HydrophobicContact CB-CB 3.81Å; D314-F317 VanDerWaalsContact O-CB 3.29Å; D314-F317 WeakPolarHBondContact O-CB 3.39Å; D314-F317 PolarHBondContact O-N 3.11Å
315	R	70.3	Confident	82.5	Confident	191 Å²	191	57.2 Å²	57.2	72%	0.721	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-56.9	-30.3	169	-67	-175.5	-179.3	173.6	-0.5	112.5	L313 F317 G318 Y443	L313-R315 PolarHBondContact O-N 3Å; R315-F317 PolarHBondContact O-N 3.02Å; R315-G318 PolarHBondContact O-N 3.3Å; R315-Y443 HydrophobicContact CB-CE1 4.31Å; R315-Y443 WeakPolarHBondContact O-CD1 3.42Å; R315-Y443 WeakPolarHBondContact O-CE1 3.48Å
316	S	73.8	Confident	82.5	Confident	74 Å²	74	55.1 Å²	55.1	52%	0.517	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-62.8	-26.7	175.7	53.3	0	0	0	0	113.6	D314 G318 K392	D314-S316 PolarHBondContact O-N 3.18Å; S316-G318 PolarHBondContact O-N 2.94Å; S316-K392 WeakPolarHBondContact O-CE 3.36Å; S316-K392 PolarHBondContact O-NZ 3.37Å
317	F	74.6	Confident	82.6	Confident	9 Å²	9	49.6 Å²	49.6	4%	0.039	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-71.5	-19.2	179.4	-165.9	-135.1	0	0	0	112.7	Y307 R311 D314 R315 G321 L396	Y307-F317 WeakPolarHBondContact OH-CZ 3.5Å; R311-F317 HydrophobicContact CB-CD1 3.73Å; R311-F317 HydrophobicContact CB-CE1 3.8Å; R311-F317 HydrophobicContact CB-CG 4.45Å; R311-F317 HydrophobicContact CG-CD1 4.18Å; R311-F317 HydrophobicContact CG-CE1 4.07Å; R311-F317 HydrophobicContact CG-CZ 4.38Å; D314-F317 HydrophobicContact CB-CB 3.81Å; D314-F317 VanDerWaalsContact O-CB 3.29Å; D314-F317 WeakPolarHBondContact O-CB 3.39Å; D314-F317 PolarHBondContact O-N 3.11Å; R315-F317 PolarHBondContact O-N 3.02Å; F317-G321 VanDerWaalsContact CD1-CA 3.45Å; F317-G321 VanDerWaalsContact CE1-C 3.45Å; F317-G321 WeakPolarHBondContact CE1-O 3.31Å; F317-L396 HydrophobicContact CZ-CD2 4.18Å
318	G	83.4	Confident	82.8	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	80.2	175.5	171.7	0	0	0	0	0	114.8	R315 S316 G321 Q322 E445	R315-G318 PolarHBondContact O-N 3.3Å; S316-G318 PolarHBondContact O-N 2.94Å; G318-G321 PolarHBondContact O-N 3.3Å; G318-Q322 VanDerWaalsContact O-CG 3.31Å; G318-Q322 WeakPolarHBondContact O-CG 3.34Å; G318-Q322 PolarHBondContact O-N 2.93Å; G318-E445 VanDerWaalsContact CA-CD 3.47Å; G318-E445 WeakPolarHBondContact CA-OE1 3.4Å; G318-E445 VanDerWaalsContact CA-OE2 3.28Å; G318-E445 WeakPolarHBondContact CA-OE2 3.16Å
319	L	86.3	Confident	83	Confident	72 Å²	72	53.1 Å²	53.1	38%	0.377	27%	0.273	S	S	.	.	H	α-helix	trans	-69.3	-35.3	-175.1	-165.3	63.3	0	0	0	111.9	Q322 S323 P425 F429 E445	L319-Q322 PolarHBondContact O-N 3.38Å; L319-S323 PolarHBondContact O-N 3.29Å; L319-P425 HydrophobicContact CB-CB 4.44Å; L319-P425 HydrophobicContact CD2-CB 3.99Å; L319-P425 HydrophobicContact CG-CB 3.97Å; L319-P425 HydrophobicContact CG-CG 4.14Å; L319-F429 HydrophobicContact CD2-CE2 4.49Å; L319-F429 HydrophobicContact CD2-CZ 3.94Å; L319-E445 VanDerWaalsContact N-CD 3.31Å; L319-E445 PolarHBondContact N-OE1 3.06Å; L319-E445 PolarHBondContact N-OE2 3.16Å
320	V	87.7	Confident	83.3	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.006	27%	0.272	C	S	.	.	H	α-helix	trans	-68.5	-39.6	174.4	-176.2	0	0	0	0	110.4	S323 F324 L396 V422 P425 V426 E445	V320-S323 PolarHBondContact O-N 3.04Å; V320-F324 PolarHBondContact O-N 2.72Å; V320-L396 HydrophobicContact CG1-CD2 4.34Å; V320-V422 HydrophobicContact CG1-CG1 3.77Å; V320-P425 HydrophobicContact CG2-CB 4.21Å; V320-V426 HydrophobicContact CG1-CG2 4.45Å; V320-V426 HydrophobicContact CG2-CG2 3.69Å; V320-E445 VanDerWaalsContact CB-OE1 3.26Å; V320-E445 WeakPolarHBondContact CB-OE1 3.45Å; V320-E445 HydrophobicContact CG2-CB 4.43Å; V320-E445 WeakPolarHBondContact CG2-OE1 3.44Å; V320-E445 PolarHBondContact N-OE1 3.45Å
321	G	87	Confident	83.6	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-64.8	-39.3	173.2	0	0	0	0	0	113.2	F317 G318 F324 C325	F317-G321 VanDerWaalsContact CD1-CA 3.45Å; F317-G321 VanDerWaalsContact CE1-C 3.45Å; F317-G321 WeakPolarHBondContact CE1-O 3.31Å; G318-G321 PolarHBondContact O-N 3.3Å; G321-F324 WeakPolarHBondContact O-CB 3.49Å; G321-F324 PolarHBondContact O-N 3.43Å; G321-C325 PolarHBondContact O-N 3.42Å; G321-C325 PolarHBondContact O-SG 3.32Å
322	Q	87.8	Confident	84.1	Confident	65 Å²	65	44.7 Å²	44.7	30%	0.304	24%	0.235	S	C	.	.	H	α-helix	trans	-66.6	-41.8	175	-74.3	170.1	10.7	0	0	111.9	G318 L319 F324 C325 A326	G318-Q322 VanDerWaalsContact O-CG 3.31Å; G318-Q322 WeakPolarHBondContact O-CG 3.34Å; G318-Q322 PolarHBondContact O-N 2.93Å; L319-Q322 PolarHBondContact O-N 3.38Å; Q322-F324 VanDerWaalsContact C-N 3.32Å; Q322-F324 PolarHBondContact O-N 2.68Å; Q322-C325 PolarHBondContact O-N 2.8Å; Q322-C325 VanDerWaalsContact O-N 3.16Å; Q322-A326 PolarHBondContact O-N 2.89Å
323	S	87.9	Confident	84.9	Confident	27 Å²	27	51.8 Å²	51.8	19%	0.189	25%	0.253	C	S	.	.	H	α-helix	trans	-60.3	-38.4	171.3	-78.5	0	0	0	0	113	L319 V320 A326 A327 L421 P425	L319-S323 PolarHBondContact O-N 3.29Å; V320-S323 PolarHBondContact O-N 3.04Å; S323-A326 PolarHBondContact O-N 3.28Å; S323-A327 PolarHBondContact O-N 2.93Å; S323-L421 WeakPolarHBondContact CB-O 3.34Å; S323-P425 VanDerWaalsContact OG-CG 3.25Å; S323-P425 WeakPolarHBondContact OG-CG 3.37Å
324	F	89.8	Confident	85.7	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-62.5	-43.8	172.7	-176.9	-126.9	0	0	0	111.8	Y307 V320 G321 Q322 A326 A327 L328 L384 V385 C388 L396 V400 I418 V422	Y307-F324 HydrophobicContact CE1-CD1 4.06Å; Y307-F324 AromaticContact CE1-CE1 3.72Å; Y307-F324 HydrophobicContact CE1-CE1 3.72Å; V320-F324 PolarHBondContact O-N 2.72Å; G321-F324 WeakPolarHBondContact O-CB 3.49Å; G321-F324 PolarHBondContact O-N 3.43Å; Q322-F324 VanDerWaalsContact C-N 3.32Å; Q322-F324 PolarHBondContact O-N 2.68Å; F324-A326 VanDerWaalsContact C-N 3.31Å; F324-A326 PolarHBondContact O-N 2.86Å; F324-A327 PolarHBondContact O-N 2.74Å; F324-L328 HydrophobicContact CD1-CD1 4.15Å; F324-L328 HydrophobicContact CE1-CD1 3.8Å; F324-L328 HydrophobicContact CE2-CD1 4.36Å; F324-L328 HydrophobicContact CE2-CD2 4.32Å; F324-L328 HydrophobicContact CE2-CG 4.25Å; F324-L328 HydrophobicContact CZ-CD1 3.91Å; F324-L328 HydrophobicContact CZ-CD2 4.32Å; F324-L328 HydrophobicContact CZ-CG 4.26Å; F324-L328 WeakPolarHBondContact O-CG 3.36Å; F324-L328 PolarHBondContact O-N 3.45Å; F324-L384 HydrophobicContact CE2-CD2 3.87Å; F324-L384 HydrophobicContact CE2-CG 4.14Å; F324-L384 HydrophobicContact CZ-CD2 4.31Å; F324-L384 HydrophobicContact CZ-CG 4.12Å; F324-V385 HydrophobicContact CZ-CG2 4.35Å; F324-C388 HydrophobicContact CE1-CB 3.74Å; F324-C388 HydrophobicContact CZ-CB 4.08Å; F324-L396 HydrophobicContact CB-CD2 4.07Å; F324-L396 HydrophobicContact CD1-CD1 4.35Å; F324-L396 HydrophobicContact CD1-CD2 4.41Å; F324-L396 HydrophobicContact CG-CD2 4.43Å; F324-V400 HydrophobicContact CE2-CG2 4.47Å; F324-I418 HydrophobicContact CD2-CG2 3.89Å; F324-I418 HydrophobicContact CE2-CG2 3.94Å; F324-V422 HydrophobicContact CB-CG2 3.75Å; F324-V422 HydrophobicContact CD2-CG2 3.78Å; F324-V422 HydrophobicContact CG-CG2 4.22Å
325	C	89.3	Confident	86.4	Confident	4 Å²	4	46.7 Å²	46.7	3%	0.027	22%	0.224	C	C	.	.	H	α-helix	trans	-64.3	-33.9	174.9	-64.1	0	0	0	0	112.6	T308 G321 Q322 H329	T308-C325 HydrophobicContact CG2-CB 4.35Å; G321-C325 PolarHBondContact O-N 3.42Å; G321-C325 PolarHBondContact O-SG 3.32Å; Q322-C325 PolarHBondContact O-N 2.8Å; Q322-C325 VanDerWaalsContact O-N 3.16Å; C325-H329 PolarHBondContact O-N 2.81Å; C325-H329 PolarHBondContact O-ND1 3.24Å
326	A	88.9	Confident	87.3	Confident	53 Å²	53	42 Å²	42	44%	0.438	21%	0.206	S	C	.	.	H	α-helix	trans	-67.6	-42.5	174.7	0	0	0	0	0	111.9	Q322 S323 F324 H329 Q330	Q322-A326 PolarHBondContact O-N 2.89Å; S323-A326 PolarHBondContact O-N 3.28Å; F324-A326 VanDerWaalsContact C-N 3.31Å; F324-A326 PolarHBondContact O-N 2.86Å; A326-H329 WeakPolarHBondContact O-CB 3.34Å; A326-H329 PolarHBondContact O-N 3.46Å; A326-Q330 PolarHBondContact O-N 3.06Å
327	A	89.8	Confident	88.1	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-61.4	-43.8	173.6	0	0	0	0	0	111.9	S323 F324 H329 Q330 E331 I418 L421	S323-A327 PolarHBondContact O-N 2.93Å; F324-A327 PolarHBondContact O-N 2.74Å; A327-H329 PolarHBondContact O-N 2.89Å; A327-Q330 PolarHBondContact O-N 2.79Å; A327-E331 PolarHBondContact O-N 3.04Å; A327-E331 VanDerWaalsContact O-N 3.08Å; A327-I418 HydrophobicContact CB-CG1 4.4Å; A327-I418 HydrophobicContact CB-CG2 4.18Å; A327-L421 HydrophobicContact CB-CB 4.11Å; A327-L421 HydrophobicContact CB-CD2 3.77Å
328	L	90.6	Very high	88.7	Confident	1 Å²	1	48 Å²	48	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-61.6	-39.8	174.4	-68.7	176.4	0	0	0	112.4	I304 Y307 F324 L332 L381 V385	I304-L328 HydrophobicContact CG2-CB 4.42Å; I304-L328 HydrophobicContact CG2-CD2 4.3Å; Y307-L328 HydrophobicContact CD1-CD1 3.97Å; Y307-L328 HydrophobicContact CE1-CD1 4.07Å; F324-L328 HydrophobicContact CD1-CD1 4.15Å; F324-L328 HydrophobicContact CE1-CD1 3.8Å; F324-L328 HydrophobicContact CE2-CD1 4.36Å; F324-L328 HydrophobicContact CE2-CD2 4.32Å; F324-L328 HydrophobicContact CE2-CG 4.25Å; F324-L328 HydrophobicContact CZ-CD1 3.91Å; F324-L328 HydrophobicContact CZ-CD2 4.32Å; F324-L328 HydrophobicContact CZ-CG 4.26Å; F324-L328 WeakPolarHBondContact O-CG 3.36Å; F324-L328 PolarHBondContact O-N 3.45Å; L328-L332 WeakPolarHBondContact O-CB 3.17Å; L328-L332 PolarHBondContact O-N 3.38Å; L328-L381 HydrophobicContact CD2-CD2 4.06Å; L328-V385 HydrophobicContact CD1-CG2 3.71Å; L328-V385 HydrophobicContact CD2-CG2 4.13Å
329	H	90.1	Very high	88.9	Confident	88 Å²	88	48.5 Å²	48.5	41%	0.407	22%	0.223	S	C	.	.	H	α-helix	trans	-62.7	-39.5	172.6	-81.4	108.2	0	0	0	112.8	T308 C325 A326 A327 L332 R333	T308-H329 WeakPolarHBondContact CG2-CE1 3.35Å; T308-H329 VanDerWaalsContact CG2-ND1 3.34Å; T308-H329 WeakPolarHBondContact CG2-ND1 3.48Å; C325-H329 PolarHBondContact O-N 2.81Å; C325-H329 PolarHBondContact O-ND1 3.24Å; A326-H329 WeakPolarHBondContact O-CB 3.34Å; A326-H329 PolarHBondContact O-N 3.46Å; A327-H329 PolarHBondContact O-N 2.89Å; H329-L332 PolarHBondContact O-N 3.47Å; H329-R333 WeakPolarHBondContact O-CB 3.47Å; H329-R333 PolarHBondContact O-N 3.07Å
330	Q	89.5	Confident	88.9	Confident	85 Å²	85	48.4 Å²	48.4	40%	0.397	23%	0.229	S	C	.	.	H	α-helix	trans	-64.1	-45.7	179	179.3	171.2	-24.9	0	0	111.4	A326 A327 R333 E334 H417	A326-Q330 PolarHBondContact O-N 3.06Å; A327-Q330 PolarHBondContact O-N 2.79Å; Q330-R333 WeakPolarHBondContact O-CB 3.2Å; Q330-R333 PolarHBondContact O-N 3.09Å; Q330-R333 VanDerWaalsContact O-N 3.16Å; Q330-E334 PolarHBondContact O-N 3.15Å; Q330-E334 VanDerWaalsContact O-N 3.14Å; Q330-H417 PolarHBondContact NE2-CE1 3.13Å; Q330-H417 PolarHBondContact NE2-NE2 3.23Å; Q330-H417 PolarHBondContact OE1-NE2 3.36Å
331	E	89.1	Confident	88.9	Confident	10 Å²	10	51.5 Å²	51.5	5%	0.047	25%	0.247	C	C	.	.	H	α-helix	trans	-62.1	-41.9	173.2	-71.9	-65.3	128.6	0	0	112.3	A327 R333 E334 Y335 R377 L381 L414	A327-E331 PolarHBondContact O-N 3.04Å; A327-E331 VanDerWaalsContact O-N 3.08Å; E331-R333 PolarHBondContact O-N 3.12Å; E331-E334 WeakPolarHBondContact O-CB 3.45Å; E331-E334 PolarHBondContact O-N 3.35Å; E331-E334 VanDerWaalsContact O-N 3.15Å; E331-Y335 PolarHBondContact O-N 3.34Å; E331-Y335 VanDerWaalsContact O-N 3.1Å; E331-R377 VanDerWaalsContact CD-NH2 3.25Å; E331-R377 IonicContact OE1-NH2 3.14Å; E331-R377 PolarHBondContact OE1-NH2 2.97Å; E331-R377 IonicContact OE2-CZ 2.72Å; E331-R377 IonicContact OE2-NE 2.72Å; E331-R377 PolarHBondContact OE2-NE 3.2Å; E331-R377 IonicContact OE2-NH2 2.96Å; E331-R377 PolarHBondContact OE2-NH2 3.05Å; E331-L381 HydrophobicContact CB-CD1 3.64Å; E331-L381 HydrophobicContact CG-CD1 4.05Å; E331-L381 HydrophobicContact CG-CD2 4.17Å; E331-L414 HydrophobicContact CG-CD1 4.06Å; E331-L414 WeakPolarHBondContact OE2-CD1 3.22Å
332	L	90.5	Very high	88.7	Confident	8 Å²	8	51.5 Å²	51.5	4%	0.042	25%	0.248	C	C	.	.	H	α-helix	trans	-63.7	-30	175.7	-152.2	68.5	0	0	0	111.9	H301 R305 L328 H329 Y335 Y336 L378	H301-L332 WeakPolarHBondContact ND1-CD1 3.3Å; R305-L332 HydrophobicContact CB-CD2 4.49Å; L328-L332 WeakPolarHBondContact O-CB 3.17Å; L328-L332 PolarHBondContact O-N 3.38Å; H329-L332 PolarHBondContact O-N 3.47Å; L332-Y335 WeakPolarHBondContact O-CB 3.45Å; L332-Y335 PolarHBondContact O-N 3.13Å; L332-Y336 HydrophobicContact CB-CE2 4.4Å; L332-Y336 HydrophobicContact CD2-CE2 3.89Å; L332-Y336 HydrophobicContact CG-CD2 4.42Å; L332-Y336 HydrophobicContact CG-CE2 3.79Å; L332-Y336 WeakPolarHBondContact O-CD2 3.35Å; L332-Y336 PolarHBondContact O-N 3.26Å; L332-L378 HydrophobicContact CD1-CD1 4.43Å
333	R	90.4	Very high	88.5	Confident	199 Å²	199	52.6 Å²	52.6	75%	0.751	25%	0.252	S	S	*	.	H	α-helix	trans	-70.9	-35.5	174.2	-166.3	179	-173.7	171.6	2.4	112.5	H329 Q330 E331 Y335 Y336 R337	H329-R333 WeakPolarHBondContact O-CB 3.47Å; H329-R333 PolarHBondContact O-N 3.07Å; Q330-R333 WeakPolarHBondContact O-CB 3.2Å; Q330-R333 PolarHBondContact O-N 3.09Å; Q330-R333 VanDerWaalsContact O-N 3.16Å; E331-R333 PolarHBondContact O-N 3.12Å; R333-Y335 VanDerWaalsContact C-N 3.32Å; R333-Y336 PolarHBondContact O-N 3.32Å; R333-R337 WeakPolarHBondContact O-CB 3.49Å; R333-R337 PolarHBondContact O-N 3.07Å
334	E	87.1	Confident	88.2	Confident	80 Å²	80	54.4 Å²	54.4	37%	0.374	27%	0.265	S	S	.	.	H	α-helix	trans	-62.8	-41.7	169.6	-59.3	-139.2	120.4	0	0	111	Q330 E331 R337 L338 R377	Q330-E334 PolarHBondContact O-N 3.15Å; Q330-E334 VanDerWaalsContact O-N 3.14Å; E331-E334 WeakPolarHBondContact O-CB 3.45Å; E331-E334 PolarHBondContact O-N 3.35Å; E331-E334 VanDerWaalsContact O-N 3.15Å; E334-R337 WeakPolarHBondContact O-CB 3.47Å; E334-R337 PolarHBondContact O-N 2.76Å; E334-L338 PolarHBondContact O-N 3.19Å; E334-L338 VanDerWaalsContact O-N 3.16Å; E334-R377 IonicContact OE2-CZ 3.65Å; E334-R377 VanDerWaalsContact OE2-CZ 3.29Å; E334-R377 IonicContact OE2-NH1 3.84Å; E334-R377 PolarHBondContact OE2-NH1 3.03Å; E334-R377 VanDerWaalsContact OE2-NH1 3.14Å; E334-R377 IonicContact OE2-NH2 3.53Å; E334-R377 PolarHBondContact OE2-NH2 3.07Å
335	Y	89.9	Confident	87.7	Confident	14 Å²	14	56.9 Å²	56.9	6%	0.055	28%	0.277	C	S	.	.	H	α-helix	trans	-62.3	-47.7	175.1	-179.8	-111.9	0	0	0	112.4	F258 L297 H301 E331 L332 R333 R337 L338 L339 P374	F258-Y335 WeakPolarHBondContact CB-OH 3.41Å; F258-Y335 WeakPolarHBondContact O-CE1 3.28Å; F258-Y335 PolarHBondContact O-OH 3.46Å; L297-Y335 HydrophobicContact CD1-CE2 4.3Å; L297-Y335 HydrophobicContact CD2-CE2 3.86Å; L297-Y335 WeakPolarHBondContact CD2-OH 3.15Å; L297-Y335 HydrophobicContact CG-CE2 4.05Å; L297-Y335 WeakPolarHBondContact CG-OH 3.38Å; H301-Y335 HydrophobicContact CB-CE1 4.24Å; H301-Y335 AromaticContact CG-CE1 3.93Å; H301-Y335 AromaticContact ND1-CD1 3.47Å; H301-Y335 WeakPolarHBondContact ND1-CD1 3.21Å; H301-Y335 AromaticContact ND1-CE1 3.32Å; H301-Y335 VanDerWaalsContact ND1-CE1 3.32Å; H301-Y335 WeakPolarHBondContact ND1-CE1 3.37Å; E331-Y335 PolarHBondContact O-N 3.34Å; E331-Y335 VanDerWaalsContact O-N 3.1Å; L332-Y335 WeakPolarHBondContact O-CB 3.45Å; L332-Y335 PolarHBondContact O-N 3.13Å; R333-Y335 VanDerWaalsContact C-N 3.32Å; Y335-R337 VanDerWaalsContact C-N 3.26Å; Y335-R337 PolarHBondContact O-N 3.28Å; Y335-L338 WeakPolarHBondContact O-CB 2.98Å; Y335-L338 PolarHBondContact O-N 3.37Å; Y335-L339 HydrophobicContact CD1-CD1 4.16Å; Y335-L339 HydrophobicContact CD1-CG 4.44Å; Y335-L339 HydrophobicContact CE1-CD1 3.62Å; Y335-L339 HydrophobicContact CE1-CD2 4.44Å; Y335-L339 HydrophobicContact CE1-CG 4.1Å; Y335-L339 HydrophobicContact CE2-CD2 4.24Å; Y335-L339 HydrophobicContact CE2-CG 4.47Å; Y335-L339 PolarHBondContact O-N 3.3Å; Y335-P374 HydrophobicContact CD2-CB 4.4Å
336	Y	90.3	Very high	87.1	Confident	92 Å²	92	57.3 Å²	57.3	36%	0.361	28%	0.279	S	S	.	.	H	α-helix	trans	-60.4	-33.7	174.8	-67	-50	0	0	0	112.8	H301 L332 R333 L338 L339 S340	H301-Y336 AromaticContact CE1-CE1 3.46Å; H301-Y336 VanDerWaalsContact CE1-CE1 3.46Å; H301-Y336 WeakPolarHBondContact CE1-CE1 3.3Å; H301-Y336 AromaticContact CE1-CZ 3.57Å; H301-Y336 PolarHBondContact CE1-OH 2.73Å; H301-Y336 AromaticContact NE2-CE1 3.99Å; H301-Y336 PolarHBondContact NE2-OH 3.29Å; L332-Y336 HydrophobicContact CB-CE2 4.4Å; L332-Y336 HydrophobicContact CD2-CE2 3.89Å; L332-Y336 HydrophobicContact CG-CD2 4.42Å; L332-Y336 HydrophobicContact CG-CE2 3.79Å; L332-Y336 WeakPolarHBondContact O-CD2 3.35Å; L332-Y336 PolarHBondContact O-N 3.26Å; R333-Y336 PolarHBondContact O-N 3.32Å; Y336-L338 VanDerWaalsContact C-N 3.33Å; Y336-L338 PolarHBondContact O-N 3.31Å; Y336-L339 HydrophobicContact CD1-CD1 4.36Å; Y336-L339 PolarHBondContact O-N 3.48Å; Y336-S340 PolarHBondContact O-N 2.92Å
337	R	91.1	Very high	86.3	Confident	164 Å²	164	59.9 Å²	59.9	62%	0.619	28%	0.281	S	S	*	.	H	α-helix	trans	-64.8	-34.2	173.7	-173.2	-177.6	69.3	89.5	-3.3	112.4	R333 E334 Y335 S340 V341	R333-R337 WeakPolarHBondContact O-CB 3.49Å; R333-R337 PolarHBondContact O-N 3.07Å; E334-R337 WeakPolarHBondContact O-CB 3.47Å; E334-R337 PolarHBondContact O-N 2.76Å; Y335-R337 VanDerWaalsContact C-N 3.26Å; Y335-R337 PolarHBondContact O-N 3.28Å; R337-S340 PolarHBondContact O-OG 3.44Å; R337-V341 WeakPolarHBondContact O-CG2 3.5Å; R337-V341 PolarHBondContact O-N 3.16Å
338	L	87.3	Confident	85.3	Confident	46 Å²	46	64 Å²	64	24%	0.241	30%	0.303	C	S	.	.	H	α-helix	trans	-71.3	-40.2	171.6	179.7	63.1	0	0	0	111.6	E334 Y335 Y336 S340 V341 L342 P374	E334-L338 PolarHBondContact O-N 3.19Å; E334-L338 VanDerWaalsContact O-N 3.16Å; Y335-L338 WeakPolarHBondContact O-CB 2.98Å; Y335-L338 PolarHBondContact O-N 3.37Å; Y336-L338 VanDerWaalsContact C-N 3.33Å; Y336-L338 PolarHBondContact O-N 3.31Å; L338-S340 VanDerWaalsContact C-N 3.31Å; L338-S340 PolarHBondContact O-N 2.88Å; L338-V341 PolarHBondContact O-N 3.29Å; L338-L342 HydrophobicContact CG-CD1 4.19Å; L338-L342 PolarHBondContact O-N 3.44Å; L338-P374 HydrophobicContact CD2-CB 4.18Å; L338-P374 HydrophobicContact CD2-CG 3.27Å
339	L	87	Confident	84	Confident	9 Å²	9	67.4 Å²	67.4	5%	0.047	32%	0.319	C	S	.	.	H	α-helix	trans	-62.2	-35.8	177.7	-64.7	-170.4	0	0	0	112.7	F258 Q259 Y335 Y336 L342 H343	F258-L339 HydrophobicContact CB-CD1 4.12Å; F258-L339 HydrophobicContact CB-CD2 3.78Å; F258-L339 HydrophobicContact CD2-CD2 3.69Å; F258-L339 HydrophobicContact CG-CD2 4.2Å; Q259-L339 HydrophobicContact CG-CD1 4.02Å; Y335-L339 HydrophobicContact CD1-CD1 4.16Å; Y335-L339 HydrophobicContact CD1-CG 4.44Å; Y335-L339 HydrophobicContact CE1-CD1 3.62Å; Y335-L339 HydrophobicContact CE1-CD2 4.44Å; Y335-L339 HydrophobicContact CE1-CG 4.1Å; Y335-L339 HydrophobicContact CE2-CD2 4.24Å; Y335-L339 HydrophobicContact CE2-CG 4.47Å; Y335-L339 PolarHBondContact O-N 3.3Å; Y336-L339 HydrophobicContact CD1-CD1 4.36Å; Y336-L339 PolarHBondContact O-N 3.48Å; L339-L342 HydrophobicContact CD2-CD1 4.19Å; L339-L342 PolarHBondContact O-N 3.43Å; L339-H343 WeakPolarHBondContact O-CB 3.44Å; L339-H343 PolarHBondContact O-N 3.47Å
340	S	85.8	Confident	82.7	Confident	70 Å²	70	67.3 Å²	67.3	49%	0.49	32%	0.321	S	S	.	.	H	α-helix	trans	-68.6	-35.3	175.4	64.5	0	0	0	0	112.9	Y336 R337 L338 H343 S344	Y336-S340 PolarHBondContact O-N 2.92Å; R337-S340 PolarHBondContact O-OG 3.44Å; L338-S340 VanDerWaalsContact C-N 3.31Å; L338-S340 PolarHBondContact O-N 2.88Å; S340-H343 PolarHBondContact O-N 3.42Å; S340-S344 WeakPolarHBondContact O-CB 3.4Å; S340-S344 PolarHBondContact O-N 3.24Å
341	V	87.4	Confident	81.3	Confident	66 Å²	66	68.7 Å²	68.7	40%	0.4	33%	0.332	S	S	.	.	H	α-helix	trans	-65.4	-44.1	172.6	174.6	0	0	0	0	111.3	R337 L338 S344 Q345	R337-V341 WeakPolarHBondContact O-CG2 3.5Å; R337-V341 PolarHBondContact O-N 3.16Å; L338-V341 PolarHBondContact O-N 3.29Å; V341-S344 PolarHBondContact O-N 2.93Å; V341-Q345 PolarHBondContact O-N 3.49Å
342	L	83.4	Confident	79.7	Confident	1 Å²	1	74.7 Å²	74.7	1%	0.005	36%	0.359	C	S	.	.	H	α-helix	trans	-62.3	-42.2	175.5	-73.4	169.3	0	0	0	112.1	L255 L338 L339 Q345 L346 L362 L367 W370	L255-L342 HydrophobicContact CD2-CB 3.96Å; L255-L342 HydrophobicContact CD2-CD1 4.19Å; L338-L342 HydrophobicContact CG-CD1 4.19Å; L338-L342 PolarHBondContact O-N 3.44Å; L339-L342 HydrophobicContact CD2-CD1 4.19Å; L339-L342 PolarHBondContact O-N 3.43Å; L342-Q345 PolarHBondContact O-N 3.01Å; L342-L346 PolarHBondContact O-N 3.4Å; L342-L362 HydrophobicContact CD2-CD1 3.91Å; L342-L362 HydrophobicContact CD2-CD2 4.39Å; L342-L367 HydrophobicContact CD1-CD1 4Å; L342-L367 HydrophobicContact CD2-CD1 3.73Å; L342-L367 HydrophobicContact CG-CD1 4.5Å; L342-W370 HydrophobicContact CD2-CE3 3.78Å; L342-W370 HydrophobicContact CD2-CZ3 4.26Å
343	H	83.4	Confident	78.1	Confident	88 Å²	88	77.3 Å²	77.3	41%	0.407	39%	0.388	S	S	.	.	H	α-helix	trans	-68	-38.7	178.2	-168.3	56.3	0	0	0	112.4	L339 S340 Q345 L346 Q347	L339-H343 WeakPolarHBondContact O-CB 3.44Å; L339-H343 PolarHBondContact O-N 3.47Å; S340-H343 PolarHBondContact O-N 3.42Å; H343-Q345 VanDerWaalsContact C-N 3.32Å; H343-Q345 PolarHBondContact O-N 2.89Å; H343-L346 PolarHBondContact O-N 3.47Å; H343-Q347 PolarHBondContact O-N 3.31Å
344	S	82.6	Confident	76	Confident	64 Å²	64	73.9 Å²	73.9	45%	0.448	39%	0.39	S	S	.	.	H	α-helix	trans	-62.7	-36.8	175.7	-179.1	0	0	0	0	112.6	S340 V341 Q347 L348	S340-S344 WeakPolarHBondContact O-CB 3.4Å; S340-S344 PolarHBondContact O-N 3.24Å; V341-S344 PolarHBondContact O-N 2.93Å; S344-Q347 PolarHBondContact O-N 2.97Å; S344-L348 WeakPolarHBondContact O-CG 3.39Å; S344-L348 PolarHBondContact O-N 3.21Å; S344-L348 VanDerWaalsContact O-N 3.09Å
345	Q	78.1	Confident	74.3	Confident	53 Å²	53	77.4 Å²	77.4	25%	0.248	41%	0.411	C	S	.	.	H	α-helix	trans	-70.3	-41.9	176.3	-71	178	14.5	0	0	112.1	V341 L342 H343 Q347 L348 E349	V341-Q345 PolarHBondContact O-N 3.49Å; L342-Q345 PolarHBondContact O-N 3.01Å; H343-Q345 VanDerWaalsContact C-N 3.32Å; H343-Q345 PolarHBondContact O-N 2.89Å; Q345-Q347 VanDerWaalsContact C-N 3.29Å; Q345-Q347 PolarHBondContact O-N 3.21Å; Q345-L348 PolarHBondContact O-N 3.15Å; Q345-E349 PolarHBondContact O-N 3.42Å; Q345-E349 VanDerWaalsContact O-N 3.08Å
346	L	76.3	Confident	72	Confident	13 Å²	13	84.1 Å²	84.1	7%	0.068	45%	0.447	C	S	.	.	H	α-helix	trans	-57.9	-41.5	172.3	174.9	66.4	0	0	0	111.9	V251 R252 L255 L342 H343 E349 D350	V251-L346 HydrophobicContact CG1-CD1 4.48Å; R252-L346 HydrophobicContact CB-CD2 4.4Å; R252-L346 HydrophobicContact CG-CD1 4.09Å; R252-L346 HydrophobicContact CG-CD2 3.75Å; R252-L346 HydrophobicContact CG-CG 4.5Å; L255-L346 HydrophobicContact CD1-CB 4.46Å; L255-L346 HydrophobicContact CD1-CD2 3.78Å; L342-L346 PolarHBondContact O-N 3.4Å; H343-L346 PolarHBondContact O-N 3.47Å; L346-E349 PolarHBondContact O-N 3.42Å; L346-D350 PolarHBondContact O-N 2.96Å; L346-D350 VanDerWaalsContact O-N 3.07Å
347	Q	71.9	Confident	69.8	Low	106 Å²	106	82.5 Å²	82.5	50%	0.495	46%	0.459	S	S	.	.	H	α-helix	trans	-66.7	-39.2	178	-173.2	175.3	-10.6	0	0	112.1	H343 S344 Q345 E349 D350 D351	H343-Q347 PolarHBondContact O-N 3.31Å; S344-Q347 PolarHBondContact O-N 2.97Å; Q345-Q347 VanDerWaalsContact C-N 3.29Å; Q345-Q347 PolarHBondContact O-N 3.21Å; Q347-E349 VanDerWaalsContact C-N 3.28Å; Q347-E349 PolarHBondContact O-N 3.32Å; Q347-D350 PolarHBondContact O-N 3.44Å; Q347-D351 WeakPolarHBondContact O-CB 3.43Å; Q347-D351 PolarHBondContact O-N 2.86Å
348	L	70.3	Confident	68	Low	88 Å²	88	82.5 Å²	82.5	46%	0.461	47%	0.47	S	S	.	.	H	α-helix	trans	-63.5	-32.1	174.5	-71.8	167.1	0	0	0	112.8	S344 Q345 Q352	S344-L348 WeakPolarHBondContact O-CG 3.39Å; S344-L348 PolarHBondContact O-N 3.21Å; S344-L348 VanDerWaalsContact O-N 3.09Å; Q345-L348 PolarHBondContact O-N 3.15Å; L348-Q352 WeakPolarHBondContact O-CB 3.38Å; L348-Q352 WeakPolarHBondContact O-CG 3.28Å; L348-Q352 PolarHBondContact O-N 3.2Å
349	E	63.5	Low	66.2	Low	71 Å²	71	88.5 Å²	88.5	33%	0.332	50%	0.497	S	S	.	.	H	α-helix	trans	-71	-36.4	172.4	-73.2	176.5	-140.6	0	0	112.7	Q345 L346 Q347 S361 L362	Q345-E349 PolarHBondContact O-N 3.42Å; Q345-E349 VanDerWaalsContact O-N 3.08Å; L346-E349 PolarHBondContact O-N 3.42Å; Q347-E349 VanDerWaalsContact C-N 3.28Å; Q347-E349 PolarHBondContact O-N 3.32Å; E349-S361 WeakPolarHBondContact OE1-CA 3.36Å; E349-L362 WeakPolarHBondContact OE1-CB 3.49Å; E349-L362 PolarHBondContact OE1-N 3.12Å; E349-L362 PolarHBondContact OE2-N 3.01Å
350	D	62.4	Low	64.6	Low	86 Å²	86	91 Å²	91	46%	0.46	52%	0.515	S	S	.	.	H	α-helix	trans	-74.7	-32.6	177.7	-82	-25.6	0	0	0	112.7	R252 L346 Q347	R252-D350 IonicContact CZ-OD1 3.39Å; R252-D350 IonicContact CZ-OD2 3.85Å; R252-D350 IonicContact NE-OD1 3.84Å; R252-D350 IonicContact NE-OD2 3.91Å; R252-D350 PolarHBondContact NE-OD2 3.31Å; R252-D350 IonicContact NH2-OD1 2.62Å; R252-D350 PolarHBondContact NH2-OD1 2.92Å; R252-D350 IonicContact NH2-OD2 3.72Å; R252-D350 PolarHBondContact NH2-OD2 3.1Å; L346-D350 PolarHBondContact O-N 2.96Å; L346-D350 VanDerWaalsContact O-N 3.07Å; Q347-D350 PolarHBondContact O-N 3.44Å
351	D	59.3	Low	63.5	Low	115 Å²	115	89.5 Å²	89.5	62%	0.615	51%	0.505	S	S	*	.	H	α-helix	trans	-81.3	-28	178.3	-75.2	-31.3	0	0	0	113.7	Q347	Q347-D351 WeakPolarHBondContact O-CB 3.43Å; Q347-D351 PolarHBondContact O-N 2.86Å
352	Q	56.3	Low	62.8	Low	135 Å²	135	86.7 Å²	86.7	63%	0.631	49%	0.487	S	S	*	.	S	Bend	trans	-105.5	49.2	-174.9	-60.5	-171.5	12	0	0	113.7	L348 V354	L348-Q352 WeakPolarHBondContact O-CB 3.38Å; L348-Q352 WeakPolarHBondContact O-CG 3.28Å; L348-Q352 PolarHBondContact O-N 3.2Å; Q352-V354 PolarHBondContact O-N 3.46Å
353	G	55.6	Low	62.6	Low	63 Å²	63	89.1 Å²	89.1	65%	0.649	50%	0.502	S	S	*	.			trans	-51.7	124.8	-177.9	0	0	0	0	0	114.3
354	V	46.5	Very low	62.3	Low	128 Å²	128	85 Å²	85	78%	0.776	48%	0.483	S	S	*	.	S	Bend	trans	97.2	100	-179.7	-173.8	0	0	0	0	116	Q352	Q352-V354 PolarHBondContact O-N 3.46Å
355	N	52.3	Low	62.2	Low	154 Å²	154	89.2 Å²	89.2	82%	0.824	49%	0.489	S	S	*	.			trans	43	85.6	148.9	-65.7	-41.2	0	0	0	118.6
356	L	40.8	Very low	62.4	Low	154 Å²	154	89.7 Å²	89.7	81%	0.806	49%	0.489	S	S	*	.			trans	-134.8	98.6	155.6	-152.2	77.6	0	0	0	112.8	S360	L356-S360 PolarHBondContact O-OG 3.05Å; L356-S360 VanDerWaalsContact O-OG 3.11Å
357	G	45	Very low	62.7	Low	59 Å²	59	89.1 Å²	89.1	61%	0.608	49%	0.486	S	S	*	.			trans	78.3	138.4	170.5	0	0	0	0	0	115.6	E359 S360	G357-E359 PolarHBondContact O-N 2.7Å; G357-S360 PolarHBondContact O-OG 3.24Å
358	L	51.8	Low	63.3	Low	164 Å²	164	86.3 Å²	86.3	86%	0.859	47%	0.474	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-8.8	170.1	-157.5	70.4	0	0	0	112.1
359	E	50	Low	64.1	Low	171 Å²	171	87.1 Å²	87.1	80%	0.799	48%	0.482	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-13.2	-169.6	-56.7	-174.6	158.8	0	0	113.9	G357 R366	G357-E359 PolarHBondContact O-N 2.7Å; E359-R366 VanDerWaalsContact O-CZ 3.25Å; E359-R366 PolarHBondContact O-NH1 3.39Å; E359-R366 PolarHBondContact O-NH2 2.82Å
360	S	53.5	Low	65.2	Low	63 Å²	63	88 Å²	88	44%	0.441	48%	0.482	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-50.3	179.3	50.5	0	0	0	0	112.7	L356 G357 R366	L356-S360 PolarHBondContact O-OG 3.05Å; L356-S360 VanDerWaalsContact O-OG 3.11Å; G357-S360 PolarHBondContact O-OG 3.24Å; S360-R366 VanDerWaalsContact C-NH1 3.27Å; S360-R366 PolarHBondContact O-NH1 3.14Å
361	S	63.8	Low	66.2	Low	38 Å²	38	84.1 Å²	84.1	27%	0.266	46%	0.462	S	S	.	.			trans	-50.3	136.8	-167.5	64.3	0	0	0	0	117	E349 T363 R366	E349-S361 WeakPolarHBondContact OE1-CA 3.36Å; S361-T363 PolarHBondContact O-N 3.39Å; S361-T363 VanDerWaalsContact O-N 3.16Å; S361-R366 VanDerWaalsContact O-CD 3.25Å; S361-R366 WeakPolarHBondContact O-CD 3.29Å; S361-R366 PolarHBondContact O-NH1 3.11Å
362	L	71.1	Confident	67.6	Low	6 Å²	6	86.2 Å²	86.2	3%	0.031	46%	0.462	C	S	.	.			trans	-88.2	58.4	-177.4	-158.2	83.2	0	0	0	113.3	V251 L342 E349 W370	V251-L362 HydrophobicContact CG1-CD2 3.82Å; L342-L362 HydrophobicContact CD2-CD1 3.91Å; L342-L362 HydrophobicContact CD2-CD2 4.39Å; E349-L362 WeakPolarHBondContact OE1-CB 3.49Å; E349-L362 PolarHBondContact OE1-N 3.12Å; E349-L362 PolarHBondContact OE2-N 3.01Å; L362-W370 HydrophobicContact CD1-CZ3 4.31Å
363	T	80.9	Confident	69	Low	53 Å²	53	83.6 Å²	83.6	33%	0.325	45%	0.453	S	S	.	.			trans	-58.5	153.1	175.8	65.4	0	0	0	0	112.9	S361 R365 R366 L367	S361-T363 PolarHBondContact O-N 3.39Å; S361-T363 VanDerWaalsContact O-N 3.16Å; T363-R365 PolarHBondContact O-N 3.41Å; T363-R365 VanDerWaalsContact O-N 3.08Å; T363-R366 WeakPolarHBondContact O-CB 3.48Å; T363-R366 PolarHBondContact O-N 2.97Å; T363-R366 PolarHBondContact OG1-N 3.08Å; T363-L367 PolarHBondContact O-N 2.94Å
364	L	76.6	Confident	70.5	Confident	1 Å²	1	81.5 Å²	81.5	1%	0.005	43%	0.428	C	S	.	.	H	α-helix	trans	-57.9	-26	175.8	-69.5	171.7	0	0	0	112.6	E247 L250 V251 I254 L287 L294 L368	E247-L364 HydrophobicContact CG-CD1 3.76Å; E247-L364 HydrophobicContact CG-CG 3.78Å; E247-L364 WeakPolarHBondContact OE1-CB 3.4Å; E247-L364 WeakPolarHBondContact OE1-CG 3.43Å; E247-L364 PolarHBondContact OE1-N 2.84Å; L250-L364 HydrophobicContact CB-CD1 4.49Å; L250-L364 HydrophobicContact CD1-CD1 4.22Å; V251-L364 HydrophobicContact CG2-CD2 3.68Å; V251-L364 HydrophobicContact CG2-CG 4Å; I254-L364 HydrophobicContact CD1-CD2 3.56Å; L287-L364 HydrophobicContact CD2-CD1 3.69Å; L294-L364 HydrophobicContact CD1-CD2 4.03Å; L364-L368 WeakPolarHBondContact O-CB 3.44Å; L364-L368 PolarHBondContact O-N 3.38Å; L364-L368 VanDerWaalsContact O-N 3.08Å
365	R	79.6	Confident	72.5	Confident	152 Å²	152	77.3 Å²	77.3	57%	0.574	40%	0.399	S	S	*	.	H	α-helix	trans	-74.1	-41.7	174.7	-63.5	-60.4	-176.8	168.6	-0.6	112.2	T363 L368 V369	T363-R365 PolarHBondContact O-N 3.41Å; T363-R365 VanDerWaalsContact O-N 3.08Å; R365-L368 PolarHBondContact O-N 3.38Å; R365-V369 PolarHBondContact O-N 2.99Å
366	R	82.3	Confident	74.1	Confident	64 Å²	64	73 Å²	73	24%	0.242	38%	0.375	C	S	.	.	H	α-helix	trans	-62.9	-47.1	172.5	-172.3	-171.1	-163.9	126.8	4.1	110.9	E359 S360 S361 T363 L368 V369 W370	E359-R366 VanDerWaalsContact O-CZ 3.25Å; E359-R366 PolarHBondContact O-NH1 3.39Å; E359-R366 PolarHBondContact O-NH2 2.82Å; S360-R366 VanDerWaalsContact C-NH1 3.27Å; S360-R366 PolarHBondContact O-NH1 3.14Å; S361-R366 VanDerWaalsContact O-CD 3.25Å; S361-R366 WeakPolarHBondContact O-CD 3.29Å; S361-R366 PolarHBondContact O-NH1 3.11Å; T363-R366 WeakPolarHBondContact O-CB 3.48Å; T363-R366 PolarHBondContact O-N 2.97Å; T363-R366 PolarHBondContact OG1-N 3.08Å; R366-L368 VanDerWaalsContact C-N 3.28Å; R366-L368 PolarHBondContact O-N 3.42Å; R366-V369 PolarHBondContact O-N 2.89Å; R366-V369 VanDerWaalsContact O-N 3.08Å; R366-W370 HydrophobicContact CG-CD2 4.35Å; R366-W370 HydrophobicContact CG-CZ2 4.25Å; R366-W370 PolarHBondContact O-N 3.07Å
367	L	83.2	Confident	76.4	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-57.6	-39.6	177	-170.1	62.9	0	0	0	112	I254 F258 L294 L342 T363 V369 W370 T371	I254-L367 HydrophobicContact CG2-CD2 3.95Å; F258-L367 HydrophobicContact CE2-CD1 4.12Å; F258-L367 HydrophobicContact CE2-CD2 4.37Å; F258-L367 HydrophobicContact CE2-CG 4.36Å; F258-L367 HydrophobicContact CZ-CD2 4.43Å; L294-L367 HydrophobicContact CD1-CD2 4.27Å; L294-L367 HydrophobicContact CD2-CG 4.28Å; L342-L367 HydrophobicContact CD1-CD1 4Å; L342-L367 HydrophobicContact CD2-CD1 3.73Å; L342-L367 HydrophobicContact CG-CD1 4.5Å; T363-L367 PolarHBondContact O-N 2.94Å; L367-V369 PolarHBondContact O-N 3.18Å; L367-W370 PolarHBondContact O-N 3.22Å; L367-T371 HydrophobicContact CD1-CG2 4.21Å; L367-T371 HydrophobicContact CG-CG2 4.41Å; L367-T371 WeakPolarHBondContact O-CB 3.42Å; L367-T371 VanDerWaalsContact O-CG2 3.29Å; L367-T371 WeakPolarHBondContact O-CG2 3.25Å; L367-T371 PolarHBondContact O-N 3.42Å; L367-T371 PolarHBondContact O-OG1 3.31Å
368	L	85	Confident	78.5	Confident	48 Å²	48	66.7 Å²	66.7	25%	0.251	32%	0.323	S	S	.	.	H	α-helix	trans	-65.9	-32.3	176.4	-175.5	65.1	0	0	0	113.8	T290 L294 L364 R365 R366	T290-L368 HydrophobicContact CG2-CD2 4.43Å; L294-L368 HydrophobicContact CD2-CB 4.23Å; L294-L368 HydrophobicContact CD2-CD1 3.95Å; L294-L368 HydrophobicContact CG-CD1 4.34Å; L364-L368 WeakPolarHBondContact O-CB 3.44Å; L364-L368 PolarHBondContact O-N 3.38Å; L364-L368 VanDerWaalsContact O-N 3.08Å; R365-L368 PolarHBondContact O-N 3.38Å; R366-L368 VanDerWaalsContact C-N 3.28Å; R366-L368 PolarHBondContact O-N 3.42Å
369	V	86.4	Confident	80.3	Confident	105 Å²	105	64.2 Å²	64.2	64%	0.636	31%	0.305	S	S	*	.	H	α-helix	trans	-74.7	-45.8	173.6	177.1	0	0	0	0	110.5	R365 R366 L367 T371 Y372	R365-V369 PolarHBondContact O-N 2.99Å; R366-V369 PolarHBondContact O-N 2.89Å; R366-V369 VanDerWaalsContact O-N 3.08Å; L367-V369 PolarHBondContact O-N 3.18Å; V369-T371 VanDerWaalsContact C-N 3.29Å; V369-T371 PolarHBondContact O-N 2.96Å; V369-Y372 WeakPolarHBondContact O-CB 3.44Å; V369-Y372 PolarHBondContact O-N 3.44Å; V369-Y372 VanDerWaalsContact O-N 3.14Å
370	W	85.8	Confident	82.2	Confident	88 Å²	88	56.6 Å²	56.6	33%	0.333	27%	0.27	S	S	.	.	H	α-helix	trans	-70.4	-24.2	-177.1	-69.9	15.6	0	0	0	113.6	L342 L362 R366 L367	L342-W370 HydrophobicContact CD2-CE3 3.78Å; L342-W370 HydrophobicContact CD2-CZ3 4.26Å; L362-W370 HydrophobicContact CD1-CZ3 4.31Å; R366-W370 HydrophobicContact CG-CD2 4.35Å; R366-W370 HydrophobicContact CG-CZ2 4.25Å; R366-W370 PolarHBondContact O-N 3.07Å; L367-W370 PolarHBondContact O-N 3.22Å
371	T	85.4	Confident	84	Confident	5 Å²	5	53.8 Å²	53.8	3%	0.031	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-3.3	173.5	53.1	0	0	0	0	113.8	F258 L294 L297 L367 V369 K375	F258-T371 HydrophobicContact CE2-CG2 3.57Å; F258-T371 HydrophobicContact CZ-CG2 3.76Å; L294-T371 WeakPolarHBondContact CD2-OG1 3.49Å; L297-T371 HydrophobicContact CD2-CG2 3.82Å; L367-T371 HydrophobicContact CD1-CG2 4.21Å; L367-T371 HydrophobicContact CG-CG2 4.41Å; L367-T371 WeakPolarHBondContact O-CB 3.42Å; L367-T371 VanDerWaalsContact O-CG2 3.29Å; L367-T371 WeakPolarHBondContact O-CG2 3.25Å; L367-T371 PolarHBondContact O-N 3.42Å; L367-T371 PolarHBondContact O-OG1 3.31Å; V369-T371 VanDerWaalsContact C-N 3.29Å; V369-T371 PolarHBondContact O-N 2.96Å; T371-K375 WeakPolarHBondContact O-CB 3.42Å; T371-K375 PolarHBondContact O-N 2.99Å
372	Y	86.8	Confident	85.2	Confident	159 Å²	159	52.1 Å²	52.1	62%	0.624	24%	0.239	S	C	*	.	H	α-helix	trans	-62.8	-54.1	-174.7	-177	-97.7	0	0	0	113.3	V369 K375 I376	V369-Y372 WeakPolarHBondContact O-CB 3.44Å; V369-Y372 PolarHBondContact O-N 3.44Å; V369-Y372 VanDerWaalsContact O-N 3.14Å; Y372-K375 WeakPolarHBondContact O-CB 3.44Å; Y372-K375 PolarHBondContact O-N 2.65Å; Y372-I376 HydrophobicContact CD1-CD1 4.01Å; Y372-I376 HydrophobicContact CE1-CD1 3.49Å; Y372-I376 VanDerWaalsContact CE1-CD1 3.49Å; Y372-I376 HydrophobicContact CE2-CD1 4.49Å; Y372-I376 PolarHBondContact O-N 2.98Å
373	D	86.3	Confident	86.1	Confident	81 Å²	81	53.5 Å²	53.5	43%	0.433	25%	0.251	S	S	.	.	H	α-helix	trans	-63.6	-50.2	176.6	167.2	88.5	0	0	0	112.6	K375 I376 R377	D373-K375 PolarHBondContact O-N 3.1Å; D373-K375 VanDerWaalsContact O-N 3.15Å; D373-I376 PolarHBondContact O-N 3.35Å; D373-R377 PolarHBondContact O-N 2.92Å
374	P	88.2	Confident	86.5	Confident	18 Å²	18	51 Å²	51	12%	0.117	24%	0.236	C	C	.	.	H	α-helix	trans	-53.4	-36.7	172.9	-27.2	31.3	0	0	0	113.4	Y335 L338 R377 L378	Y335-P374 HydrophobicContact CD2-CB 4.4Å; L338-P374 HydrophobicContact CD2-CB 4.18Å; L338-P374 HydrophobicContact CD2-CG 3.27Å; P374-R377 PolarHBondContact O-N 3.43Å; P374-L378 WeakPolarHBondContact O-CB 3.47Å; P374-L378 PolarHBondContact O-N 3.46Å
375	K	86.7	Confident	87.1	Confident	41 Å²	41	51 Å²	51	18%	0.178	24%	0.236	C	C	.	.	H	α-helix	trans	-66.9	-36.9	177.4	-174.2	171	-177.7	173.7	0	112.3	R293 E296 L297 T371 Y372 D373 K379	R293-K375 PolarHBondContact O-NZ 3.37Å; E296-K375 WeakPolarHBondContact OE1-CE 3.32Å; E296-K375 IonicContact OE1-NZ 2.88Å; E296-K375 WeakPolarHBondContact OE2-CE 3.3Å; E296-K375 IonicContact OE2-NZ 3.68Å; E296-K375 PolarHBondContact OE2-NZ 2.7Å; L297-K375 HydrophobicContact CD1-CB 3.92Å; L297-K375 HydrophobicContact CD1-CG 4.35Å; T371-K375 WeakPolarHBondContact O-CB 3.42Å; T371-K375 PolarHBondContact O-N 2.99Å; Y372-K375 WeakPolarHBondContact O-CB 3.44Å; Y372-K375 PolarHBondContact O-N 2.65Å; D373-K375 PolarHBondContact O-N 3.1Å; D373-K375 VanDerWaalsContact O-N 3.15Å; K375-K379 WeakPolarHBondContact O-CB 3.33Å; K375-K379 PolarHBondContact O-N 3.41Å
376	I	87.1	Confident	87.6	Confident	63 Å²	63	47.2 Å²	47.2	32%	0.323	23%	0.227	S	C	.	.	H	α-helix	trans	-68.7	-46.2	175.1	-66.7	168.9	0	0	0	110.4	Y372 D373 K379 T380	Y372-I376 HydrophobicContact CD1-CD1 4.01Å; Y372-I376 HydrophobicContact CE1-CD1 3.49Å; Y372-I376 VanDerWaalsContact CE1-CD1 3.49Å; Y372-I376 HydrophobicContact CE2-CD1 4.49Å; Y372-I376 PolarHBondContact O-N 2.98Å; D373-I376 PolarHBondContact O-N 3.35Å; I376-K379 PolarHBondContact O-N 2.72Å; I376-T380 PolarHBondContact O-N 3.48Å; I376-T380 PolarHBondContact O-OG1 3.07Å
377	R	87.8	Confident	87.8	Confident	74 Å²	74	47.2 Å²	47.2	28%	0.279	23%	0.23	S	C	.	.	H	α-helix	trans	-58.5	-54.7	175.4	-66.2	-177	69.7	159.4	-6.1	111.3	E331 E334 D373 P374 K379 T380 L381 L414	E331-R377 VanDerWaalsContact CD-NH2 3.25Å; E331-R377 IonicContact OE1-NH2 3.14Å; E331-R377 PolarHBondContact OE1-NH2 2.97Å; E331-R377 IonicContact OE2-CZ 2.72Å; E331-R377 IonicContact OE2-NE 2.72Å; E331-R377 PolarHBondContact OE2-NE 3.2Å; E331-R377 IonicContact OE2-NH2 2.96Å; E331-R377 PolarHBondContact OE2-NH2 3.05Å; E334-R377 IonicContact OE2-CZ 3.65Å; E334-R377 VanDerWaalsContact OE2-CZ 3.29Å; E334-R377 IonicContact OE2-NH1 3.84Å; E334-R377 PolarHBondContact OE2-NH1 3.03Å; E334-R377 VanDerWaalsContact OE2-NH1 3.14Å; E334-R377 IonicContact OE2-NH2 3.53Å; E334-R377 PolarHBondContact OE2-NH2 3.07Å; D373-R377 PolarHBondContact O-N 2.92Å; P374-R377 PolarHBondContact O-N 3.43Å; R377-K379 VanDerWaalsContact C-N 3.27Å; R377-K379 PolarHBondContact O-N 2.72Å; R377-T380 WeakPolarHBondContact O-CB 3.4Å; R377-T380 PolarHBondContact O-N 2.84Å; R377-L381 WeakPolarHBondContact O-CG 3.3Å; R377-L381 PolarHBondContact O-N 3.12Å; R377-L414 HydrophobicContact CB-CD2 4.08Å; R377-L414 HydrophobicContact CG-CD2 4.22Å
378	L	89.8	Confident	87.8	Confident	6 Å²	6	47.2 Å²	47.2	3%	0.031	23%	0.23	C	C	.	.	H	α-helix	trans	-65.1	-28.8	-177.1	-152.7	68.9	0	0	0	112.7	L297 L300 H301 I304 L332 P374 L381 A382	L297-L378 HydrophobicContact CD1-CB 4.41Å; L297-L378 HydrophobicContact CD1-CD2 3.78Å; L297-L378 HydrophobicContact CG-CD2 4.25Å; L297-L378 WeakPolarHBondContact O-CD2 3.47Å; L300-L378 HydrophobicContact CB-CB 4.39Å; L300-L378 HydrophobicContact CB-CD2 3.78Å; L300-L378 HydrophobicContact CB-CG 3.86Å; H301-L378 HydrophobicContact CB-CD2 4.11Å; I304-L378 HydrophobicContact CD1-CD1 3.49Å; I304-L378 VanDerWaalsContact CD1-CD1 3.49Å; I304-L378 HydrophobicContact CD1-CG 3.79Å; L332-L378 HydrophobicContact CD1-CD1 4.43Å; P374-L378 WeakPolarHBondContact O-CB 3.47Å; P374-L378 PolarHBondContact O-N 3.46Å; L378-L381 HydrophobicContact CD1-CD1 4.32Å; L378-A382 WeakPolarHBondContact O-CB 3.47Å; L378-A382 PolarHBondContact O-N 2.99Å
379	K	90.8	Very high	87.7	Confident	113 Å²	113	50.1 Å²	50.1	49%	0.491	24%	0.242	S	C	.	.	H	α-helix	trans	-72	-38.6	172	-170.5	165.2	-166	147.3	0	112.7	E296 L300 K375 I376 R377 A382 A383	E296-K379 IonicContact OE1-NZ 3.94Å; E296-K379 PolarHBondContact OE1-NZ 2.89Å; L300-K379 HydrophobicContact CD1-CB 4.05Å; K375-K379 WeakPolarHBondContact O-CB 3.33Å; K375-K379 PolarHBondContact O-N 3.41Å; I376-K379 PolarHBondContact O-N 2.72Å; R377-K379 VanDerWaalsContact C-N 3.27Å; R377-K379 PolarHBondContact O-N 2.72Å; K379-A382 PolarHBondContact O-N 3.22Å; K379-A383 PolarHBondContact O-N 3.21Å
380	T	89.7	Confident	87.4	Confident	10 Å²	10	48.3 Å²	48.3	6%	0.061	24%	0.244	C	C	.	.	H	α-helix	trans	-63.3	-45.6	172.8	-58.2	0	0	0	0	110.8	I376 R377 A382 A383 L384 M411 L414 V415	I376-T380 PolarHBondContact O-N 3.48Å; I376-T380 PolarHBondContact O-OG1 3.07Å; R377-T380 WeakPolarHBondContact O-CB 3.4Å; R377-T380 PolarHBondContact O-N 2.84Å; T380-A382 PolarHBondContact O-N 3.31Å; T380-A383 PolarHBondContact O-N 2.96Å; T380-L384 WeakPolarHBondContact O-CB 3.18Å; T380-L384 PolarHBondContact O-N 3.24Å; T380-M411 HydrophobicContact CG2-CB 4.42Å; T380-M411 HydrophobicContact CG2-CE 4.02Å; T380-M411 HydrophobicContact CG2-CG 4.2Å; T380-L414 HydrophobicContact CG2-CD2 4.07Å; T380-V415 HydrophobicContact CG2-CG2 4.16Å
381	L	90	Very high	87.4	Confident	4 Å²	4	46.9 Å²	46.9	2%	0.021	24%	0.239	C	C	.	.	H	α-helix	trans	-61.6	-42.6	175.8	-64.7	173.3	0	0	0	112.5	I304 L328 E331 R377 L378 L384 V385 L414 I418	I304-L381 HydrophobicContact CD1-CB 3.55Å; I304-L381 HydrophobicContact CD1-CD1 4.46Å; I304-L381 HydrophobicContact CG1-CB 4.36Å; L328-L381 HydrophobicContact CD2-CD2 4.06Å; E331-L381 HydrophobicContact CB-CD1 3.64Å; E331-L381 HydrophobicContact CG-CD1 4.05Å; E331-L381 HydrophobicContact CG-CD2 4.17Å; R377-L381 WeakPolarHBondContact O-CG 3.3Å; R377-L381 PolarHBondContact O-N 3.12Å; L378-L381 HydrophobicContact CD1-CD1 4.32Å; L381-L384 PolarHBondContact O-N 2.9Å; L381-V385 WeakPolarHBondContact O-CB 3.37Å; L381-V385 WeakPolarHBondContact O-CG2 3.47Å; L381-V385 PolarHBondContact O-N 3Å; L381-L414 HydrophobicContact CD2-CD1 4.32Å; L381-L414 HydrophobicContact CD2-CD2 4.35Å; L381-L414 HydrophobicContact CD2-CG 4.5Å; L381-L414 HydrophobicContact CG-CD2 4.36Å; L381-I418 HydrophobicContact CD2-CD1 3.41Å; L381-I418 VanDerWaalsContact CD2-CD1 3.41Å
382	A	89.9	Confident	87.4	Confident	4 Å²	4	49.1 Å²	49.1	3%	0.033	25%	0.248	C	C	.	.	H	α-helix	trans	-65.3	-38.5	177.3	0	0	0	0	0	112.8	L300 K303 I304 L378 K379 T380 V385 D386	L300-A382 HydrophobicContact CD2-CB 3.5Å; L300-A382 VanDerWaalsContact CD2-CB 3.5Å; K303-A382 HydrophobicContact CD-CB 4.44Å; I304-A382 HydrophobicContact CD1-CB 4.38Å; I304-A382 HydrophobicContact CG1-CB 4.39Å; L378-A382 WeakPolarHBondContact O-CB 3.47Å; L378-A382 PolarHBondContact O-N 2.99Å; K379-A382 PolarHBondContact O-N 3.22Å; T380-A382 PolarHBondContact O-N 3.31Å; A382-V385 PolarHBondContact O-N 2.72Å; A382-D386 PolarHBondContact O-N 2.62Å
383	A	89.4	Confident	87.3	Confident	35 Å²	35	41.6 Å²	41.6	29%	0.289	22%	0.219	S	C	.	.	H	α-helix	trans	-68.5	-36.4	174.6	0	0	0	0	0	112.3	K379 T380 D386 H387 Y403	K379-A383 PolarHBondContact O-N 3.21Å; T380-A383 PolarHBondContact O-N 2.96Å; A383-D386 PolarHBondContact O-N 3.36Å; A383-H387 PolarHBondContact O-N 3.28Å; A383-H387 VanDerWaalsContact O-N 3.08Å; A383-Y403 HydrophobicContact CB-CE1 4.42Å
384	L	89.2	Confident	87.2	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-66.1	-44.4	174.1	-171.7	62.8	0	0	0	111.1	F324 T380 L381 D386 H387 C388 V400 Y403 I418	F324-L384 HydrophobicContact CE2-CD2 3.87Å; F324-L384 HydrophobicContact CE2-CG 4.14Å; F324-L384 HydrophobicContact CZ-CD2 4.31Å; F324-L384 HydrophobicContact CZ-CG 4.12Å; T380-L384 WeakPolarHBondContact O-CB 3.18Å; T380-L384 PolarHBondContact O-N 3.24Å; L381-L384 PolarHBondContact O-N 2.9Å; L384-D386 VanDerWaalsContact C-N 3.31Å; L384-D386 PolarHBondContact O-N 3.07Å; L384-H387 PolarHBondContact O-N 3.4Å; L384-H387 VanDerWaalsContact O-N 3.16Å; L384-C388 WeakPolarHBondContact O-CB 3.18Å; L384-C388 PolarHBondContact O-N 3.38Å; L384-C388 PolarHBondContact O-SG 3.26Å; L384-V400 HydrophobicContact CD1-CG2 4.2Å; L384-Y403 HydrophobicContact CD1-CD2 4.19Å; L384-Y403 HydrophobicContact CD1-CG 4.13Å; L384-I418 HydrophobicContact CD2-CD1 3.94Å; L384-I418 HydrophobicContact CD2-CG2 4.15Å
385	V	90.3	Very high	87.1	Confident	1 Å²	1	40.1 Å²	40.1	1%	0.006	21%	0.208	C	C	.	.	H	α-helix	trans	-57.3	-41.4	173.1	162	0	0	0	0	111.8	I304 Y307 F324 L328 L381 A382 C388 Q389	I304-V385 HydrophobicContact CG1-CG2 4.45Å; Y307-V385 HydrophobicContact CD1-CG1 3.99Å; Y307-V385 HydrophobicContact CD1-CG2 4.06Å; Y307-V385 HydrophobicContact CD2-CG1 3.64Å; Y307-V385 HydrophobicContact CE1-CG1 4.46Å; Y307-V385 HydrophobicContact CE1-CG2 4.36Å; Y307-V385 HydrophobicContact CE2-CG1 4.13Å; Y307-V385 HydrophobicContact CG-CG1 3.55Å; Y307-V385 HydrophobicContact CG-CG2 4.43Å; F324-V385 HydrophobicContact CZ-CG2 4.35Å; L328-V385 HydrophobicContact CD1-CG2 3.71Å; L328-V385 HydrophobicContact CD2-CG2 4.13Å; L381-V385 WeakPolarHBondContact O-CB 3.37Å; L381-V385 WeakPolarHBondContact O-CG2 3.47Å; L381-V385 PolarHBondContact O-N 3Å; A382-V385 PolarHBondContact O-N 2.72Å; V385-C388 PolarHBondContact O-N 3.11Å; V385-Q389 WeakPolarHBondContact O-CG 3.42Å; V385-Q389 PolarHBondContact O-N 2.95Å
386	D	89.4	Confident	87.2	Confident	72 Å²	72	38.2 Å²	38.2	39%	0.385	20%	0.2	S	C	.	.	H	α-helix	trans	-61.9	-45.8	173.6	-74.3	-32.9	0	0	0	112.5	K303 A382 A383 L384 C388 Q389	K303-D386 WeakPolarHBondContact CE-OD1 3.46Å; K303-D386 IonicContact NZ-OD1 3.33Å; K303-D386 PolarHBondContact NZ-OD1 2.93Å; K303-D386 IonicContact NZ-OD2 2.74Å; K303-D386 PolarHBondContact NZ-OD2 3.14Å; A382-D386 PolarHBondContact O-N 2.62Å; A383-D386 PolarHBondContact O-N 3.36Å; L384-D386 VanDerWaalsContact C-N 3.31Å; L384-D386 PolarHBondContact O-N 3.07Å; D386-C388 PolarHBondContact O-N 3.2Å; D386-Q389 PolarHBondContact O-N 3.14Å; D386-Q389 PolarHBondContact OD1-NE2 3.34Å
387	H	86.1	Confident	87.2	Confident	64 Å²	64	35.2 Å²	35.2	30%	0.296	18%	0.184	S	C	.	.	H	α-helix	trans	-68.2	-24.5	-179.8	-161.3	71.6	0	0	0	113.5	A383 L384 R391 Y403	A383-H387 PolarHBondContact O-N 3.28Å; A383-H387 VanDerWaalsContact O-N 3.08Å; L384-H387 PolarHBondContact O-N 3.4Å; L384-H387 VanDerWaalsContact O-N 3.16Å; H387-R391 PolarHBondContact CD2-NH2 2.97Å; H387-R391 PolarHBondContact CE1-NH2 2.9Å; H387-R391 PolarHBondContact NE2-NH2 2.94Å; H387-R391 PolarHBondContact O-NE 3.31Å; H387-R391 PolarHBondContact O-NH2 3.28Å; H387-Y403 HydrophobicContact CB-CE2 3.75Å; H387-Y403 AromaticContact CD2-CE2 3.55Å; H387-Y403 AromaticContact CG-CE2 3.55Å
388	C	84.7	Confident	87.3	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-89.4	-6.4	-178.6	-66.3	0	0	0	0	114.3	F324 L384 V385 D386 G390 R391 L396	F324-C388 HydrophobicContact CE1-CB 3.74Å; F324-C388 HydrophobicContact CZ-CB 4.08Å; L384-C388 WeakPolarHBondContact O-CB 3.18Å; L384-C388 PolarHBondContact O-N 3.38Å; L384-C388 PolarHBondContact O-SG 3.26Å; V385-C388 PolarHBondContact O-N 3.11Å; D386-C388 PolarHBondContact O-N 3.2Å; C388-G390 PolarHBondContact O-N 2.91Å; C388-R391 PolarHBondContact O-N 2.96Å; C388-L396 HydrophobicContact CB-CD1 3.45Å; C388-L396 VanDerWaalsContact CB-CD1 3.45Å; C388-L396 WeakPolarHBondContact SG-CD1 3.39Å
389	Q	82.7	Confident	87.2	Confident	108 Å²	108	32.5 Å²	32.5	51%	0.505	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.5	122.7	179.7	-82.7	164.1	44.8	0	0	111.9	Y307 V385 D386	Y307-Q389 HydrophobicContact CD2-CG 4.38Å; Y307-Q389 HydrophobicContact CE2-CG 3.95Å; V385-Q389 WeakPolarHBondContact O-CG 3.42Å; V385-Q389 PolarHBondContact O-N 2.95Å; D386-Q389 PolarHBondContact O-N 3.14Å; D386-Q389 PolarHBondContact OD1-NE2 3.34Å
390	G	79.4	Confident	87.1	Confident	67 Å²	67	27.1 Å²	27.1	69%	0.691	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.5	-8.7	175.5	0	0	0	0	0	115.8	C388	C388-G390 PolarHBondContact O-N 2.91Å
391	R	85	Confident	87	Confident	59 Å²	59	27.5 Å²	27.5	22%	0.223	16%	0.155	C	C	.	.			trans	-85.8	159.7	-178.4	-53.4	-168.9	-169	-128.6	18.4	112.8	H387 C388 E395 L396	H387-R391 PolarHBondContact CD2-NH2 2.97Å; H387-R391 PolarHBondContact CE1-NH2 2.9Å; H387-R391 PolarHBondContact NE2-NH2 2.94Å; H387-R391 PolarHBondContact O-NE 3.31Å; H387-R391 PolarHBondContact O-NH2 3.28Å; C388-R391 PolarHBondContact O-N 2.96Å; R391-E395 WeakPolarHBondContact CA-OE2 3.4Å; R391-E395 WeakPolarHBondContact CB-OE2 3.37Å; R391-E395 WeakPolarHBondContact CD-OE1 3.4Å; R391-E395 VanDerWaalsContact CG-OE1 3.31Å; R391-E395 WeakPolarHBondContact CG-OE1 3.34Å; R391-E395 WeakPolarHBondContact CG-OE2 3.47Å; R391-E395 IonicContact CZ-OE1 3.03Å; R391-E395 IonicContact NE-OE1 3.56Å; R391-E395 IonicContact NH1-OE1 2.74Å; R391-E395 PolarHBondContact NH1-OE1 3.38Å; R391-L396 HydrophobicContact CB-CB 4.31Å
392	K	85.2	Confident	86.8	Confident	52 Å²	52	29.5 Å²	29.5	23%	0.226	17%	0.173	C	C	.	.			trans	-143.9	154.6	-179.7	-178.8	164.9	176.5	170.8	0	112.6	S316 G394 E395 L396 Y443 E445	S316-K392 WeakPolarHBondContact O-CE 3.36Å; S316-K392 PolarHBondContact O-NZ 3.37Å; K392-G394 PolarHBondContact O-N 3.39Å; K392-E395 VanDerWaalsContact O-CB 3.27Å; K392-E395 WeakPolarHBondContact O-CB 3.28Å; K392-E395 PolarHBondContact O-N 2.95Å; K392-E395 VanDerWaalsContact O-N 3.1Å; K392-L396 PolarHBondContact O-N 3.41Å; K392-Y443 WeakPolarHBondContact CE-O 3.24Å; K392-Y443 PolarHBondContact NZ-O 2.77Å; K392-E445 HydrophobicContact CD-CG 4.43Å; K392-E445 VanDerWaalsContact CE-CG 3.45Å; K392-E445 HydrophobicContact CG-CG 4.05Å
393	G	85.3	Confident	86.6	Confident	0 Å²	0	32 Å²	32	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	54.9	-135.9	170.2	0	0	0	0	0	113.6	E395 L396 A397	G393-E395 PolarHBondContact O-N 2.85Å; G393-L396 WeakPolarHBondContact O-CB 3.46Å; G393-L396 PolarHBondContact O-N 3.04Å; G393-A397 PolarHBondContact O-N 3.43Å
394	G	84.6	Confident	86.4	Confident	1 Å²	1	31.2 Å²	31.2	1%	0.01	17%	0.173	C	C	.	.	H	α-helix	trans	-64.5	-16.2	178.2	0	0	0	0	0	115.5	K392 S398 M470	K392-G394 PolarHBondContact O-N 3.39Å; G394-S398 WeakPolarHBondContact O-CB 3.44Å; G394-S398 PolarHBondContact O-N 2.93Å; G394-S398 PolarHBondContact O-OG 3.39Å; G394-M470 WeakPolarHBondContact CA-O 3.49Å
395	E	86.1	Confident	86	Confident	68 Å²	68	37.8 Å²	37.8	32%	0.318	20%	0.201	S	C	.	.	H	α-helix	trans	-70.1	-38.7	170.5	-156.6	-136.8	150.6	0	0	111.1	R391 K392 G393 S398 A399	R391-E395 WeakPolarHBondContact CA-OE2 3.4Å; R391-E395 WeakPolarHBondContact CB-OE2 3.37Å; R391-E395 WeakPolarHBondContact CD-OE1 3.4Å; R391-E395 VanDerWaalsContact CG-OE1 3.31Å; R391-E395 WeakPolarHBondContact CG-OE1 3.34Å; R391-E395 WeakPolarHBondContact CG-OE2 3.47Å; R391-E395 IonicContact CZ-OE1 3.03Å; R391-E395 IonicContact NE-OE1 3.56Å; R391-E395 IonicContact NH1-OE1 2.74Å; R391-E395 PolarHBondContact NH1-OE1 3.38Å; K392-E395 VanDerWaalsContact O-CB 3.27Å; K392-E395 WeakPolarHBondContact O-CB 3.28Å; K392-E395 PolarHBondContact O-N 2.95Å; K392-E395 VanDerWaalsContact O-N 3.1Å; G393-E395 PolarHBondContact O-N 2.85Å; E395-S398 WeakPolarHBondContact O-CB 3.19Å; E395-S398 PolarHBondContact O-N 3.47Å; E395-A399 WeakPolarHBondContact O-CB 3.47Å; E395-A399 PolarHBondContact O-N 3.38Å
396	L	88.9	Confident	85.5	Confident	0 Å²	0	40 Å²	40	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-66.3	-43.8	173.3	179.9	62.3	0	0	0	110.9	F317 V320 F324 C388 R391 K392 G393 S398 A399 V400	F317-L396 HydrophobicContact CZ-CD2 4.18Å; V320-L396 HydrophobicContact CG1-CD2 4.34Å; F324-L396 HydrophobicContact CB-CD2 4.07Å; F324-L396 HydrophobicContact CD1-CD1 4.35Å; F324-L396 HydrophobicContact CD1-CD2 4.41Å; F324-L396 HydrophobicContact CG-CD2 4.43Å; C388-L396 HydrophobicContact CB-CD1 3.45Å; C388-L396 VanDerWaalsContact CB-CD1 3.45Å; C388-L396 WeakPolarHBondContact SG-CD1 3.39Å; R391-L396 HydrophobicContact CB-CB 4.31Å; K392-L396 PolarHBondContact O-N 3.41Å; G393-L396 WeakPolarHBondContact O-CB 3.46Å; G393-L396 PolarHBondContact O-N 3.04Å; L396-S398 VanDerWaalsContact C-N 3.29Å; L396-S398 PolarHBondContact O-N 2.62Å; L396-A399 WeakPolarHBondContact O-CB 3.27Å; L396-A399 PolarHBondContact O-N 2.8Å; L396-A399 VanDerWaalsContact O-N 3.16Å; L396-V400 WeakPolarHBondContact O-CG2 3.17Å; L396-V400 PolarHBondContact O-N 3.15Å; L396-V400 VanDerWaalsContact O-N 3.07Å
397	A	87.5	Confident	85	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-61	-37.8	174.1	0	0	0	0	0	112.3	G393 V400 H401 V422 P472 F474	G393-A397 PolarHBondContact O-N 3.43Å; A397-V400 PolarHBondContact O-N 3.12Å; A397-H401 WeakPolarHBondContact O-CB 3.39Å; A397-H401 PolarHBondContact O-N 3.38Å; A397-V422 HydrophobicContact CB-CG1 4.31Å; A397-P472 HydrophobicContact CB-CB 4.39Å; A397-F474 HydrophobicContact CB-CE1 4.21Å
398	S	88.9	Confident	85.1	Confident	22 Å²	22	39.6 Å²	39.6	15%	0.154	23%	0.231	C	C	.	.	H	α-helix	trans	-65.4	-38.6	174	-62.2	0	0	0	0	113	G394 E395 L396 H401 A402 I471 P472 S473	G394-S398 WeakPolarHBondContact O-CB 3.44Å; G394-S398 PolarHBondContact O-N 2.93Å; G394-S398 PolarHBondContact O-OG 3.39Å; E395-S398 WeakPolarHBondContact O-CB 3.19Å; E395-S398 PolarHBondContact O-N 3.47Å; L396-S398 VanDerWaalsContact C-N 3.29Å; L396-S398 PolarHBondContact O-N 2.62Å; S398-H401 PolarHBondContact O-N 3.01Å; S398-A402 WeakPolarHBondContact O-CB 3.45Å; S398-A402 PolarHBondContact O-N 3.45Å; S398-I471 PolarHBondContact OG-O 3.36Å; S398-P472 WeakPolarHBondContact OG-CA 3.39Å; S398-S473 WeakPolarHBondContact CA-OG 3.43Å; S398-S473 PolarHBondContact OG-N 3.09Å
399	A	88.2	Confident	85.1	Confident	2 Å²	2	43.3 Å²	43.3	2%	0.017	26%	0.256	C	S	.	.	H	α-helix	trans	-64.2	-39.3	177.1	0	0	0	0	0	111.9	E395 L396	E395-A399 WeakPolarHBondContact O-CB 3.47Å; E395-A399 PolarHBondContact O-N 3.38Å; L396-A399 WeakPolarHBondContact O-CB 3.27Å; L396-A399 PolarHBondContact O-N 2.8Å; L396-A399 VanDerWaalsContact O-N 3.16Å
400	V	88.8	Confident	85	Confident	0 Å²	0	46.5 Å²	46.5	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-69.7	-48.1	173.8	-178	0	0	0	0	111.1	F324 L384 L396 A397 A402 Y403 T404 V415 I418 L419	F324-V400 HydrophobicContact CE2-CG2 4.47Å; L384-V400 HydrophobicContact CD1-CG2 4.2Å; L396-V400 WeakPolarHBondContact O-CG2 3.17Å; L396-V400 PolarHBondContact O-N 3.15Å; L396-V400 VanDerWaalsContact O-N 3.07Å; A397-V400 PolarHBondContact O-N 3.12Å; V400-A402 PolarHBondContact O-N 3.33Å; V400-Y403 PolarHBondContact O-N 2.94Å; V400-T404 PolarHBondContact O-N 3.48Å; V400-V415 HydrophobicContact CG1-CG1 3.83Å; V400-V415 WeakPolarHBondContact O-CG1 3.49Å; V400-I418 HydrophobicContact CG1-CG2 4.25Å; V400-L419 HydrophobicContact CB-CD1 4.08Å; V400-L419 HydrophobicContact CG1-CB 3.88Å; V400-L419 HydrophobicContact CG1-CD1 3.99Å; V400-L419 HydrophobicContact CG1-CG 4.47Å
401	H	87.1	Confident	85.3	Confident	17 Å²	17	45.5 Å²	45.5	8%	0.079	24%	0.242	C	C	.	.	H	α-helix	trans	-60.6	-29.6	179.2	-174	63.1	0	0	0	113.9	A397 S398 Y403 T404 K405 L419 S473 F474 E527	A397-H401 WeakPolarHBondContact O-CB 3.39Å; A397-H401 PolarHBondContact O-N 3.38Å; S398-H401 PolarHBondContact O-N 3.01Å; H401-Y403 PolarHBondContact O-N 3.34Å; H401-T404 WeakPolarHBondContact O-CB 3.45Å; H401-T404 PolarHBondContact O-N 3.47Å; H401-K405 WeakPolarHBondContact NE2-CE 3.37Å; H401-K405 PolarHBondContact NE2-NZ 2.98Å; H401-L419 HydrophobicContact CB-CD1 4.27Å; H401-L419 HydrophobicContact CB-CD2 4.02Å; H401-S473 PolarHBondContact CD2-OG 3.09Å; H401-S473 PolarHBondContact NE2-O 3.29Å; H401-F474 HydrophobicContact CB-CD1 4.23Å; H401-E527 IonicContact CE1-OE1 2.66Å; H401-E527 PolarHBondContact CE1-OE1 2.96Å; H401-E527 IonicContact NE2-OE1 2.84Å
402	A	86.6	Confident	85.3	Confident	47 Å²	47	46.8 Å²	46.8	39%	0.388	25%	0.247	S	C	.	.	H	α-helix	trans	-60.6	-33.5	173.1	0	0	0	0	0	112.7	S398 V400	S398-A402 WeakPolarHBondContact O-CB 3.45Å; S398-A402 PolarHBondContact O-N 3.45Å; V400-A402 PolarHBondContact O-N 3.33Å
403	Y	85.9	Confident	85.3	Confident	56 Å²	56	47.7 Å²	47.7	22%	0.22	26%	0.26	C	S	.	.	H	α-helix	trans	-77.7	-27.2	177.7	-84.6	-112.5	0	0	0	112.8	A383 L384 H387 V400 H401 K405 T406	A383-Y403 HydrophobicContact CB-CE1 4.42Å; L384-Y403 HydrophobicContact CD1-CD2 4.19Å; L384-Y403 HydrophobicContact CD1-CG 4.13Å; H387-Y403 HydrophobicContact CB-CE2 3.75Å; H387-Y403 AromaticContact CD2-CE2 3.55Å; H387-Y403 AromaticContact CG-CE2 3.55Å; V400-Y403 PolarHBondContact O-N 2.94Å; H401-Y403 PolarHBondContact O-N 3.34Å; Y403-K405 PolarHBondContact O-N 3.29Å; Y403-T406 WeakPolarHBondContact O-CB 3.45Å; Y403-T406 WeakPolarHBondContact O-CG2 3.47Å; Y403-T406 PolarHBondContact O-N 2.99Å; Y403-T406 PolarHBondContact O-OG1 2.97Å
404	T	83.8	Confident	85.4	Confident	18 Å²	18	48.2 Å²	48.2	11%	0.11	26%	0.263	C	S	.	.	H	α-helix	trans	-58.6	-28.7	173.5	-44.2	0	0	0	0	112.2	V400 H401 T406 R412	V400-T404 PolarHBondContact O-N 3.48Å; H401-T404 WeakPolarHBondContact O-CB 3.45Å; H401-T404 PolarHBondContact O-N 3.47Å; T404-T406 PolarHBondContact O-N 3.22Å; T404-R412 HydrophobicContact CG2-CG 3.84Å; T404-R412 PolarHBondContact O-NE 3.37Å
405	K	81.1	Confident	85.6	Confident	139 Å²	139	48.1 Å²	48.1	60%	0.604	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.3	0.8	179	-61.9	176.8	-177.1	176.5	0	113.9	H401 Y403	H401-K405 WeakPolarHBondContact NE2-CE 3.37Å; H401-K405 PolarHBondContact NE2-NZ 2.98Å; Y403-K405 PolarHBondContact O-N 3.29Å
406	T	81.4	Confident	85.6	Confident	48 Å²	48	47.9 Å²	47.9	29%	0.294	26%	0.261	S	S	.	.	S	Bend	trans	-72.2	158	170.8	60.7	0	0	0	0	111.6	Y403 T404 R412	Y403-T406 WeakPolarHBondContact O-CB 3.45Å; Y403-T406 WeakPolarHBondContact O-CG2 3.47Å; Y403-T406 PolarHBondContact O-N 2.99Å; Y403-T406 PolarHBondContact O-OG1 2.97Å; T404-T406 PolarHBondContact O-N 3.22Å; T406-R412 PolarHBondContact O-NH2 3.03Å
407	G	78.8	Confident	85.4	Confident	69 Å²	69	51.5 Å²	51.5	71%	0.711	28%	0.278	S	S	*	.	S	Bend	trans	-75.5	-29.7	-169.4	0	0	0	0	0	116.1	R412	G407-R412 PolarHBondContact O-NH2 3.12Å
408	D	86.4	Confident	85.5	Confident	58 Å²	58	51.5 Å²	51.5	31%	0.31	28%	0.278	S	S	.	.			trans	-73.2	122.5	-173	178.2	0.4	0	0	0	112.1	Y410 M411 R412	D408-Y410 VanDerWaalsContact C-N 3.32Å; D408-Y410 PolarHBondContact O-N 3.04Å; D408-Y410 PolarHBondContact OD1-N 2.96Å; D408-M411 HydrophobicContact CB-CB 4.09Å; D408-M411 HydrophobicContact CB-CG 4.14Å; D408-M411 HydrophobicContact CB-SD 4.16Å; D408-M411 PolarHBondContact O-N 3.09Å; D408-M411 WeakPolarHBondContact OD2-CG 3.49Å; D408-R412 WeakPolarHBondContact O-CB 3.44Å; D408-R412 PolarHBondContact O-N 3.35Å
409	P	84.6	Confident	85.4	Confident	79 Å²	79	50.6 Å²	50.6	51%	0.513	27%	0.271	S	S	.	.	H	α-helix	trans	-64	-29.5	177.4	27.7	-35.9	0	0	0	114.4	R412 S413	P409-R412 PolarHBondContact O-N 2.93Å; P409-S413 PolarHBondContact O-N 3.4Å; P409-S413 PolarHBondContact O-OG 3.11Å
410	Y	82.5	Confident	85.2	Confident	174 Å²	174	51.1 Å²	51.1	68%	0.682	28%	0.275	S	S	*	.	H	α-helix	trans	-74.4	-40	178.9	-72.2	-87.3	0	0	0	111.7	D408 S413 L414	D408-Y410 VanDerWaalsContact C-N 3.32Å; D408-Y410 PolarHBondContact O-N 3.04Å; D408-Y410 PolarHBondContact OD1-N 2.96Å; Y410-S413 PolarHBondContact O-OG 2.89Å; Y410-L414 PolarHBondContact O-N 2.88Å
411	M	84.9	Confident	85.1	Confident	47 Å²	47	53 Å²	53	23%	0.232	29%	0.285	C	S	.	.	H	α-helix	trans	-65.5	-40.5	169.3	-69.5	178	61.1	0	0	111.1	T380 D408 L414 V415	T380-M411 HydrophobicContact CG2-CB 4.42Å; T380-M411 HydrophobicContact CG2-CE 4.02Å; T380-M411 HydrophobicContact CG2-CG 4.2Å; D408-M411 HydrophobicContact CB-CB 4.09Å; D408-M411 HydrophobicContact CB-CG 4.14Å; D408-M411 HydrophobicContact CB-SD 4.16Å; D408-M411 PolarHBondContact O-N 3.09Å; D408-M411 WeakPolarHBondContact OD2-CG 3.49Å; M411-L414 PolarHBondContact O-N 3.32Å; M411-V415 WeakPolarHBondContact O-CB 3.4Å; M411-V415 VanDerWaalsContact O-CG2 3.26Å; M411-V415 WeakPolarHBondContact O-CG2 3.16Å; M411-V415 PolarHBondContact O-N 3.44Å
412	R	84.9	Confident	85	Confident	86 Å²	86	52.2 Å²	52.2	33%	0.325	28%	0.281	S	S	.	.	H	α-helix	trans	-63.3	-46.7	-179	-169.2	179.6	-54	114.4	13.1	112.6	T404 T406 G407 D408 P409 L414 V415 Q416	T404-R412 HydrophobicContact CG2-CG 3.84Å; T404-R412 PolarHBondContact O-NE 3.37Å; T406-R412 PolarHBondContact O-NH2 3.03Å; G407-R412 PolarHBondContact O-NH2 3.12Å; D408-R412 WeakPolarHBondContact O-CB 3.44Å; D408-R412 PolarHBondContact O-N 3.35Å; P409-R412 PolarHBondContact O-N 2.93Å; R412-L414 PolarHBondContact O-N 3.16Å; R412-V415 PolarHBondContact O-N 3.36Å; R412-Q416 WeakPolarHBondContact O-CB 3.4Å; R412-Q416 PolarHBondContact O-N 3.02Å
413	S	86.1	Confident	84.9	Confident	71 Å²	71	50 Å²	50	50%	0.497	26%	0.263	S	S	.	.	H	α-helix	trans	-63.7	-41.2	-180	58.8	0	0	0	0	112.2	P409 Y410 Q416 H417	P409-S413 PolarHBondContact O-N 3.4Å; P409-S413 PolarHBondContact O-OG 3.11Å; Y410-S413 PolarHBondContact O-OG 2.89Å; S413-Q416 PolarHBondContact O-N 3.3Å; S413-H417 WeakPolarHBondContact O-CB 3.49Å; S413-H417 PolarHBondContact O-N 3.18Å
414	L	86.4	Confident	84.8	Confident	10 Å²	10	51.3 Å²	51.3	5%	0.052	27%	0.27	C	S	.	.	H	α-helix	trans	-60.6	-49	173.4	175.2	59.1	0	0	0	112.1	E331 R377 T380 L381 Y410 M411 R412 H417 I418	E331-L414 HydrophobicContact CG-CD1 4.06Å; E331-L414 WeakPolarHBondContact OE2-CD1 3.22Å; R377-L414 HydrophobicContact CB-CD2 4.08Å; R377-L414 HydrophobicContact CG-CD2 4.22Å; T380-L414 HydrophobicContact CG2-CD2 4.07Å; L381-L414 HydrophobicContact CD2-CD1 4.32Å; L381-L414 HydrophobicContact CD2-CD2 4.35Å; L381-L414 HydrophobicContact CD2-CG 4.5Å; L381-L414 HydrophobicContact CG-CD2 4.36Å; Y410-L414 PolarHBondContact O-N 2.88Å; M411-L414 PolarHBondContact O-N 3.32Å; R412-L414 PolarHBondContact O-N 3.16Å; L414-H417 PolarHBondContact O-N 3.07Å; L414-I418 HydrophobicContact CD1-CD1 4.03Å; L414-I418 HydrophobicContact CG-CD1 4.17Å; L414-I418 WeakPolarHBondContact O-CD1 3.45Å; L414-I418 WeakPolarHBondContact O-CG1 3.28Å; L414-I418 PolarHBondContact O-N 2.87Å; L414-I418 VanDerWaalsContact O-N 3.09Å
415	V	88.4	Confident	84.9	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-69.9	-34	-179.6	175.8	0	0	0	0	111.7	T380 V400 M411 R412 I418 L419	T380-V415 HydrophobicContact CG2-CG2 4.16Å; V400-V415 HydrophobicContact CG1-CG1 3.83Å; V400-V415 WeakPolarHBondContact O-CG1 3.49Å; M411-V415 WeakPolarHBondContact O-CB 3.4Å; M411-V415 VanDerWaalsContact O-CG2 3.26Å; M411-V415 WeakPolarHBondContact O-CG2 3.16Å; M411-V415 PolarHBondContact O-N 3.44Å; R412-V415 PolarHBondContact O-N 3.36Å; V415-I418 PolarHBondContact O-N 3.24Å; V415-L419 VanDerWaalsContact O-CB 3.25Å; V415-L419 WeakPolarHBondContact O-CB 3.32Å; V415-L419 PolarHBondContact O-N 3.41Å
416	Q	85.9	Confident	85	Confident	63 Å²	63	44.4 Å²	44.4	29%	0.294	24%	0.24	S	C	.	.	H	α-helix	trans	-66.1	-40.2	174.5	-178.3	176.3	-10.9	0	0	112	R412 S413 L419 S420 T524	R412-Q416 WeakPolarHBondContact O-CB 3.4Å; R412-Q416 PolarHBondContact O-N 3.02Å; S413-Q416 PolarHBondContact O-N 3.3Å; Q416-L419 PolarHBondContact O-N 3.37Å; Q416-S420 PolarHBondContact O-N 3.04Å; Q416-T524 PolarHBondContact NE2-OG1 3.36Å
417	H	86.1	Confident	85	Confident	76 Å²	76	42.8 Å²	42.8	35%	0.352	23%	0.23	S	C	.	.	H	α-helix	trans	-62.8	-43.6	172.4	-178.8	57.9	0	0	0	111.9	Q330 S413 L414 L419 S420 L421	Q330-H417 PolarHBondContact NE2-CE1 3.13Å; Q330-H417 PolarHBondContact NE2-NE2 3.23Å; Q330-H417 PolarHBondContact OE1-NE2 3.36Å; S413-H417 WeakPolarHBondContact O-CB 3.49Å; S413-H417 PolarHBondContact O-N 3.18Å; L414-H417 PolarHBondContact O-N 3.07Å; H417-L419 VanDerWaalsContact C-N 3.31Å; H417-L419 PolarHBondContact O-N 2.99Å; H417-S420 PolarHBondContact O-N 3.26Å; H417-S420 PolarHBondContact O-OG 2.78Å; H417-L421 VanDerWaalsContact CE1-CD1 3.48Å; H417-L421 WeakPolarHBondContact CE1-CD1 3.42Å; H417-L421 WeakPolarHBondContact O-CD1 3.41Å; H417-L421 PolarHBondContact O-N 3.43Å
418	I	88.3	Confident	85.2	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.9	-38.3	174.7	-63.8	161.8	0	0	0	110.8	F324 A327 L381 L384 V400 L414 V415 L421 V422	F324-I418 HydrophobicContact CD2-CG2 3.89Å; F324-I418 HydrophobicContact CE2-CG2 3.94Å; A327-I418 HydrophobicContact CB-CG1 4.4Å; A327-I418 HydrophobicContact CB-CG2 4.18Å; L381-I418 HydrophobicContact CD2-CD1 3.41Å; L381-I418 VanDerWaalsContact CD2-CD1 3.41Å; L384-I418 HydrophobicContact CD2-CD1 3.94Å; L384-I418 HydrophobicContact CD2-CG2 4.15Å; V400-I418 HydrophobicContact CG1-CG2 4.25Å; L414-I418 HydrophobicContact CD1-CD1 4.03Å; L414-I418 HydrophobicContact CG-CD1 4.17Å; L414-I418 WeakPolarHBondContact O-CD1 3.45Å; L414-I418 WeakPolarHBondContact O-CG1 3.28Å; L414-I418 PolarHBondContact O-N 2.87Å; L414-I418 VanDerWaalsContact O-N 3.09Å; V415-I418 PolarHBondContact O-N 3.24Å; I418-L421 PolarHBondContact O-N 2.93Å; I418-V422 HydrophobicContact CG2-CG2 4.04Å; I418-V422 WeakPolarHBondContact O-CB 3.36Å; I418-V422 WeakPolarHBondContact O-CG2 3.46Å; I418-V422 PolarHBondContact O-N 3.29Å
419	L	87.4	Confident	85.2	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.01	20%	0.203	C	C	.	.	H	α-helix	trans	-66.9	-38	-180	-174.7	60.1	0	0	0	112.7	V400 H401 V415 Q416 H417 V422 S423 F474 F523	V400-L419 HydrophobicContact CB-CD1 4.08Å; V400-L419 HydrophobicContact CG1-CB 3.88Å; V400-L419 HydrophobicContact CG1-CD1 3.99Å; V400-L419 HydrophobicContact CG1-CG 4.47Å; H401-L419 HydrophobicContact CB-CD1 4.27Å; H401-L419 HydrophobicContact CB-CD2 4.02Å; V415-L419 VanDerWaalsContact O-CB 3.25Å; V415-L419 WeakPolarHBondContact O-CB 3.32Å; V415-L419 PolarHBondContact O-N 3.41Å; Q416-L419 PolarHBondContact O-N 3.37Å; H417-L419 VanDerWaalsContact C-N 3.31Å; H417-L419 PolarHBondContact O-N 2.99Å; L419-V422 PolarHBondContact O-N 2.91Å; L419-S423 WeakPolarHBondContact O-CB 3.47Å; L419-S423 PolarHBondContact O-N 3.45Å; L419-S423 PolarHBondContact O-OG 3.4Å; L419-F474 HydrophobicContact CD1-CE1 4.27Å; L419-F523 HydrophobicContact CD1-CZ 4.46Å; L419-F523 HydrophobicContact CD2-CE1 3.56Å; L419-F523 HydrophobicContact CD2-CZ 3.95Å; L419-F523 HydrophobicContact CG-CE1 3.65Å; L419-F523 HydrophobicContact CG-CZ 3.77Å
420	S	84.6	Confident	85.2	Confident	14 Å²	14	36.7 Å²	36.7	10%	0.098	18%	0.179	C	C	.	.	H	α-helix	trans	-65.3	-40.4	175.1	65.9	0	0	0	0	111.6	Q416 H417 S423 H424	Q416-S420 PolarHBondContact O-N 3.04Å; H417-S420 PolarHBondContact O-N 3.26Å; H417-S420 PolarHBondContact O-OG 2.78Å; S420-S423 PolarHBondContact O-OG 3.02Å; S420-S423 VanDerWaalsContact O-OG 3.04Å; S420-H424 PolarHBondContact O-N 3.09Å
421	L	85.1	Confident	85.1	Confident	40 Å²	40	30.2 Å²	30.2	21%	0.209	15%	0.154	C	C	.	.	H	α-helix	trans	-66.4	-44.2	173.5	-88.8	72.6	0	0	0	112.7	S323 A327 H417 I418 H424	S323-L421 WeakPolarHBondContact CB-O 3.34Å; A327-L421 HydrophobicContact CB-CB 4.11Å; A327-L421 HydrophobicContact CB-CD2 3.77Å; H417-L421 VanDerWaalsContact CE1-CD1 3.48Å; H417-L421 WeakPolarHBondContact CE1-CD1 3.42Å; H417-L421 WeakPolarHBondContact O-CD1 3.41Å; H417-L421 PolarHBondContact O-N 3.43Å; I418-L421 PolarHBondContact O-N 2.93Å; L421-H424 PolarHBondContact O-N 2.94Å
422	V	87.1	Confident	85	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-68	-34.3	179.7	169.8	0	0	0	0	112.2	V320 F324 A397 I418 L419 P425	V320-V422 HydrophobicContact CG1-CG1 3.77Å; F324-V422 HydrophobicContact CB-CG2 3.75Å; F324-V422 HydrophobicContact CD2-CG2 3.78Å; F324-V422 HydrophobicContact CG-CG2 4.22Å; A397-V422 HydrophobicContact CB-CG1 4.31Å; I418-V422 HydrophobicContact CG2-CG2 4.04Å; I418-V422 WeakPolarHBondContact O-CB 3.36Å; I418-V422 WeakPolarHBondContact O-CG2 3.46Å; I418-V422 PolarHBondContact O-N 3.29Å; L419-V422 PolarHBondContact O-N 2.91Å; V422-P425 WeakPolarHBondContact O-CD 3.41Å
423	S	84	Confident	85.1	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-78.9	-20.9	179.7	68.3	0	0	0	0	113.8	L419 S420 V426 L427 F523	L419-S423 WeakPolarHBondContact O-CB 3.47Å; L419-S423 PolarHBondContact O-N 3.45Å; L419-S423 PolarHBondContact O-OG 3.4Å; S420-S423 PolarHBondContact O-OG 3.02Å; S420-S423 VanDerWaalsContact O-OG 3.04Å; S423-V426 CarbonylContact O-C 3.18Å; S423-V426 WeakPolarHBondContact O-CA 3.29Å; S423-V426 WeakPolarHBondContact O-CB 3.13Å; S423-V426 PolarHBondContact O-N 3.39Å; S423-L427 PolarHBondContact O-N 2.62Å; S423-F523 WeakPolarHBondContact OG-CD2 3.29Å; S423-F523 WeakPolarHBondContact OG-CE2 3.49Å
424	H	83.1	Confident	84.9	Confident	83 Å²	83	25.3 Å²	25.3	38%	0.384	12%	0.122	S	C	.	.	H	α-helix	trans	-53.3	-44.8	-175	-179.3	79	0	0	0	114.1	S420 L421 V426 L427 S428	S420-H424 PolarHBondContact O-N 3.09Å; L421-H424 PolarHBondContact O-N 2.94Å; H424-V426 PolarHBondContact O-N 3.21Å; H424-L427 PolarHBondContact O-N 3.14Å; H424-S428 WeakPolarHBondContact O-CB 3.41Å; H424-S428 PolarHBondContact O-N 3.41Å
425	P	86.1	Confident	84.4	Confident	6 Å²	6	26.9 Å²	26.9	4%	0.039	13%	0.128	C	C	.	.	H	α-helix	trans	-62.4	-39.1	172.3	-23.1	34.6	0	0	0	113.6	L319 V320 S323 V422 L427 S428 F429	L319-P425 HydrophobicContact CB-CB 4.44Å; L319-P425 HydrophobicContact CD2-CB 3.99Å; L319-P425 HydrophobicContact CG-CB 3.97Å; L319-P425 HydrophobicContact CG-CG 4.14Å; V320-P425 HydrophobicContact CG2-CB 4.21Å; S323-P425 VanDerWaalsContact OG-CG 3.25Å; S323-P425 WeakPolarHBondContact OG-CG 3.37Å; V422-P425 WeakPolarHBondContact O-CD 3.41Å; P425-L427 VanDerWaalsContact C-N 3.33Å; P425-L427 PolarHBondContact O-N 3.1Å; P425-S428 WeakPolarHBondContact O-CB 3.29Å; P425-S428 PolarHBondContact O-N 2.92Å; P425-F429 HydrophobicContact CB-CE2 4.41Å; P425-F429 WeakPolarHBondContact O-CD2 3.46Å; P425-F429 WeakPolarHBondContact O-CG 3.49Å; P425-F429 PolarHBondContact O-N 3.2Å
426	V	84	Confident	83.8	Confident	7 Å²	7	30.1 Å²	30.1	4%	0.042	15%	0.145	C	C	.	.	H	α-helix	trans	-65.4	-39.2	179	-173.1	0	0	0	0	111	V320 S423 H424 L430 P472	V320-V426 HydrophobicContact CG1-CG2 4.45Å; V320-V426 HydrophobicContact CG2-CG2 3.69Å; S423-V426 CarbonylContact O-C 3.18Å; S423-V426 WeakPolarHBondContact O-CA 3.29Å; S423-V426 WeakPolarHBondContact O-CB 3.13Å; S423-V426 PolarHBondContact O-N 3.39Å; H424-V426 PolarHBondContact O-N 3.21Å; V426-L430 VanDerWaalsContact O-CB 3.31Å; V426-L430 WeakPolarHBondContact O-CB 3.43Å; V426-L430 PolarHBondContact O-N 3.15Å; V426-P472 HydrophobicContact CG1-CG 4.09Å
427	L	81.2	Confident	83.4	Confident	14 Å²	14	27.2 Å²	27.2	7%	0.073	13%	0.132	C	C	.	.	H	α-helix	trans	-69.2	-38.4	173.8	-67.2	172.4	0	0	0	111.7	S423 H424 P425 L430 Y431 F523 L526 F530	S423-L427 PolarHBondContact O-N 2.62Å; H424-L427 PolarHBondContact O-N 3.14Å; P425-L427 VanDerWaalsContact C-N 3.33Å; P425-L427 PolarHBondContact O-N 3.1Å; L427-L430 PolarHBondContact O-N 3.35Å; L427-Y431 HydrophobicContact CB-CD2 4.44Å; L427-Y431 HydrophobicContact CB-CE2 4.33Å; L427-Y431 WeakPolarHBondContact O-CB 3.48Å; L427-Y431 WeakPolarHBondContact O-CD2 3Å; L427-Y431 PolarHBondContact O-N 2.87Å; L427-F523 HydrophobicContact CD1-CD2 4.07Å; L427-F523 HydrophobicContact CD1-CE2 4.4Å; L427-L526 HydrophobicContact CD1-CD1 3.72Å; L427-L526 HydrophobicContact CD2-CD1 3.98Å; L427-L526 HydrophobicContact CD2-CD2 4.32Å; L427-F530 HydrophobicContact CD2-CE2 4.23Å; L427-F530 HydrophobicContact CD2-CZ 3.96Å
428	S	83.3	Confident	83.1	Confident	52 Å²	52	29.4 Å²	29.4	36%	0.364	14%	0.143	S	C	.	.	H	α-helix	trans	-61.1	-47.6	174.2	-174.7	0	0	0	0	112.1	H424 P425 L430 Y431 R432	H424-S428 WeakPolarHBondContact O-CB 3.41Å; H424-S428 PolarHBondContact O-N 3.41Å; P425-S428 WeakPolarHBondContact O-CB 3.29Å; P425-S428 PolarHBondContact O-N 2.92Å; S428-L430 VanDerWaalsContact C-N 3.33Å; S428-L430 PolarHBondContact O-N 3.25Å; S428-Y431 PolarHBondContact O-N 3.11Å; S428-R432 WeakPolarHBondContact O-CG 3.41Å; S428-R432 PolarHBondContact O-N 3.41Å; S428-R432 VanDerWaalsContact O-N 3.09Å
429	F	84.9	Confident	82.7	Confident	24 Å²	24	31.2 Å²	31.2	11%	0.105	15%	0.152	C	C	.	.	H	α-helix	trans	-59.5	-43.1	173.2	-64.8	-49.7	0	0	0	112	L319 P425 W433 F446	L319-F429 HydrophobicContact CD2-CE2 4.49Å; L319-F429 HydrophobicContact CD2-CZ 3.94Å; P425-F429 HydrophobicContact CB-CE2 4.41Å; P425-F429 WeakPolarHBondContact O-CD2 3.46Å; P425-F429 WeakPolarHBondContact O-CG 3.49Å; P425-F429 PolarHBondContact O-N 3.2Å; F429-W433 VanDerWaalsContact O-CB 3.28Å; F429-W433 WeakPolarHBondContact O-CB 3.29Å; F429-W433 PolarHBondContact O-N 3.23Å; F429-F446 HydrophobicContact CB-CD2 3.73Å; F429-F446 HydrophobicContact CB-CE2 3.96Å; F429-F446 HydrophobicContact CB-CG 4.17Å; F429-F446 HydrophobicContact CD2-CD2 4.45Å; F429-F446 HydrophobicContact CG-CD2 4.47Å
430	L	84.8	Confident	82.1	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-65.1	-42.7	178.9	177.6	151.3	0	0	0	112.4	V426 L427 S428 W433 I434 F446 I475 V483 F530	V426-L430 VanDerWaalsContact O-CB 3.31Å; V426-L430 WeakPolarHBondContact O-CB 3.43Å; V426-L430 PolarHBondContact O-N 3.15Å; L427-L430 PolarHBondContact O-N 3.35Å; S428-L430 VanDerWaalsContact C-N 3.33Å; S428-L430 PolarHBondContact O-N 3.25Å; L430-W433 PolarHBondContact O-N 3.43Å; L430-I434 HydrophobicContact CD2-CD1 3.5Å; L430-I434 HydrophobicContact CD2-CG1 4.38Å; L430-I434 HydrophobicContact CG-CD1 3.9Å; L430-I434 WeakPolarHBondContact O-CB 3.42Å; L430-I434 VanDerWaalsContact O-CG1 3.31Å; L430-I434 WeakPolarHBondContact O-CG1 3.36Å; L430-I434 PolarHBondContact O-N 3.29Å; L430-F446 HydrophobicContact CB-CE2 4.16Å; L430-F446 HydrophobicContact CB-CZ 4.26Å; L430-I475 HydrophobicContact CD1-CD1 4.4Å; L430-V483 HydrophobicContact CD1-CG1 4.36Å; L430-V483 HydrophobicContact CD1-CG2 4.34Å; L430-V483 HydrophobicContact CG-CG1 4.33Å; L430-F530 HydrophobicContact CD1-CE1 4.25Å; L430-F530 HydrophobicContact CD1-CZ 3.78Å; L430-F530 HydrophobicContact CD2-CE2 3.99Å; L430-F530 HydrophobicContact CD2-CZ 3.53Å; L430-F530 HydrophobicContact CG-CZ 4.33Å
431	Y	80.4	Confident	81.9	Confident	38 Å²	38	36.5 Å²	36.5	15%	0.149	18%	0.176	C	C	.	.	H	α-helix	trans	-67.2	-42.1	179	-77.9	-54.9	0	0	0	112.1	L427 S428 W433 I434 Y435 F530	L427-Y431 HydrophobicContact CB-CD2 4.44Å; L427-Y431 HydrophobicContact CB-CE2 4.33Å; L427-Y431 WeakPolarHBondContact O-CB 3.48Å; L427-Y431 WeakPolarHBondContact O-CD2 3Å; L427-Y431 PolarHBondContact O-N 2.87Å; S428-Y431 PolarHBondContact O-N 3.11Å; Y431-W433 VanDerWaalsContact C-N 3.32Å; Y431-W433 PolarHBondContact O-N 3.37Å; Y431-I434 PolarHBondContact O-N 3.36Å; Y431-Y435 HydrophobicContact CD1-CD2 4.21Å; Y431-Y435 AromaticContact CD1-CE2 3.6Å; Y431-Y435 HydrophobicContact CD1-CE2 3.6Å; Y431-Y435 HydrophobicContact CE1-CE2 4.24Å; Y431-Y435 HydrophobicContact CG-CE2 4.48Å; Y431-Y435 WeakPolarHBondContact O-CB 3.3Å; Y431-Y435 WeakPolarHBondContact O-CD2 3.31Å; Y431-Y435 PolarHBondContact O-N 2.73Å; Y431-F530 HydrophobicContact CE1-CE2 4.39Å
432	R	82.7	Confident	81.7	Confident	96 Å²	96	40 Å²	40	36%	0.362	20%	0.199	S	C	.	.	H	α-helix	trans	-64.2	-38.4	175.3	-64.9	172.9	94.9	-160.4	-4.5	111.3	S428 I434 D436 G437 E440	S428-R432 WeakPolarHBondContact O-CG 3.41Å; S428-R432 PolarHBondContact O-N 3.41Å; S428-R432 VanDerWaalsContact O-N 3.09Å; R432-I434 PolarHBondContact O-N 3.29Å; R432-D436 WeakPolarHBondContact CA-OD2 3.1Å; R432-D436 CarbonylContact O-C 3.58Å; R432-D436 WeakPolarHBondContact O-CA 3.33Å; R432-D436 VanDerWaalsContact O-CB 3.31Å; R432-D436 WeakPolarHBondContact O-CB 3.49Å; R432-D436 PolarHBondContact O-N 2.79Å; R432-G437 PolarHBondContact O-N 3.48Å; R432-E440 IonicContact CZ-OE2 2.67Å; R432-E440 IonicContact NH1-OE2 3.93Å; R432-E440 PolarHBondContact NH1-OE2 2.99Å; R432-E440 IonicContact NH2-OE2 2.69Å; R432-E440 PolarHBondContact NH2-OE2 3.23Å
433	W	86.9	Confident	81.4	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-68.7	-30.7	173.6	-178.4	-116	0	0	0	114.1	F429 L430 Y431 G437 L439 F446 V448 Y464 V483 G487	F429-W433 VanDerWaalsContact O-CB 3.28Å; F429-W433 WeakPolarHBondContact O-CB 3.29Å; F429-W433 PolarHBondContact O-N 3.23Å; L430-W433 PolarHBondContact O-N 3.43Å; Y431-W433 VanDerWaalsContact C-N 3.32Å; Y431-W433 PolarHBondContact O-N 3.37Å; W433-G437 VanDerWaalsContact CZ3-O 3.29Å; W433-G437 WeakPolarHBondContact CZ3-O 3.29Å; W433-L439 HydrophobicContact CB-CD2 3.92Å; W433-L439 HydrophobicContact CD2-CD1 4.25Å; W433-L439 HydrophobicContact CD2-CD2 3.75Å; W433-L439 HydrophobicContact CD2-CG 3.96Å; W433-L439 HydrophobicContact CE3-CD1 3.89Å; W433-L439 HydrophobicContact CE3-CD2 3.7Å; W433-L439 HydrophobicContact CE3-CG 3.42Å; W433-L439 VanDerWaalsContact CE3-CG 3.42Å; W433-L439 HydrophobicContact CG-CD2 3.89Å; W433-L439 HydrophobicContact CH2-CD1 4.17Å; W433-L439 HydrophobicContact CZ3-CD1 3.84Å; W433-L439 HydrophobicContact CZ3-CD2 4.48Å; W433-L439 HydrophobicContact CZ3-CG 3.77Å; W433-F446 HydrophobicContact CG-CE1 4.35Å; W433-V448 HydrophobicContact CZ2-CG1 4.09Å; W433-Y464 AromaticContact CH2-CD1 3.53Å; W433-Y464 HydrophobicContact CH2-CD1 3.53Å; W433-Y464 HydrophobicContact CH2-CD2 4.33Å; W433-Y464 AromaticContact CH2-CE1 3.43Å; W433-Y464 HydrophobicContact CH2-CE1 3.43Å; W433-Y464 VanDerWaalsContact CH2-CE1 3.43Å; W433-Y464 HydrophobicContact CH2-CE2 4.25Å; W433-Y464 AromaticContact CH2-CG 3.99Å; W433-Y464 HydrophobicContact CH2-CG 3.99Å; W433-Y464 AromaticContact CH2-CZ 3.83Å; W433-Y464 HydrophobicContact CZ2-CD1 4.18Å; W433-Y464 HydrophobicContact CZ2-CE1 4.48Å; W433-Y464 HydrophobicContact CZ2-CG 4.47Å; W433-Y464 HydrophobicContact CZ3-CD1 4.25Å; W433-Y464 AromaticContact CZ3-CE1 3.76Å; W433-Y464 HydrophobicContact CZ3-CE1 3.76Å; W433-V483 PolarHBondContact NE1-O 2.87Å; W433-G487 VanDerWaalsContact CE2-CA 3.47Å; W433-G487 VanDerWaalsContact CH2-C 3.45Å; W433-G487 VanDerWaalsContact CZ2-C 3.44Å; W433-G487 WeakPolarHBondContact O-CA 3.49Å
434	I	82.6	Confident	81.4	Confident	5 Å²	5	49.2 Å²	49.2	3%	0.026	24%	0.239	C	C	.	.	H	α-helix	trans	-86	-21.4	179.4	-74.4	-178.9	0	0	0	113.7	L430 Y431 R432 V483 I486 I490 I534 A537	L430-I434 HydrophobicContact CD2-CD1 3.5Å; L430-I434 HydrophobicContact CD2-CG1 4.38Å; L430-I434 HydrophobicContact CG-CD1 3.9Å; L430-I434 WeakPolarHBondContact O-CB 3.42Å; L430-I434 VanDerWaalsContact O-CG1 3.31Å; L430-I434 WeakPolarHBondContact O-CG1 3.36Å; L430-I434 PolarHBondContact O-N 3.29Å; Y431-I434 PolarHBondContact O-N 3.36Å; R432-I434 PolarHBondContact O-N 3.29Å; I434-V483 HydrophobicContact CD1-CG1 4.3Å; I434-V483 HydrophobicContact CD1-CG2 4.07Å; I434-V483 HydrophobicContact CG1-CG1 4.32Å; I434-I486 HydrophobicContact CB-CG2 4.29Å; I434-I486 HydrophobicContact CD1-CD1 4.36Å; I434-I486 HydrophobicContact CG1-CD1 4.4Å; I434-I486 HydrophobicContact CG1-CG2 4.12Å; I434-I486 HydrophobicContact CG2-CG2 4.24Å; I434-I490 WeakPolarHBondContact O-CD1 3.27Å; I434-I534 HydrophobicContact CD1-CG1 4.31Å; I434-A537 HydrophobicContact CG2-CB 4.18Å
435	Y	76.8	Confident	81.5	Confident	43 Å²	43	45.4 Å²	45.4	17%	0.169	22%	0.221	C	C	.	.	H	α-helix	trans	-116.6	-41.8	-177.6	-63.4	-48.4	0	0	0	114.1	Y431 M506 V509 T510	Y431-Y435 HydrophobicContact CD1-CD2 4.21Å; Y431-Y435 AromaticContact CD1-CE2 3.6Å; Y431-Y435 HydrophobicContact CD1-CE2 3.6Å; Y431-Y435 HydrophobicContact CE1-CE2 4.24Å; Y431-Y435 HydrophobicContact CG-CE2 4.48Å; Y431-Y435 WeakPolarHBondContact O-CB 3.3Å; Y431-Y435 WeakPolarHBondContact O-CD2 3.31Å; Y431-Y435 PolarHBondContact O-N 2.73Å; Y435-M506 HydrophobicContact CD1-CB 3.74Å; Y435-M506 HydrophobicContact CD1-CE 3.78Å; Y435-M506 HydrophobicContact CD1-CG 4.08Å; Y435-M506 HydrophobicContact CD1-SD 4.33Å; Y435-M506 HydrophobicContact CE1-CB 3.98Å; Y435-M506 HydrophobicContact CE1-CE 3.94Å; Y435-M506 HydrophobicContact CE1-CG 4.1Å; Y435-V509 HydrophobicContact CE2-CB 4.31Å; Y435-V509 HydrophobicContact CE2-CG1 4.21Å; Y435-V509 WeakPolarHBondContact OH-CG1 3.49Å; Y435-T510 HydrophobicContact CD2-CG2 3.7Å; Y435-T510 HydrophobicContact CE2-CG2 4.47Å; Y435-T510 HydrophobicContact CG-CG2 4.15Å
436	D	75.7	Confident	81.6	Confident	68 Å²	68	45.2 Å²	45.2	36%	0.364	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-26.5	-177.9	-45.9	-46.4	0	0	0	111.6	R432 E438 H494	R432-D436 WeakPolarHBondContact CA-OD2 3.1Å; R432-D436 CarbonylContact O-C 3.58Å; R432-D436 WeakPolarHBondContact O-CA 3.33Å; R432-D436 VanDerWaalsContact O-CB 3.31Å; R432-D436 WeakPolarHBondContact O-CB 3.49Å; R432-D436 PolarHBondContact O-N 2.79Å; D436-E438 VanDerWaalsContact C-N 3.35Å; D436-H494 PolarHBondContact O-CE1 3.2Å; D436-H494 PolarHBondContact O-ND1 3.2Å
437	G	77.1	Confident	81.8	Confident	2 Å²	2	45 Å²	45	2%	0.021	22%	0.218	C	C	.	.			trans	79.1	13.3	-178.5	0	0	0	0	0	114.4	R432 W433	R432-G437 PolarHBondContact O-N 3.48Å; W433-G437 VanDerWaalsContact CZ3-O 3.29Å; W433-G437 WeakPolarHBondContact CZ3-O 3.29Å
438	E	78.5	Confident	82.2	Confident	123 Å²	123	44.3 Å²	44.3	58%	0.575	22%	0.215	S	C	*	.			trans	-108.6	152.1	-175.6	-59	-166.3	150.3	0	0	112.6	D436	D436-E438 VanDerWaalsContact C-N 3.35Å
439	L	80.1	Confident	82.4	Confident	37 Å²	37	42.3 Å²	42.3	19%	0.194	20%	0.201	C	C	.	.			trans	-127.8	94.3	-179.2	-71.5	176.7	0	0	0	111.8	W433 D441 F446 V448 Y464	W433-L439 HydrophobicContact CB-CD2 3.92Å; W433-L439 HydrophobicContact CD2-CD1 4.25Å; W433-L439 HydrophobicContact CD2-CD2 3.75Å; W433-L439 HydrophobicContact CD2-CG 3.96Å; W433-L439 HydrophobicContact CE3-CD1 3.89Å; W433-L439 HydrophobicContact CE3-CD2 3.7Å; W433-L439 HydrophobicContact CE3-CG 3.42Å; W433-L439 VanDerWaalsContact CE3-CG 3.42Å; W433-L439 HydrophobicContact CG-CD2 3.89Å; W433-L439 HydrophobicContact CH2-CD1 4.17Å; W433-L439 HydrophobicContact CZ3-CD1 3.84Å; W433-L439 HydrophobicContact CZ3-CD2 4.48Å; W433-L439 HydrophobicContact CZ3-CG 3.77Å; L439-D441 PolarHBondContact O-N 3.36Å; L439-F446 HydrophobicContact CD2-CD1 3.75Å; L439-F446 HydrophobicContact CD2-CE1 3.82Å; L439-V448 HydrophobicContact CD1-CB 4.29Å; L439-V448 HydrophobicContact CD1-CG1 3.8Å; L439-Y464 HydrophobicContact CD1-CD1 4.03Å; L439-Y464 HydrophobicContact CD1-CE1 3.96Å
440	E	74.9	Confident	82.3	Confident	110 Å²	110	43.9 Å²	43.9	51%	0.514	22%	0.215	S	C	.	.			trans	-84.7	42.9	172.6	-61.6	-166.4	127.1	0	0	113	R432 T442	R432-E440 IonicContact CZ-OE2 2.67Å; R432-E440 IonicContact NH1-OE2 3.93Å; R432-E440 PolarHBondContact NH1-OE2 2.99Å; R432-E440 IonicContact NH2-OE2 2.69Å; R432-E440 PolarHBondContact NH2-OE2 3.23Å; E440-T442 VanDerWaalsContact C-N 3.33Å; E440-T442 PolarHBondContact O-N 2.9Å
441	D	80.7	Confident	82.2	Confident	17 Å²	17	46.8 Å²	46.8	9%	0.091	23%	0.231	C	C	.	.			trans	-82.4	69.8	-178.3	-176.3	17.5	0	0	0	113	L439 Y443 H444 E445 F446 R467	L439-D441 PolarHBondContact O-N 3.36Å; D441-Y443 PolarHBondContact O-N 2.8Å; D441-H444 PolarHBondContact O-ND1 3.48Å; D441-H444 VanDerWaalsContact OD1-CA 3.24Å; D441-H444 WeakPolarHBondContact OD1-CA 3.19Å; D441-H444 PolarHBondContact OD1-N 3.1Å; D441-H444 WeakPolarHBondContact OD2-CA 3.43Å; D441-E445 PolarHBondContact OD1-N 3.48Å; D441-E445 PolarHBondContact OD2-N 2.75Å; D441-F446 HydrophobicContact CB-CB 4.29Å; D441-F446 PolarHBondContact OD2-N 3.08Å; D441-F446 VanDerWaalsContact OD2-N 3.1Å; D441-R467 IonicContact OD2-NH1 2.97Å; D441-R467 PolarHBondContact OD2-NH1 2.96Å
442	T	80.4	Confident	82.1	Confident	113 Å²	113	51 Å²	51	69%	0.693	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-21.1	179.4	53.2	0	0	0	0	114.8	E440	E440-T442 VanDerWaalsContact C-N 3.33Å; E440-T442 PolarHBondContact O-N 2.9Å
443	Y	81.3	Confident	82	Confident	79 Å²	79	51.8 Å²	51.8	31%	0.31	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-1.6	-175.4	-67.6	-59.7	0	0	0	114.6	R315 K392 D441 E445	R315-Y443 HydrophobicContact CB-CE1 4.31Å; R315-Y443 WeakPolarHBondContact O-CD1 3.42Å; R315-Y443 WeakPolarHBondContact O-CE1 3.48Å; K392-Y443 WeakPolarHBondContact CE-O 3.24Å; K392-Y443 PolarHBondContact NZ-O 2.77Å; D441-Y443 PolarHBondContact O-N 2.8Å; Y443-E445 WeakPolarHBondContact CB-OE2 3.44Å
444	H	84.3	Confident	81.7	Confident	115 Å²	115	53.2 Å²	53.2	53%	0.532	29%	0.287	S	S	.	.	S	Bend	trans	62.4	43.2	-178.6	-60.2	-10.3	0	0	0	113.3	D441 R467	D441-H444 PolarHBondContact O-ND1 3.48Å; D441-H444 VanDerWaalsContact OD1-CA 3.24Å; D441-H444 WeakPolarHBondContact OD1-CA 3.19Å; D441-H444 PolarHBondContact OD1-N 3.1Å; D441-H444 WeakPolarHBondContact OD2-CA 3.43Å; H444-R467 VanDerWaalsContact CG-NH2 3.29Å; H444-R467 PolarHBondContact ND1-NH2 3.39Å
445	E	85	Confident	81.2	Confident	4 Å²	4	61 Å²	61	2%	0.019	32%	0.321	C	S	.	.			trans	-96.4	-21	-179.5	-70	179.1	98.9	0	0	113.6	G318 L319 V320 K392 D441 Y443	G318-E445 VanDerWaalsContact CA-CD 3.47Å; G318-E445 WeakPolarHBondContact CA-OE1 3.4Å; G318-E445 VanDerWaalsContact CA-OE2 3.28Å; G318-E445 WeakPolarHBondContact CA-OE2 3.16Å; L319-E445 VanDerWaalsContact N-CD 3.31Å; L319-E445 PolarHBondContact N-OE1 3.06Å; L319-E445 PolarHBondContact N-OE2 3.16Å; V320-E445 VanDerWaalsContact CB-OE1 3.26Å; V320-E445 WeakPolarHBondContact CB-OE1 3.45Å; V320-E445 HydrophobicContact CG2-CB 4.43Å; V320-E445 WeakPolarHBondContact CG2-OE1 3.44Å; V320-E445 PolarHBondContact N-OE1 3.45Å; K392-E445 HydrophobicContact CD-CG 4.43Å; K392-E445 VanDerWaalsContact CE-CG 3.45Å; K392-E445 HydrophobicContact CG-CG 4.05Å; D441-E445 PolarHBondContact OD1-N 3.48Å; D441-E445 PolarHBondContact OD2-N 2.75Å; Y443-E445 WeakPolarHBondContact CB-OE2 3.44Å
446	F	87.9	Confident	80.7	Confident	2 Å²	2	63.6 Å²	63.6	1%	0.009	34%	0.341	C	S	.	.	S	Bend	trans	-82.9	152.4	-178.7	-164.4	-123.6	0	0	0	111.6	F429 L430 W433 L439 D441 V448 R467	F429-F446 HydrophobicContact CB-CD2 3.73Å; F429-F446 HydrophobicContact CB-CE2 3.96Å; F429-F446 HydrophobicContact CB-CG 4.17Å; F429-F446 HydrophobicContact CD2-CD2 4.45Å; F429-F446 HydrophobicContact CG-CD2 4.47Å; L430-F446 HydrophobicContact CB-CE2 4.16Å; L430-F446 HydrophobicContact CB-CZ 4.26Å; W433-F446 HydrophobicContact CG-CE1 4.35Å; L439-F446 HydrophobicContact CD2-CD1 3.75Å; L439-F446 HydrophobicContact CD2-CE1 3.82Å; D441-F446 HydrophobicContact CB-CB 4.29Å; D441-F446 PolarHBondContact OD2-N 3.08Å; D441-F446 VanDerWaalsContact OD2-N 3.1Å; F446-V448 HydrophobicContact CD1-CB 3.74Å; F446-V448 HydrophobicContact CD1-CG2 4.24Å; F446-V448 HydrophobicContact CE1-CB 3.68Å; F446-V448 HydrophobicContact CE1-CG2 3.71Å; F446-R467 PolarHBondContact O-NH1 3.43Å
447	F	88.7	Confident	80.3	Confident	1 Å²	1	66.3 Å²	66.3	0%	0.004	36%	0.355	C	S	.	.	S	Bend	trans	-80.6	-17.4	-177.1	61.8	-100.7	0	0	0	113.7	L466 R467 M470 I471 I475 V483	F447-L466 HydrophobicContact CD2-CD1 3.77Å; F447-L466 HydrophobicContact CE2-CD1 4.36Å; F447-L466 CarbonylContact O-C 3.59Å; F447-L466 WeakPolarHBondContact O-CA 3.46Å; F447-R467 PolarHBondContact O-N 3.07Å; F447-M470 HydrophobicContact CB-CB 4.29Å; F447-I471 HydrophobicContact CB-CG1 4.01Å; F447-I471 HydrophobicContact CG-CG1 4.48Å; F447-I475 HydrophobicContact CE1-CD1 3.83Å; F447-I475 HydrophobicContact CZ-CD1 4.33Å; F447-V483 HydrophobicContact CE2-CB 4.48Å; F447-V483 HydrophobicContact CE2-CG1 4.25Å; F447-V483 HydrophobicContact CZ-CB 4.42Å; F447-V483 HydrophobicContact CZ-CG1 4.03Å
448	V	89.4	Confident	80	Confident	1 Å²	1	72 Å²	72	1%	0.006	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	128.3	164	-177.3	0	0	0	0	108.6	W433 L439 F446 Y464 T465 L484	W433-V448 HydrophobicContact CZ2-CG1 4.09Å; L439-V448 HydrophobicContact CD1-CB 4.29Å; L439-V448 HydrophobicContact CD1-CG1 3.8Å; F446-V448 HydrophobicContact CD1-CB 3.74Å; F446-V448 HydrophobicContact CD1-CG2 4.24Å; F446-V448 HydrophobicContact CE1-CB 3.68Å; F446-V448 HydrophobicContact CE1-CG2 3.71Å; V448-Y464 HydrophobicContact CG1-CD1 4.23Å; V448-T465 WeakPolarHBondContact CA-O 3.33Å; V448-L484 HydrophobicContact CB-CD1 4.49Å; V448-L484 HydrophobicContact CG1-CD1 3.63Å; V448-L484 HydrophobicContact CG2-CB 4.48Å; V448-L484 HydrophobicContact CG2-CD1 4.07Å
449	A	86.5	Confident	79.9	Confident	9 Å²	9	66.4 Å²	66.4	7%	0.074	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	131	172.6	0	0	0	0	0	110.1	Y464 T465 R467	A449-Y464 WeakPolarHBondContact O-CA 3.26Å; A449-T465 PolarHBondContact N-O 3.42Å; A449-T465 PolarHBondContact O-N 3.41Å; A449-R467 HydrophobicContact CB-CG 4.05Å
450	S	84.6	Confident	79.9	Confident	58 Å²	58	64.8 Å²	64.8	41%	0.406	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	132	164.4	41.7	0	0	0	0	110.3	K463	S450-K463 CarbonylContact C-O 3.59Å; S450-K463 WeakPolarHBondContact CA-O 3.49Å
451	D	82.3	Confident	80	Confident	61 Å²	61	63.2 Å²	63.2	33%	0.326	33%	0.334	S	S	.	.			trans	-96.7	116.3	169.2	-167.5	-41.2	0	0	0	109.6	T453 V454 K463	D451-T453 VanDerWaalsContact C-N 3.28Å; D451-T453 PolarHBondContact O-N 3.06Å; D451-T453 WeakPolarHBondContact OD1-CA 2.98Å; D451-T453 VanDerWaalsContact OD1-CB 3.29Å; D451-T453 WeakPolarHBondContact OD1-CB 3.14Å; D451-T453 WeakPolarHBondContact OD1-CG2 3.36Å; D451-T453 PolarHBondContact OD1-N 3.38Å; D451-T453 PolarHBondContact OD1-OG1 3.31Å; D451-V454 HydrophobicContact CB-CG2 4.05Å; D451-K463 PolarHBondContact N-O 3.11Å
452	P	77.9	Confident	79.9	Confident	127 Å²	127	65.7 Å²	65.7	83%	0.825	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-8.1	-179.3	33.2	-36.3	0	0	0	113.8
453	T	79.9	Confident	80.1	Confident	113 Å²	113	61.8 Å²	61.8	69%	0.693	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-21.5	179.3	71.5	0	0	0	0	112.8	D451 K455	D451-T453 VanDerWaalsContact C-N 3.28Å; D451-T453 PolarHBondContact O-N 3.06Å; D451-T453 WeakPolarHBondContact OD1-CA 2.98Å; D451-T453 VanDerWaalsContact OD1-CB 3.29Å; D451-T453 WeakPolarHBondContact OD1-CB 3.14Å; D451-T453 WeakPolarHBondContact OD1-CG2 3.36Å; D451-T453 PolarHBondContact OD1-N 3.38Å; D451-T453 PolarHBondContact OD1-OG1 3.31Å; T453-K455 PolarHBondContact O-N 3.26Å
454	V	80.8	Confident	80.4	Confident	29 Å²	29	58.7 Å²	58.7	18%	0.176	31%	0.309	C	S	.	.	S	Bend	trans	-77.2	119.6	-177.7	179.5	0	0	0	0	110.6	D451 R458 D462 K463	D451-V454 HydrophobicContact CB-CG2 4.05Å; V454-R458 HydrophobicContact CG1-CB 4.02Å; V454-D462 HydrophobicContact CG1-CB 3.9Å; V454-D462 HydrophobicContact CG2-CB 3.81Å; V454-K463 HydrophobicContact CB-CB 4.05Å; V454-K463 HydrophobicContact CB-CG 4.42Å; V454-K463 HydrophobicContact CG1-CB 3.87Å
455	K	71.8	Confident	80.6	Confident	170 Å²	170	56.8 Å²	56.8	74%	0.739	31%	0.305	S	S	*	.			trans	-65	153.5	174.7	-67.5	-174.7	178.1	-177.9	0	111.6	T453 D457 R458	T453-K455 PolarHBondContact O-N 3.26Å; K455-D457 PolarHBondContact O-N 2.93Å; K455-D457 VanDerWaalsContact O-N 3.12Å; K455-R458 PolarHBondContact O-N 3.11Å
456	T	67.1	Low	80.8	Confident	97 Å²	97	58.4 Å²	58.4	60%	0.595	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-50.4	-36.6	177.4	44.4	0	0	0	0	113.6	R458 L459	T456-R458 PolarHBondContact O-N 3.34Å; T456-R458 VanDerWaalsContact O-N 3.09Å; T456-L459 WeakPolarHBondContact O-CB 3.13Å; T456-L459 WeakPolarHBondContact O-CD2 3.4Å; T456-L459 PolarHBondContact O-N 2.94Å
457	D	66.7	Low	80.9	Confident	124 Å²	124	61 Å²	61	66%	0.663	32%	0.324	S	S	*	.	G	3₁₀ helix	trans	-52.3	-28.7	175.2	-171.6	59.4	0	0	0	114.6	K455	K455-D457 PolarHBondContact O-N 2.93Å; K455-D457 VanDerWaalsContact O-N 3.12Å
458	R	70.9	Confident	80.9	Confident	122 Å²	122	68.9 Å²	68.9	46%	0.46	36%	0.358	S	S	.	.	G	3₁₀ helix	trans	-116	22.2	178	-71.5	-172.1	164.8	-137.3	-4.3	113.8	V454 K455 T456 W460 H461 D462 E655	V454-R458 HydrophobicContact CG1-CB 4.02Å; K455-R458 PolarHBondContact O-N 3.11Å; T456-R458 PolarHBondContact O-N 3.34Å; T456-R458 VanDerWaalsContact O-N 3.09Å; R458-W460 PolarHBondContact O-N 3.06Å; R458-W460 VanDerWaalsContact O-N 3.09Å; R458-H461 PolarHBondContact O-N 2.93Å; R458-D462 WeakPolarHBondContact CD-OD2 3.38Å; R458-D462 IonicContact NH1-OD2 3.64Å; R458-D462 PolarHBondContact NH1-OD2 3.33Å; R458-D462 PolarHBondContact O-N 3.1Å; R458-E655 IonicContact NH2-OE1 2.66Å
459	L	76	Confident	80.8	Confident	5 Å²	5	73 Å²	73	3%	0.026	39%	0.387	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-32.3	-175.8	83	168.8	0	0	0	114.6	T456 K463 F492 Q495 V496	T456-L459 WeakPolarHBondContact O-CB 3.13Å; T456-L459 WeakPolarHBondContact O-CD2 3.4Å; T456-L459 PolarHBondContact O-N 2.94Å; L459-K463 HydrophobicContact CB-CD 3.98Å; L459-K463 WeakPolarHBondContact O-CB 3.46Å; L459-F492 HydrophobicContact CD1-CB 4.45Å; L459-F492 HydrophobicContact CD1-CD2 4.1Å; L459-F492 HydrophobicContact CD2-CD2 3.94Å; L459-F492 HydrophobicContact CD2-CE2 4.26Å; L459-F492 HydrophobicContact CG-CD2 4.3Å; L459-Q495 HydrophobicContact CD1-CB 4.42Å; L459-V496 HydrophobicContact CD1-CG2 3.35Å; L459-V496 HydrophobicContact CD2-CG2 3.82Å; L459-V496 HydrophobicContact CG-CG2 4.25Å
460	W	80.5	Confident	80.8	Confident	3 Å²	3	74.3 Å²	74.3	1%	0.011	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-38.7	-173.7	-167.1	-96	0	0	0	112.6	R458 L485 K488 F492 L545 T650 L744 D745	R458-W460 PolarHBondContact O-N 3.06Å; R458-W460 VanDerWaalsContact O-N 3.09Å; W460-L485 HydrophobicContact CH2-CD1 3.86Å; W460-L485 HydrophobicContact CZ2-CD1 3.54Å; W460-K488 HydrophobicContact CH2-CB 4.39Å; W460-K488 HydrophobicContact CZ3-CB 4.23Å; W460-K488 VanDerWaalsContact O-CE 3.3Å; W460-K488 WeakPolarHBondContact O-CE 3.41Å; W460-K488 PolarHBondContact O-NZ 3.01Å; W460-F492 HydrophobicContact CE3-CB 4Å; W460-F492 AromaticContact CE3-CD2 3.87Å; W460-F492 HydrophobicContact CE3-CD2 3.87Å; W460-F492 HydrophobicContact CE3-CG 4.04Å; W460-F492 HydrophobicContact CZ3-CB 3.8Å; W460-F492 HydrophobicContact CZ3-CD2 4.34Å; W460-F492 HydrophobicContact CZ3-CG 4.04Å; W460-L545 HydrophobicContact CH2-CD2 3.75Å; W460-L545 HydrophobicContact CZ3-CD2 4.07Å; W460-T650 HydrophobicContact CB-CG2 3.45Å; W460-T650 VanDerWaalsContact CB-CG2 3.45Å; W460-T650 HydrophobicContact CD2-CG2 4.15Å; W460-T650 HydrophobicContact CG-CG2 3.65Å; W460-L744 HydrophobicContact CD2-CD2 4.27Å; W460-L744 HydrophobicContact CE3-CD2 4.3Å; W460-L744 HydrophobicContact CH2-CB 4.16Å; W460-L744 HydrophobicContact CH2-CD2 4.01Å; W460-L744 HydrophobicContact CZ2-CB 3.83Å; W460-L744 HydrophobicContact CZ2-CD2 3.96Å; W460-L744 HydrophobicContact CZ2-CG 4.31Å; W460-L744 HydrophobicContact CZ3-CD2 4.17Å; W460-D745 PolarHBondContact NE1-OD1 3.29Å
461	H	77.8	Confident	81	Confident	78 Å²	78	72.9 Å²	72.9	36%	0.361	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-63.6	-173.8	-60.1	97.4	0	0	0	110.8	R458	R458-H461 PolarHBondContact O-N 2.93Å
462	D	78.9	Confident	81.2	Confident	69 Å²	69	70 Å²	70	37%	0.369	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-26.9	-160.4	-57.5	-33.6	0	0	0	113.5	V454 R458 Y464	V454-D462 HydrophobicContact CG1-CB 3.9Å; V454-D462 HydrophobicContact CG2-CB 3.81Å; R458-D462 WeakPolarHBondContact CD-OD2 3.38Å; R458-D462 IonicContact NH1-OD2 3.64Å; R458-D462 PolarHBondContact NH1-OD2 3.33Å; R458-D462 PolarHBondContact O-N 3.1Å; D462-Y464 PolarHBondContact O-N 2.87Å
463	K	83.3	Confident	81.6	Confident	30 Å²	30	66.6 Å²	66.6	13%	0.13	34%	0.343	C	S	.	.	S	Bend	trans	-69.4	-26	-167.4	-171.9	-177.5	176.6	-154	0	115	S450 D451 V454 L459	S450-K463 CarbonylContact C-O 3.59Å; S450-K463 WeakPolarHBondContact CA-O 3.49Å; D451-K463 PolarHBondContact N-O 3.11Å; V454-K463 HydrophobicContact CB-CB 4.05Å; V454-K463 HydrophobicContact CB-CG 4.42Å; V454-K463 HydrophobicContact CG1-CB 3.87Å; L459-K463 HydrophobicContact CB-CD 3.98Å; L459-K463 WeakPolarHBondContact O-CB 3.46Å
464	Y	88.3	Confident	81.7	Confident	14 Å²	14	63.2 Å²	63.2	6%	0.055	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	116	-175.6	-60.5	-80.4	0	0	0	111.8	W433 L439 V448 A449 D462 K488 N491	W433-Y464 AromaticContact CH2-CD1 3.53Å; W433-Y464 HydrophobicContact CH2-CD1 3.53Å; W433-Y464 HydrophobicContact CH2-CD2 4.33Å; W433-Y464 AromaticContact CH2-CE1 3.43Å; W433-Y464 HydrophobicContact CH2-CE1 3.43Å; W433-Y464 VanDerWaalsContact CH2-CE1 3.43Å; W433-Y464 HydrophobicContact CH2-CE2 4.25Å; W433-Y464 AromaticContact CH2-CG 3.99Å; W433-Y464 HydrophobicContact CH2-CG 3.99Å; W433-Y464 AromaticContact CH2-CZ 3.83Å; W433-Y464 HydrophobicContact CZ2-CD1 4.18Å; W433-Y464 HydrophobicContact CZ2-CE1 4.48Å; W433-Y464 HydrophobicContact CZ2-CG 4.47Å; W433-Y464 HydrophobicContact CZ3-CD1 4.25Å; W433-Y464 AromaticContact CZ3-CE1 3.76Å; W433-Y464 HydrophobicContact CZ3-CE1 3.76Å; L439-Y464 HydrophobicContact CD1-CD1 4.03Å; L439-Y464 HydrophobicContact CD1-CE1 3.96Å; V448-Y464 HydrophobicContact CG1-CD1 4.23Å; A449-Y464 WeakPolarHBondContact O-CA 3.26Å; D462-Y464 PolarHBondContact O-N 2.87Å; Y464-K488 HydrophobicContact CD2-CG 4.08Å; Y464-K488 HydrophobicContact CG-CG 4.45Å; Y464-N491 PolarHBondContact OH-ND2 3.25Å; Y464-N491 PolarHBondContact OH-OD1 3.25Å
465	T	87.6	Confident	81.8	Confident	75 Å²	75	62.7 Å²	62.7	46%	0.46	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	161.8	-175.1	63.2	0	0	0	0	112.1	V448 A449	V448-T465 WeakPolarHBondContact CA-O 3.33Å; A449-T465 PolarHBondContact N-O 3.42Å; A449-T465 PolarHBondContact O-N 3.41Å
466	L	90.4	Very high	82.6	Confident	39 Å²	39	58 Å²	58	20%	0.204	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	110.7	-172.2	-164.6	84.1	0	0	0	112.3	F447 K468 I471 M477 S480	F447-L466 HydrophobicContact CD2-CD1 3.77Å; F447-L466 HydrophobicContact CE2-CD1 4.36Å; F447-L466 CarbonylContact O-C 3.59Å; F447-L466 WeakPolarHBondContact O-CA 3.46Å; L466-K468 PolarHBondContact O-N 3.03Å; L466-I471 HydrophobicContact CD2-CD1 3.87Å; L466-I471 HydrophobicContact CG-CD1 4.31Å; L466-M477 HydrophobicContact CD2-CE 3.46Å; L466-M477 VanDerWaalsContact CD2-CE 3.46Å; L466-M477 HydrophobicContact CD2-SD 4.07Å; L466-S480 WeakPolarHBondContact CD2-OG 3.35Å
467	R	89.5	Confident	83.6	Confident	57 Å²	57	56.8 Å²	56.8	22%	0.215	29%	0.289	C	S	.	.			trans	-75.8	87.5	175.7	-62.8	-177.8	-176	129.1	-3.4	110.7	D441 H444 F446 F447 A449 S469 M470	D441-R467 IonicContact OD2-NH1 2.97Å; D441-R467 PolarHBondContact OD2-NH1 2.96Å; H444-R467 VanDerWaalsContact CG-NH2 3.29Å; H444-R467 PolarHBondContact ND1-NH2 3.39Å; F446-R467 PolarHBondContact O-NH1 3.43Å; F447-R467 PolarHBondContact O-N 3.07Å; A449-R467 HydrophobicContact CB-CG 4.05Å; R467-S469 PolarHBondContact O-N 2.88Å; R467-M470 HydrophobicContact CB-CB 4.13Å; R467-M470 HydrophobicContact CB-CG 4.19Å; R467-M470 PolarHBondContact O-N 3.13Å
468	K	89.2	Confident	84.6	Confident	165 Å²	165	55.2 Å²	55.2	72%	0.717	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-51.2	-31.2	-178.3	-64.7	-179.8	-176.4	174.5	0	114.9	L466 M470	L466-K468 PolarHBondContact O-N 3.03Å; K468-M470 VanDerWaalsContact C-N 3.33Å
469	S	87.4	Confident	85.4	Confident	89 Å²	89	50.4 Å²	50.4	62%	0.622	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-73.3	-19.5	177.3	48.7	0	0	0	0	114.7	R467	R467-S469 PolarHBondContact O-N 2.88Å
470	M	86.2	Confident	86	Confident	36 Å²	36	50.1 Å²	50.1	18%	0.177	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-103.3	5.8	-177.7	-62.6	-61.2	-174	0	0	112.9	G394 F447 R467 K468 P472	G394-M470 WeakPolarHBondContact CA-O 3.49Å; F447-M470 HydrophobicContact CB-CB 4.29Å; R467-M470 HydrophobicContact CB-CB 4.13Å; R467-M470 HydrophobicContact CB-CG 4.19Å; R467-M470 PolarHBondContact O-N 3.13Å; K468-M470 VanDerWaalsContact C-N 3.33Å; M470-P472 WeakPolarHBondContact O-CD 3.49Å
471	I	88.6	Confident	86.4	Confident	27 Å²	27	57.2 Å²	57.2	14%	0.138	29%	0.289	C	S	.	.			trans	-73.7	120.5	176.6	-57.7	174	0	0	0	108.5	S398 F447 L466 I475 M477	S398-I471 PolarHBondContact OG-O 3.36Å; F447-I471 HydrophobicContact CB-CG1 4.01Å; F447-I471 HydrophobicContact CG-CG1 4.48Å; L466-I471 HydrophobicContact CD2-CD1 3.87Å; L466-I471 HydrophobicContact CG-CD1 4.31Å; I471-I475 HydrophobicContact CG2-CB 4.34Å; I471-M477 HydrophobicContact CD1-SD 4.1Å
472	P	87	Confident	87	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.284	C	S	.	.			trans	-63.4	137.1	175.5	-18.7	31.2	0	0	0	111.3	A397 S398 V426 M470 F474 I475	A397-P472 HydrophobicContact CB-CB 4.39Å; S398-P472 WeakPolarHBondContact OG-CA 3.39Å; V426-P472 HydrophobicContact CG1-CG 4.09Å; M470-P472 WeakPolarHBondContact O-CD 3.49Å; P472-F474 HydrophobicContact CB-CD1 3.91Å; P472-F474 HydrophobicContact CB-CD2 4.28Å; P472-F474 HydrophobicContact CB-CE1 3.47Å; P472-F474 VanDerWaalsContact CB-CE1 3.47Å; P472-F474 HydrophobicContact CB-CE2 3.87Å; P472-F474 HydrophobicContact CB-CG 4.29Å; P472-F474 HydrophobicContact CB-CZ 3.45Å; P472-F474 VanDerWaalsContact CB-CZ 3.45Å; P472-F474 HydrophobicContact CG-CE1 4.49Å; P472-F474 HydrophobicContact CG-CE2 4.41Å; P472-F474 HydrophobicContact CG-CZ 4.06Å; P472-F474 PolarHBondContact O-N 2.97Å; P472-I475 HydrophobicContact CB-CG1 4.39Å; P472-I475 HydrophobicContact CG-CD1 4.06Å; P472-I475 HydrophobicContact CG-CG1 4.45Å; P472-I475 PolarHBondContact O-N 2.81Å
473	S	84.8	Confident	87.5	Confident	56 Å²	56	53 Å²	53	39%	0.392	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	3.9	-174.9	64	0	0	0	0	116.2	S398 H401	S398-S473 WeakPolarHBondContact CA-OG 3.43Å; S398-S473 PolarHBondContact OG-N 3.09Å; H401-S473 PolarHBondContact CD2-OG 3.09Å; H401-S473 PolarHBondContact NE2-O 3.29Å
474	F	82.1	Confident	87.8	Confident	42 Å²	42	52.8 Å²	52.8	18%	0.184	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-7.9	167.2	54.3	-99.1	0	0	0	113.5	A397 H401 L419 P472 F523	A397-F474 HydrophobicContact CB-CE1 4.21Å; H401-F474 HydrophobicContact CB-CD1 4.23Å; L419-F474 HydrophobicContact CD1-CE1 4.27Å; P472-F474 HydrophobicContact CB-CD1 3.91Å; P472-F474 HydrophobicContact CB-CD2 4.28Å; P472-F474 HydrophobicContact CB-CE1 3.47Å; P472-F474 VanDerWaalsContact CB-CE1 3.47Å; P472-F474 HydrophobicContact CB-CE2 3.87Å; P472-F474 HydrophobicContact CB-CG 4.29Å; P472-F474 HydrophobicContact CB-CZ 3.45Å; P472-F474 VanDerWaalsContact CB-CZ 3.45Å; P472-F474 HydrophobicContact CG-CE1 4.49Å; P472-F474 HydrophobicContact CG-CE2 4.41Å; P472-F474 HydrophobicContact CG-CZ 4.06Å; P472-F474 PolarHBondContact O-N 2.97Å; F474-F523 HydrophobicContact CD1-CZ 4.4Å; F474-F523 HydrophobicContact CE1-CZ 4.24Å; F474-F523 HydrophobicContact CE2-CE2 4.47Å; F474-F523 HydrophobicContact CE2-CZ 4.45Å; F474-F523 HydrophobicContact CZ-CE2 4.37Å; F474-F523 HydrophobicContact CZ-CZ 4.27Å
475	I	84.1	Confident	87.8	Confident	18 Å²	18	52.8 Å²	52.8	9%	0.092	27%	0.267	C	S	.	.	S	Bend	trans	-103.2	123.3	173.9	-56.6	-173.5	0	0	0	108.1	L430 F447 I471 P472 Q479	L430-I475 HydrophobicContact CD1-CD1 4.4Å; F447-I475 HydrophobicContact CE1-CD1 3.83Å; F447-I475 HydrophobicContact CZ-CD1 4.33Å; I471-I475 HydrophobicContact CG2-CB 4.34Å; P472-I475 HydrophobicContact CB-CG1 4.39Å; P472-I475 HydrophobicContact CG-CD1 4.06Å; P472-I475 HydrophobicContact CG-CG1 4.45Å; P472-I475 PolarHBondContact O-N 2.81Å; I475-Q479 HydrophobicContact CG2-CB 3.82Å
476	T	87.4	Confident	87.9	Confident	71 Å²	71	49.2 Å²	49.2	44%	0.436	25%	0.245	S	C	.	.			trans	-73.4	159	176.8	82.4	0	0	0	0	111.3	D478 Q479 S480	T476-D478 PolarHBondContact O-N 2.92Å; T476-D478 PolarHBondContact OG1-N 3.35Å; T476-Q479 PolarHBondContact O-N 2.91Å; T476-Q479 VanDerWaalsContact O-N 3.14Å; T476-Q479 PolarHBondContact OG1-N 2.97Å; T476-S480 PolarHBondContact O-N 3.1Å
477	M	88.8	Confident	87.8	Confident	72 Å²	72	47.3 Å²	47.3	36%	0.355	24%	0.236	S	C	.	.	H	α-helix	trans	-53.3	-39	174.8	-175.5	69.1	-161.2	0	0	111.4	L466 I471 S480 R481	L466-M477 HydrophobicContact CD2-CE 3.46Å; L466-M477 VanDerWaalsContact CD2-CE 3.46Å; L466-M477 HydrophobicContact CD2-SD 4.07Å; I471-M477 HydrophobicContact CD1-SD 4.1Å; M477-S480 PolarHBondContact O-N 3.16Å; M477-S480 PolarHBondContact O-OG 3Å; M477-R481 HydrophobicContact CE-CG 4.4Å; M477-R481 WeakPolarHBondContact O-CG 3.41Å; M477-R481 PolarHBondContact O-N 3.03Å; M477-R481 VanDerWaalsContact O-N 3.08Å
478	D	87.9	Confident	87.7	Confident	92 Å²	92	45.9 Å²	45.9	49%	0.492	23%	0.231	S	C	.	.	H	α-helix	trans	-71.7	-36.6	-178.2	-50.3	-50	0	0	0	112	T476 S480 R481 K482	T476-D478 PolarHBondContact O-N 2.92Å; T476-D478 PolarHBondContact OG1-N 3.35Å; D478-S480 VanDerWaalsContact C-N 3.34Å; D478-R481 WeakPolarHBondContact O-CB 3.49Å; D478-R481 PolarHBondContact O-N 2.74Å; D478-K482 WeakPolarHBondContact O-CG 3.02Å; D478-K482 PolarHBondContact O-N 3.23Å
479	Q	87.2	Confident	87.6	Confident	20 Å²	20	38 Å²	38	9%	0.093	20%	0.197	C	C	.	.	H	α-helix	trans	-65.4	-39.7	171.2	-56.3	-31.8	-51.1	0	0	111.6	I475 T476 R481 K482 V483 Q531	I475-Q479 HydrophobicContact CG2-CB 3.82Å; T476-Q479 PolarHBondContact O-N 2.91Å; T476-Q479 VanDerWaalsContact O-N 3.14Å; T476-Q479 PolarHBondContact OG1-N 2.97Å; Q479-R481 PolarHBondContact O-N 3.27Å; Q479-K482 PolarHBondContact O-N 2.67Å; Q479-K482 VanDerWaalsContact O-N 3.15Å; Q479-V483 WeakPolarHBondContact O-CB 3.21Å; Q479-V483 VanDerWaalsContact O-CG2 3.3Å; Q479-V483 WeakPolarHBondContact O-CG2 3.43Å; Q479-V483 PolarHBondContact O-N 3Å; Q479-Q531 VanDerWaalsContact CD-CD 3.42Å; Q479-Q531 VanDerWaalsContact NE2-NE2 3.11Å
480	S	89.3	Confident	87.5	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-62.4	-30.6	176.2	80.2	0	0	0	0	112.6	L466 T476 M477 D478 L484	L466-S480 WeakPolarHBondContact CD2-OG 3.35Å; T476-S480 PolarHBondContact O-N 3.1Å; M477-S480 PolarHBondContact O-N 3.16Å; M477-S480 PolarHBondContact O-OG 3Å; D478-S480 VanDerWaalsContact C-N 3.34Å; S480-L484 WeakPolarHBondContact O-CB 3.44Å; S480-L484 PolarHBondContact O-N 2.98Å
481	R	89.1	Confident	87.4	Confident	151 Å²	151	33 Å²	33	57%	0.57	16%	0.163	S	C	*	.	H	α-helix	trans	-71.6	-45.8	170.3	-65.4	172.4	-171.7	-120	10.2	112.3	M477 D478 Q479 L484 L485	M477-R481 HydrophobicContact CE-CG 4.4Å; M477-R481 WeakPolarHBondContact O-CG 3.41Å; M477-R481 PolarHBondContact O-N 3.03Å; M477-R481 VanDerWaalsContact O-N 3.08Å; D478-R481 WeakPolarHBondContact O-CB 3.49Å; D478-R481 PolarHBondContact O-N 2.74Å; Q479-R481 PolarHBondContact O-N 3.27Å; R481-L484 WeakPolarHBondContact O-CB 3.43Å; R481-L484 PolarHBondContact O-N 2.85Å; R481-L485 PolarHBondContact O-N 3.41Å
482	K	89.7	Confident	87.3	Confident	58 Å²	58	31.7 Å²	31.7	25%	0.252	16%	0.157	S	C	.	.	H	α-helix	trans	-61.3	-45.3	177.8	-68.8	-171	-168.5	-170.3	0	111.8	D478 Q479 L484 L485 I486 I534 D535 Y538	D478-K482 WeakPolarHBondContact O-CG 3.02Å; D478-K482 PolarHBondContact O-N 3.23Å; Q479-K482 PolarHBondContact O-N 2.67Å; Q479-K482 VanDerWaalsContact O-N 3.15Å; K482-L484 VanDerWaalsContact C-N 3.33Å; K482-L484 PolarHBondContact O-N 2.67Å; K482-L485 PolarHBondContact O-N 3.04Å; K482-L485 VanDerWaalsContact O-N 3.15Å; K482-I486 VanDerWaalsContact O-CG1 3.31Å; K482-I486 WeakPolarHBondContact O-CG1 3.39Å; K482-I486 PolarHBondContact O-N 3.46Å; K482-I534 HydrophobicContact CB-CG2 4.22Å; K482-D535 WeakPolarHBondContact CD-OD1 3.3Å; K482-D535 IonicContact NZ-OD1 2.65Å; K482-D535 PolarHBondContact NZ-OD1 2.79Å; K482-D535 IonicContact NZ-OD2 3.63Å; K482-Y538 HydrophobicContact CB-CD2 3.7Å; K482-Y538 HydrophobicContact CB-CE2 4.03Å; K482-Y538 HydrophobicContact CD-CD2 4.19Å; K482-Y538 HydrophobicContact CD-CE2 4.46Å; K482-Y538 HydrophobicContact CD-CG 4.39Å; K482-Y538 HydrophobicContact CG-CD2 3.82Å; K482-Y538 HydrophobicContact CG-CE2 3.81Å; K482-Y538 HydrophobicContact CG-CG 4.5Å
483	V	89.1	Confident	87.1	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-62.9	-38.1	176.3	174.7	0	0	0	0	111.5	L430 W433 I434 F447 Q479 G487 I534	L430-V483 HydrophobicContact CD1-CG1 4.36Å; L430-V483 HydrophobicContact CD1-CG2 4.34Å; L430-V483 HydrophobicContact CG-CG1 4.33Å; W433-V483 PolarHBondContact NE1-O 2.87Å; I434-V483 HydrophobicContact CD1-CG1 4.3Å; I434-V483 HydrophobicContact CD1-CG2 4.07Å; I434-V483 HydrophobicContact CG1-CG1 4.32Å; F447-V483 HydrophobicContact CE2-CB 4.48Å; F447-V483 HydrophobicContact CE2-CG1 4.25Å; F447-V483 HydrophobicContact CZ-CB 4.42Å; F447-V483 HydrophobicContact CZ-CG1 4.03Å; Q479-V483 WeakPolarHBondContact O-CB 3.21Å; Q479-V483 VanDerWaalsContact O-CG2 3.3Å; Q479-V483 WeakPolarHBondContact O-CG2 3.43Å; Q479-V483 PolarHBondContact O-N 3Å; V483-G487 PolarHBondContact O-N 3.27Å; V483-I534 HydrophobicContact CG2-CD1 3.85Å; V483-I534 HydrophobicContact CG2-CG1 4.46Å; V483-I534 HydrophobicContact CG2-CG2 4.29Å
484	L	90.1	Very high	87	Confident	26 Å²	26	32.4 Å²	32.4	14%	0.136	15%	0.154	C	C	.	.	H	α-helix	trans	-61.1	-45.7	171.5	178.3	65.8	0	0	0	111.8	V448 S480 R481 K482 K488	V448-L484 HydrophobicContact CB-CD1 4.49Å; V448-L484 HydrophobicContact CG1-CD1 3.63Å; V448-L484 HydrophobicContact CG2-CB 4.48Å; V448-L484 HydrophobicContact CG2-CD1 4.07Å; S480-L484 WeakPolarHBondContact O-CB 3.44Å; S480-L484 PolarHBondContact O-N 2.98Å; R481-L484 WeakPolarHBondContact O-CB 3.43Å; R481-L484 PolarHBondContact O-N 2.85Å; K482-L484 VanDerWaalsContact C-N 3.33Å; K482-L484 PolarHBondContact O-N 2.67Å; L484-K488 HydrophobicContact CG-CD 4.45Å; L484-K488 WeakPolarHBondContact O-CB 3.34Å; L484-K488 WeakPolarHBondContact O-CG 3.32Å; L484-K488 PolarHBondContact O-N 3.26Å
485	L	89.1	Confident	86.8	Confident	14 Å²	14	34 Å²	34	7%	0.073	16%	0.162	C	C	.	.	H	α-helix	trans	-72.8	-33.7	-177	-175.4	50.9	0	0	0	113.4	W460 R481 K482 S489 Y538 D743	W460-L485 HydrophobicContact CH2-CD1 3.86Å; W460-L485 HydrophobicContact CZ2-CD1 3.54Å; R481-L485 PolarHBondContact O-N 3.41Å; K482-L485 PolarHBondContact O-N 3.04Å; K482-L485 VanDerWaalsContact O-N 3.15Å; L485-S489 WeakPolarHBondContact O-CB 3.37Å; L485-S489 PolarHBondContact O-N 3.04Å; L485-S489 PolarHBondContact O-OG 2.88Å; L485-Y538 HydrophobicContact CB-CE2 4.25Å; L485-Y538 HydrophobicContact CD2-CE2 3.89Å; L485-Y538 HydrophobicContact CG-CE2 4.23Å; L485-D743 HydrophobicContact CD2-CB 4.28Å
486	I	89.3	Confident	86.6	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-57	-57.9	171.1	-69.7	162.8	0	0	0	110.1	I434 K482 K488 S489 I490 I534 A537 Y538 T541	I434-I486 HydrophobicContact CB-CG2 4.29Å; I434-I486 HydrophobicContact CD1-CD1 4.36Å; I434-I486 HydrophobicContact CG1-CD1 4.4Å; I434-I486 HydrophobicContact CG1-CG2 4.12Å; I434-I486 HydrophobicContact CG2-CG2 4.24Å; K482-I486 VanDerWaalsContact O-CG1 3.31Å; K482-I486 WeakPolarHBondContact O-CG1 3.39Å; K482-I486 PolarHBondContact O-N 3.46Å; I486-K488 PolarHBondContact O-N 3.42Å; I486-S489 WeakPolarHBondContact O-CA 3.47Å; I486-S489 WeakPolarHBondContact O-CB 3.14Å; I486-S489 PolarHBondContact O-N 2.81Å; I486-I490 HydrophobicContact CG2-CD1 3.89Å; I486-I490 PolarHBondContact O-N 3.43Å; I486-I534 HydrophobicContact CD1-CG2 4.26Å; I486-A537 HydrophobicContact CD1-CB 4.34Å; I486-Y538 HydrophobicContact CG1-CD2 4.13Å; I486-T541 HydrophobicContact CG2-CG2 4.36Å
487	G	87.5	Confident	85.9	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-70.6	-30.5	-176.3	0	0	0	0	0	113.4	W433 V483 S489 I490 N491	W433-G487 VanDerWaalsContact CE2-CA 3.47Å; W433-G487 VanDerWaalsContact CH2-C 3.45Å; W433-G487 VanDerWaalsContact CZ2-C 3.44Å; W433-G487 WeakPolarHBondContact O-CA 3.49Å; V483-G487 PolarHBondContact O-N 3.27Å; G487-S489 VanDerWaalsContact C-N 3.32Å; G487-S489 PolarHBondContact O-N 3.41Å; G487-I490 PolarHBondContact O-N 3Å; G487-N491 WeakPolarHBondContact O-CB 3.4Å; G487-N491 PolarHBondContact O-N 3.13Å
488	K	87.3	Confident	85.3	Confident	26 Å²	26	34.5 Å²	34.5	11%	0.113	16%	0.16	C	C	.	.	H	α-helix	trans	-56.2	-46.7	165.6	-83.3	-172.9	175.9	-166.7	0	111	W460 Y464 L484 I486 F492	W460-K488 HydrophobicContact CH2-CB 4.39Å; W460-K488 HydrophobicContact CZ3-CB 4.23Å; W460-K488 VanDerWaalsContact O-CE 3.3Å; W460-K488 WeakPolarHBondContact O-CE 3.41Å; W460-K488 PolarHBondContact O-NZ 3.01Å; Y464-K488 HydrophobicContact CD2-CG 4.08Å; Y464-K488 HydrophobicContact CG-CG 4.45Å; L484-K488 HydrophobicContact CG-CD 4.45Å; L484-K488 WeakPolarHBondContact O-CB 3.34Å; L484-K488 WeakPolarHBondContact O-CG 3.32Å; L484-K488 PolarHBondContact O-N 3.26Å; I486-K488 PolarHBondContact O-N 3.42Å; K488-F492 WeakPolarHBondContact O-CB 3.45Å; K488-F492 PolarHBondContact O-N 2.67Å
489	S	87.5	Confident	84.5	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.007	14%	0.142	C	C	.	.	H	α-helix	trans	-64	-45.1	-179.6	-58.4	0	0	0	0	112.7	L485 I486 G487 F492 L493	L485-S489 WeakPolarHBondContact O-CB 3.37Å; L485-S489 PolarHBondContact O-N 3.04Å; L485-S489 PolarHBondContact O-OG 2.88Å; I486-S489 WeakPolarHBondContact O-CA 3.47Å; I486-S489 WeakPolarHBondContact O-CB 3.14Å; I486-S489 PolarHBondContact O-N 2.81Å; G487-S489 VanDerWaalsContact C-N 3.32Å; G487-S489 PolarHBondContact O-N 3.41Å; S489-F492 PolarHBondContact O-N 2.94Å; S489-L493 WeakPolarHBondContact O-CG 3.45Å; S489-L493 PolarHBondContact O-N 3.3Å
490	I	85.3	Confident	83.3	Confident	11 Å²	11	37.9 Å²	37.9	6%	0.056	17%	0.173	C	C	.	.	H	α-helix	trans	-68.8	-47.4	178.5	-63.5	170.6	0	0	0	110.9	I434 I486 G487 F492 L493 H494 M506 T541	I434-I490 WeakPolarHBondContact O-CD1 3.27Å; I486-I490 HydrophobicContact CG2-CD1 3.89Å; I486-I490 PolarHBondContact O-N 3.43Å; G487-I490 PolarHBondContact O-N 3Å; I490-F492 PolarHBondContact O-N 2.92Å; I490-L493 WeakPolarHBondContact O-CB 3.47Å; I490-L493 PolarHBondContact O-N 3.34Å; I490-L493 VanDerWaalsContact O-N 3.13Å; I490-H494 PolarHBondContact O-N 3.25Å; I490-M506 HydrophobicContact CD1-CE 4.47Å; I490-T541 HydrophobicContact CD1-CG2 4.05Å; I490-T541 HydrophobicContact CG1-CG2 4.13Å
491	N	85.4	Confident	82	Confident	8 Å²	8	41.6 Å²	41.6	4%	0.043	20%	0.196	C	C	.	.	H	α-helix	trans	-59.3	-36.1	175.9	176.2	93.2	0	0	0	111.7	Y464 G487 Q495	Y464-N491 PolarHBondContact OH-ND2 3.25Å; Y464-N491 PolarHBondContact OH-OD1 3.25Å; G487-N491 WeakPolarHBondContact O-CB 3.4Å; G487-N491 PolarHBondContact O-N 3.13Å; N491-Q495 PolarHBondContact ND2-OE1 2.96Å; N491-Q495 VanDerWaalsContact O-CB 3.29Å; N491-Q495 WeakPolarHBondContact O-CB 3.49Å; N491-Q495 PolarHBondContact O-N 2.91Å; N491-Q495 PolarHBondContact OD1-NE2 2.6Å; N491-Q495 PolarHBondContact OD1-OE1 3.03Å
492	F	84.8	Confident	80.3	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-65.3	-45.9	174.1	179.1	-89	0	0	0	112.4	L459 W460 K488 S489 I490 H494 Q495 V496 C497 L545 L549 P647 T650	L459-F492 HydrophobicContact CD1-CB 4.45Å; L459-F492 HydrophobicContact CD1-CD2 4.1Å; L459-F492 HydrophobicContact CD2-CD2 3.94Å; L459-F492 HydrophobicContact CD2-CE2 4.26Å; L459-F492 HydrophobicContact CG-CD2 4.3Å; W460-F492 HydrophobicContact CE3-CB 4Å; W460-F492 AromaticContact CE3-CD2 3.87Å; W460-F492 HydrophobicContact CE3-CD2 3.87Å; W460-F492 HydrophobicContact CE3-CG 4.04Å; W460-F492 HydrophobicContact CZ3-CB 3.8Å; W460-F492 HydrophobicContact CZ3-CD2 4.34Å; W460-F492 HydrophobicContact CZ3-CG 4.04Å; K488-F492 WeakPolarHBondContact O-CB 3.45Å; K488-F492 PolarHBondContact O-N 2.67Å; S489-F492 PolarHBondContact O-N 2.94Å; I490-F492 PolarHBondContact O-N 2.92Å; F492-H494 VanDerWaalsContact C-N 3.32Å; F492-H494 PolarHBondContact O-N 3.47Å; F492-Q495 PolarHBondContact O-N 3.13Å; F492-V496 HydrophobicContact CD2-CB 4.13Å; F492-V496 HydrophobicContact CD2-CG2 3.84Å; F492-V496 HydrophobicContact CE2-CB 3.99Å; F492-V496 HydrophobicContact CE2-CG1 4.1Å; F492-V496 HydrophobicContact CE2-CG2 4.02Å; F492-V496 HydrophobicContact CG-CG2 4.43Å; F492-V496 HydrophobicContact CZ-CB 4.28Å; F492-V496 HydrophobicContact CZ-CG1 4.3Å; F492-V496 WeakPolarHBondContact O-CA 3.41Å; F492-V496 WeakPolarHBondContact O-CB 3.38Å; F492-V496 PolarHBondContact O-N 3.21Å; F492-C497 VanDerWaalsContact CE1-SG 3.58Å; F492-C497 PolarHBondContact O-N 2.87Å; F492-L545 HydrophobicContact CD1-CD1 3.53Å; F492-L545 HydrophobicContact CE1-CD1 3.77Å; F492-L549 HydrophobicContact CE1-CD2 4.14Å; F492-L549 HydrophobicContact CZ-CD2 4.44Å; F492-P647 HydrophobicContact CE1-CB 4.04Å; F492-P647 HydrophobicContact CE2-CB 4.5Å; F492-P647 HydrophobicContact CZ-CB 3.55Å; F492-T650 HydrophobicContact CD2-CG2 4.5Å; F492-T650 HydrophobicContact CE2-CG2 3.87Å; F492-T650 WeakPolarHBondContact CE2-OG1 3.44Å
493	L	84.4	Confident	78.6	Confident	7 Å²	7	37.1 Å²	37.1	4%	0.037	19%	0.192	C	C	.	.	H	α-helix	trans	-57.8	-44.6	174.7	-73.5	163	0	0	0	111.5	S489 I490 C497 H498 D499 Y544 L545 V548	S489-L493 WeakPolarHBondContact O-CG 3.45Å; S489-L493 PolarHBondContact O-N 3.3Å; I490-L493 WeakPolarHBondContact O-CB 3.47Å; I490-L493 PolarHBondContact O-N 3.34Å; I490-L493 VanDerWaalsContact O-N 3.13Å; L493-C497 HydrophobicContact CD2-CB 4.28Å; L493-C497 CarbonylContact O-C 3.57Å; L493-C497 WeakPolarHBondContact O-CB 3.43Å; L493-C497 PolarHBondContact O-N 2.79Å; L493-H498 PolarHBondContact O-N 3.12Å; L493-D499 PolarHBondContact O-N 3.49Å; L493-Y544 HydrophobicContact CD1-CD1 3.72Å; L493-Y544 HydrophobicContact CD1-CE1 3.93Å; L493-Y544 HydrophobicContact CD2-CE1 4.32Å; L493-L545 HydrophobicContact CD1-CB 4.48Å; L493-L545 HydrophobicContact CD2-CD1 4.01Å; L493-L545 HydrophobicContact CG-CD1 4.13Å; L493-V548 HydrophobicContact CD2-CB 4.04Å; L493-V548 HydrophobicContact CD2-CG1 3.87Å; L493-V548 HydrophobicContact CD2-CG2 4.08Å
494	H	82.8	Confident	76.6	Confident	64 Å²	64	42.9 Å²	42.9	30%	0.296	23%	0.228	S	C	.	.	H	α-helix	trans	-69.8	-45.6	179.2	-65.6	178.3	0	0	0	113.1	D436 I490 F492 D499	D436-H494 PolarHBondContact O-CE1 3.2Å; D436-H494 PolarHBondContact O-ND1 3.2Å; I490-H494 PolarHBondContact O-N 3.25Å; F492-H494 VanDerWaalsContact C-N 3.32Å; F492-H494 PolarHBondContact O-N 3.47Å; H494-D499 PolarHBondContact CD2-O 3.11Å
495	Q	77.9	Confident	74.7	Confident	75 Å²	75	48.4 Å²	48.4	35%	0.35	25%	0.25	S	S	.	.	H	α-helix	trans	-88.5	-25.7	-172.1	-72.8	171	3.8	0	0	115	L459 N491 F492 H498	L459-Q495 HydrophobicContact CD1-CB 4.42Å; N491-Q495 PolarHBondContact ND2-OE1 2.96Å; N491-Q495 VanDerWaalsContact O-CB 3.29Å; N491-Q495 WeakPolarHBondContact O-CB 3.49Å; N491-Q495 PolarHBondContact O-N 2.91Å; N491-Q495 PolarHBondContact OD1-NE2 2.6Å; N491-Q495 PolarHBondContact OD1-OE1 3.03Å; F492-Q495 PolarHBondContact O-N 3.13Å; Q495-H498 PolarHBondContact O-CE1 2.67Å; Q495-H498 VanDerWaalsContact O-CE1 3.23Å
496	V	77.8	Confident	72.7	Confident	24 Å²	24	48.7 Å²	48.7	15%	0.145	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.1	-39.4	-170.7	-163.1	0	0	0	0	112.6	L459 F492 H498 P647	L459-V496 HydrophobicContact CD1-CG2 3.35Å; L459-V496 HydrophobicContact CD2-CG2 3.82Å; L459-V496 HydrophobicContact CG-CG2 4.25Å; F492-V496 HydrophobicContact CD2-CB 4.13Å; F492-V496 HydrophobicContact CD2-CG2 3.84Å; F492-V496 HydrophobicContact CE2-CB 3.99Å; F492-V496 HydrophobicContact CE2-CG1 4.1Å; F492-V496 HydrophobicContact CE2-CG2 4.02Å; F492-V496 HydrophobicContact CG-CG2 4.43Å; F492-V496 HydrophobicContact CZ-CB 4.28Å; F492-V496 HydrophobicContact CZ-CG1 4.3Å; F492-V496 WeakPolarHBondContact O-CA 3.41Å; F492-V496 WeakPolarHBondContact O-CB 3.38Å; F492-V496 PolarHBondContact O-N 3.21Å; V496-H498 VanDerWaalsContact C-N 3.33Å; V496-P647 HydrophobicContact CG1-CB 3.84Å
497	C	74.1	Confident	70.7	Confident	4 Å²	4	52 Å²	52	3%	0.027	27%	0.268	C	S	.	.	S	Bend	trans	-83.1	-12.8	170.6	-57.3	0	0	0	0	112.8	F492 L493 D499 V548 Y553	F492-C497 VanDerWaalsContact CE1-SG 3.58Å; F492-C497 PolarHBondContact O-N 2.87Å; L493-C497 HydrophobicContact CD2-CB 4.28Å; L493-C497 CarbonylContact O-C 3.57Å; L493-C497 WeakPolarHBondContact O-CB 3.43Å; L493-C497 PolarHBondContact O-N 2.79Å; C497-D499 HydrophobicContact CB-CB 4.22Å; C497-D499 PolarHBondContact O-N 3.48Å; C497-D499 VanDerWaalsContact O-N 3.09Å; C497-V548 HydrophobicContact CB-CG1 4.26Å; C497-Y553 WeakPolarHBondContact CA-OH 3.43Å; C497-Y553 HydrophobicContact CB-CE2 3.94Å; C497-Y553 PolarHBondContact O-OH 3.31Å; C497-Y553 VanDerWaalsContact O-OH 3.14Å
498	H	75.4	Confident	68.6	Low	143 Å²	143	55.1 Å²	55.1	66%	0.662	30%	0.295	S	S	*	.			trans	54	21.5	-171.7	-57.7	-41.2	0	0	0	114.5	L493 Q495 V496 Q500	L493-H498 PolarHBondContact O-N 3.12Å; Q495-H498 PolarHBondContact O-CE1 2.67Å; Q495-H498 VanDerWaalsContact O-CE1 3.23Å; V496-H498 VanDerWaalsContact C-N 3.33Å; H498-Q500 PolarHBondContact O-N 3.22Å; H498-Q500 VanDerWaalsContact O-N 3.15Å
499	D	71.2	Confident	66.6	Low	22 Å²	22	56.6 Å²	56.6	12%	0.118	31%	0.306	C	S	.	.			trans	-87.6	84.7	-176.7	-88.5	-21.3	0	0	0	110.5	L493 H494 C497 T501 V548 K552	L493-D499 PolarHBondContact O-N 3.49Å; H494-D499 PolarHBondContact CD2-O 3.11Å; C497-D499 HydrophobicContact CB-CB 4.22Å; C497-D499 PolarHBondContact O-N 3.48Å; C497-D499 VanDerWaalsContact O-N 3.09Å; D499-T501 PolarHBondContact O-N 3.28Å; D499-V548 WeakPolarHBondContact OD2-CG1 3.47Å; D499-K552 IonicContact OD1-NZ 3.65Å; D499-K552 PolarHBondContact OD1-NZ 3.27Å; D499-K552 IonicContact OD2-NZ 2.73Å; D499-K552 PolarHBondContact OD2-NZ 3.47Å
500	Q	62.3	Low	64.6	Low	161 Å²	161	58.7 Å²	58.7	75%	0.752	32%	0.318	S	S	*	.			trans	-73.6	4.4	172.7	-66.1	-172.6	-9.5	0	0	113.8	H498 P502	H498-Q500 PolarHBondContact O-N 3.22Å; H498-Q500 VanDerWaalsContact O-N 3.15Å; Q500-P502 WeakPolarHBondContact O-CD 3.5Å
501	T	61.2	Low	62.7	Low	79 Å²	79	66 Å²	66	49%	0.485	35%	0.35	S	S	.	.			trans	-66.9	105.3	-177.1	41.9	0	0	0	0	110.6	D499 T503 Y544	D499-T501 PolarHBondContact O-N 3.28Å; T501-T503 PolarHBondContact O-N 3.1Å; T501-Y544 PolarHBondContact OG1-OH 3.17Å
502	P	53.2	Low	60.6	Low	80 Å²	80	69.1 Å²	69.1	52%	0.519	37%	0.372	S	S	.	.			trans	-77.2	124.6	-174.3	28.7	-23.9	0	0	0	108.4	Q500 T504 I507	Q500-P502 WeakPolarHBondContact O-CD 3.5Å; P502-T504 PolarHBondContact O-N 3.34Å; P502-I507 HydrophobicContact CB-CD1 3.78Å; P502-I507 HydrophobicContact CB-CG1 3.97Å; P502-I507 HydrophobicContact CG-CD1 3.65Å; P502-I507 HydrophobicContact CG-CG1 4.39Å
503	T	54.5	Low	58.7	Low	35 Å²	35	71 Å²	71	22%	0.215	39%	0.387	C	S	.	.			trans	-53.8	110.8	-178.9	-26.8	0	0	0	0	108.5	T501 K505 M506 E540	T501-T503 PolarHBondContact O-N 3.1Å; T503-K505 PolarHBondContact O-N 2.67Å; T503-M506 WeakPolarHBondContact O-CB 3.49Å; T503-M506 PolarHBondContact O-N 2.79Å; T503-M506 PolarHBondContact OG1-SD 2.94Å; T503-M506 VanDerWaalsContact OG1-SD 3.42Å; T503-E540 HydrophobicContact CG2-CG 4.33Å
504	T	46.7	Very low	56.8	Low	121 Å²	121	78.8 Å²	78.8	74%	0.742	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-13.1	-159	-38.8	0	0	0	0	114.1	P502	P502-T504 PolarHBondContact O-N 3.34Å
505	K	50.2	Low	55.1	Low	142 Å²	142	77.5 Å²	77.5	62%	0.617	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-29	172.1	-55.3	179.9	-159.1	151.4	0	113.9	T503 A508 E540	T503-K505 PolarHBondContact O-N 2.67Å; K505-A508 WeakPolarHBondContact O-CB 3.22Å; K505-E540 WeakPolarHBondContact CD-OE1 3.37Å; K505-E540 IonicContact NZ-OE1 2.87Å; K505-E540 PolarHBondContact NZ-OE1 3.25Å
506	M	48.2	Very low	53.6	Low	19 Å²	19	78.8 Å²	78.8	9%	0.094	44%	0.437	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-41.1	180	-68.2	178.3	113.9	0	0	111.3	Y435 I490 T503 A508 V509 A537 T541	Y435-M506 HydrophobicContact CD1-CB 3.74Å; Y435-M506 HydrophobicContact CD1-CE 3.78Å; Y435-M506 HydrophobicContact CD1-CG 4.08Å; Y435-M506 HydrophobicContact CD1-SD 4.33Å; Y435-M506 HydrophobicContact CE1-CB 3.98Å; Y435-M506 HydrophobicContact CE1-CE 3.94Å; Y435-M506 HydrophobicContact CE1-CG 4.1Å; I490-M506 HydrophobicContact CD1-CE 4.47Å; T503-M506 WeakPolarHBondContact O-CB 3.49Å; T503-M506 PolarHBondContact O-N 2.79Å; T503-M506 PolarHBondContact OG1-SD 2.94Å; T503-M506 VanDerWaalsContact OG1-SD 3.42Å; M506-A508 PolarHBondContact O-N 2.62Å; M506-A508 VanDerWaalsContact O-N 3.12Å; M506-V509 PolarHBondContact O-N 3.19Å; M506-A537 HydrophobicContact CE-CB 4.36Å; M506-T541 HydrophobicContact CE-CG2 3.39Å; M506-T541 HydrophobicContact SD-CG2 4.12Å
507	I	47.4	Very low	51.9	Low	69 Å²	69	85.4 Å²	85.4	35%	0.354	47%	0.466	S	S	.	.	H	α-helix	trans	-57.9	-28.8	177.8	-42.7	170.2	0	0	0	112.3	P502 V509 T510	P502-I507 HydrophobicContact CB-CD1 3.78Å; P502-I507 HydrophobicContact CB-CG1 3.97Å; P502-I507 HydrophobicContact CG-CD1 3.65Å; P502-I507 HydrophobicContact CG-CG1 4.39Å; I507-V509 PolarHBondContact O-N 2.8Å; I507-T510 WeakPolarHBondContact CA-OG1 3.49Å; I507-T510 PolarHBondContact O-OG1 3.49Å
508	A	42.6	Very low	50.7	Low	67 Å²	67	89 Å²	89	55%	0.554	49%	0.485	S	S	*	.	H	α-helix	trans	-66.7	-24.8	178.1	0	0	0	0	0	112.7	K505 M506	K505-A508 WeakPolarHBondContact O-CB 3.22Å; M506-A508 PolarHBondContact O-N 2.62Å; M506-A508 VanDerWaalsContact O-N 3.12Å
509	V	46.1	Very low	49.5	Very low	57 Å²	57	83.1 Å²	83.1	35%	0.345	46%	0.461	S	S	.	.	H	α-helix	trans	-88.2	-35.4	-179.3	-172.4	0	0	0	0	111.9	Y435 M506 I507 K511 S512 A513	Y435-V509 HydrophobicContact CE2-CB 4.31Å; Y435-V509 HydrophobicContact CE2-CG1 4.21Å; Y435-V509 WeakPolarHBondContact OH-CG1 3.49Å; M506-V509 PolarHBondContact O-N 3.19Å; I507-V509 PolarHBondContact O-N 2.8Å; V509-K511 PolarHBondContact O-N 2.91Å; V509-S512 PolarHBondContact O-N 2.7Å; V509-S512 PolarHBondContact O-OG 3Å; V509-S512 VanDerWaalsContact O-OG 3.13Å; V509-A513 PolarHBondContact O-N 3.35Å
510	T	45.2	Very low	48.4	Very low	44 Å²	44	84 Å²	84	27%	0.27	47%	0.472	S	S	.	.	H	α-helix	trans	-57.1	-37	173.8	32.5	0	0	0	0	112	Y435 I507 S512 A513	Y435-T510 HydrophobicContact CD2-CG2 3.7Å; Y435-T510 HydrophobicContact CE2-CG2 4.47Å; Y435-T510 HydrophobicContact CG-CG2 4.15Å; I507-T510 WeakPolarHBondContact CA-OG1 3.49Å; I507-T510 PolarHBondContact O-OG1 3.49Å; T510-S512 VanDerWaalsContact C-N 3.26Å; T510-S512 PolarHBondContact O-N 3.39Å; T510-A513 PolarHBondContact O-N 2.9Å
511	K	45.5	Very low	47.9	Very low	166 Å²	166	82.3 Å²	82.3	72%	0.722	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-7.7	177.9	-69.8	-166.4	174.8	-171.2	0	115.5	V509	V509-K511 PolarHBondContact O-N 2.91Å
512	S	41.8	Very low	47.5	Very low	73 Å²	73	80.7 Å²	80.7	51%	0.51	46%	0.456	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.1	10.2	173.4	63	0	0	0	0	113.3	V509 T510	V509-S512 PolarHBondContact O-N 2.7Å; V509-S512 PolarHBondContact O-OG 3Å; V509-S512 VanDerWaalsContact O-OG 3.13Å; T510-S512 VanDerWaalsContact C-N 3.26Å; T510-S512 PolarHBondContact O-N 3.39Å
513	A	44.2	Very low	47.5	Very low	38 Å²	38	77.4 Å²	77.4	31%	0.314	43%	0.434	S	S	.	.	S	Bend	trans	-106.5	-4.7	179.5	0	0	0	0	0	114.2	V509 T510 S515	V509-A513 PolarHBondContact O-N 3.35Å; T510-A513 PolarHBondContact O-N 2.9Å; A513-S515 VanDerWaalsContact C-N 3.29Å; A513-S515 PolarHBondContact O-N 3.03Å
514	E	44.6	Very low	47.7	Very low	171 Å²	171	80 Å²	80	80%	0.799	45%	0.449	S	S	*	.	S	Bend	trans	-78	-8.3	-175	-62.3	-177.7	165.2	0	0	114.2
515	S	46.7	Very low	48	Very low	38 Å²	38	77.7 Å²	77.7	27%	0.266	43%	0.433	S	S	.	.			trans	-96.2	126.8	-176.6	157.5	0	0	0	0	112.1	A513 Q517 D518 A519	A513-S515 VanDerWaalsContact C-N 3.29Å; A513-S515 PolarHBondContact O-N 3.03Å; S515-Q517 PolarHBondContact O-N 3.22Å; S515-Q517 PolarHBondContact OG-N 3.19Å; S515-D518 WeakPolarHBondContact CB-OD2 3.07Å; S515-D518 PolarHBondContact OG-N 2.96Å; S515-D518 PolarHBondContact OG-OD2 3.47Å; S515-A519 PolarHBondContact O-N 2.83Å
516	P	45.8	Very low	48.2	Very low	102 Å²	102	71.7 Å²	71.7	66%	0.662	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-7.1	177.9	31.3	-35.6	0	0	0	113.7
517	Q	44	Very low	48.7	Very low	162 Å²	162	76.5 Å²	76.5	76%	0.757	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-44.3	173.9	-67.2	-174	-71.4	0	0	110.8	S515 A519 A520	S515-Q517 PolarHBondContact O-N 3.22Å; S515-Q517 PolarHBondContact OG-N 3.19Å; Q517-A519 PolarHBondContact O-N 2.85Å; Q517-A520 PolarHBondContact O-N 2.68Å; Q517-A520 VanDerWaalsContact O-N 3.09Å
518	D	48.9	Very low	49.3	Very low	80 Å²	80	79.8 Å²	79.8	43%	0.428	45%	0.448	S	S	.	.	H	α-helix	trans	-58.6	-31.3	173.7	-63.8	-85.7	0	0	0	111.6	S515 A520 D521 L522	S515-D518 WeakPolarHBondContact CB-OD2 3.07Å; S515-D518 PolarHBondContact OG-N 2.96Å; S515-D518 PolarHBondContact OG-OD2 3.47Å; D518-A520 VanDerWaalsContact C-N 3.27Å; D518-A520 PolarHBondContact O-N 2.67Å; D518-D521 PolarHBondContact O-N 3.25Å; D518-L522 HydrophobicContact CB-CD1 4.46Å; D518-L522 WeakPolarHBondContact O-CB 3.19Å; D518-L522 WeakPolarHBondContact O-CG 3.29Å; D518-L522 PolarHBondContact O-N 3.17Å
519	A	48.5	Very low	50.4	Low	20 Å²	20	78.2 Å²	78.2	17%	0.165	43%	0.434	C	S	.	.	H	α-helix	trans	-59.8	-29.3	176.3	0	0	0	0	0	114.6	S515 Q517 F523	S515-A519 PolarHBondContact O-N 2.83Å; Q517-A519 PolarHBondContact O-N 2.85Å; A519-F523 PolarHBondContact O-N 3.25Å
520	A	47.8	Very low	51.6	Low	41 Å²	41	76.3 Å²	76.3	34%	0.339	42%	0.422	S	S	.	.	H	α-helix	trans	-79.7	-42.3	-179.9	0	0	0	0	0	112.2	Q517 D518 F523 T524	Q517-A520 PolarHBondContact O-N 2.68Å; Q517-A520 VanDerWaalsContact O-N 3.09Å; D518-A520 VanDerWaalsContact C-N 3.27Å; D518-A520 PolarHBondContact O-N 2.67Å; A520-F523 PolarHBondContact O-N 3.45Å; A520-T524 PolarHBondContact O-N 2.96Å; A520-T524 PolarHBondContact O-OG1 3.24Å
521	D	53.1	Low	53.1	Low	125 Å²	125	77 Å²	77	67%	0.668	42%	0.421	S	S	*	.	H	α-helix	trans	-67.2	-42.4	172.6	-72.1	-20.9	0	0	0	110.2	D518 F523 T524 D525	D518-D521 PolarHBondContact O-N 3.25Å; D521-F523 VanDerWaalsContact C-N 3.31Å; D521-F523 PolarHBondContact O-N 3Å; D521-T524 PolarHBondContact O-N 3.29Å; D521-D525 WeakPolarHBondContact O-CB 3.14Å; D521-D525 PolarHBondContact O-N 2.99Å
522	L	52.6	Low	54.7	Low	44 Å²	44	71.1 Å²	71.1	23%	0.23	41%	0.408	C	S	.	.	H	α-helix	trans	-56.1	-41.1	171.3	-79.4	168.6	0	0	0	112.1	D518 T524 D525 L526	D518-L522 HydrophobicContact CB-CD1 4.46Å; D518-L522 WeakPolarHBondContact O-CB 3.19Å; D518-L522 WeakPolarHBondContact O-CG 3.29Å; D518-L522 PolarHBondContact O-N 3.17Å; L522-T524 PolarHBondContact O-N 2.71Å; L522-D525 CarbonylContact O-C 3.51Å; L522-D525 PolarHBondContact O-N 2.73Å; L522-L526 WeakPolarHBondContact O-CA 3.44Å; L522-L526 WeakPolarHBondContact O-CB 3.43Å; L522-L526 WeakPolarHBondContact O-CD1 3.42Å; L522-L526 PolarHBondContact O-N 2.97Å
523	F	54.1	Low	56.5	Low	12 Å²	12	71.8 Å²	71.8	5%	0.053	40%	0.402	C	S	.	.	H	α-helix	trans	-66.1	-25.8	178.2	-151.6	-87.1	0	0	0	113	L419 S423 L427 F474 A519 A520 D521 L526	L419-F523 HydrophobicContact CD1-CZ 4.46Å; L419-F523 HydrophobicContact CD2-CE1 3.56Å; L419-F523 HydrophobicContact CD2-CZ 3.95Å; L419-F523 HydrophobicContact CG-CE1 3.65Å; L419-F523 HydrophobicContact CG-CZ 3.77Å; S423-F523 WeakPolarHBondContact OG-CD2 3.29Å; S423-F523 WeakPolarHBondContact OG-CE2 3.49Å; L427-F523 HydrophobicContact CD1-CD2 4.07Å; L427-F523 HydrophobicContact CD1-CE2 4.4Å; F474-F523 HydrophobicContact CD1-CZ 4.4Å; F474-F523 HydrophobicContact CE1-CZ 4.24Å; F474-F523 HydrophobicContact CE2-CE2 4.47Å; F474-F523 HydrophobicContact CE2-CZ 4.45Å; F474-F523 HydrophobicContact CZ-CE2 4.37Å; F474-F523 HydrophobicContact CZ-CZ 4.27Å; A519-F523 PolarHBondContact O-N 3.25Å; A520-F523 PolarHBondContact O-N 3.45Å; D521-F523 VanDerWaalsContact C-N 3.31Å; D521-F523 PolarHBondContact O-N 3Å; F523-L526 HydrophobicContact CB-CD1 4.49Å; F523-L526 HydrophobicContact CD2-CD1 3.74Å; F523-L526 HydrophobicContact CE2-CD1 4.18Å; F523-L526 HydrophobicContact CG-CD1 4.37Å; F523-L526 WeakPolarHBondContact O-CB 3.34Å
524	T	57.2	Low	58.3	Low	89 Å²	89	70.2 Å²	70.2	55%	0.546	39%	0.388	S	S	.	.	H	α-helix	trans	-85.2	-30.2	177.4	-49.6	0	0	0	0	111.8	Q416 A520 D521 L522 L526	Q416-T524 PolarHBondContact NE2-OG1 3.36Å; A520-T524 PolarHBondContact O-N 2.96Å; A520-T524 PolarHBondContact O-OG1 3.24Å; D521-T524 PolarHBondContact O-N 3.29Å; L522-T524 PolarHBondContact O-N 2.71Å; T524-L526 VanDerWaalsContact C-N 3.3Å
525	D	53.6	Low	60.3	Low	73 Å²	73	64.6 Å²	64.6	39%	0.39	36%	0.364	S	S	.	.	H	α-helix	trans	-74.5	-18.5	169	-167.9	47.5	0	0	0	112.4	D521 L522 E527 N528 A529 K533	D521-D525 WeakPolarHBondContact O-CB 3.14Å; D521-D525 PolarHBondContact O-N 2.99Å; L522-D525 CarbonylContact O-C 3.51Å; L522-D525 PolarHBondContact O-N 2.73Å; D525-E527 PolarHBondContact O-N 3.42Å; D525-N528 PolarHBondContact O-N 3.14Å; D525-A529 WeakPolarHBondContact O-CB 3.48Å; D525-A529 PolarHBondContact O-N 3.34Å; D525-A529 WeakPolarHBondContact OD1-CB 3.49Å; D525-A529 WeakPolarHBondContact OD2-CB 3.19Å; D525-K533 IonicContact OD2-NZ 3.44Å; D525-K533 PolarHBondContact OD2-NZ 3.06Å
526	L	54.2	Low	62.1	Low	16 Å²	16	65.7 Å²	65.7	8%	0.084	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-29.7	-164.5	-126.6	143.8	0	0	0	115	L427 L522 F523 T524 N528 F530	L427-L526 HydrophobicContact CD1-CD1 3.72Å; L427-L526 HydrophobicContact CD2-CD1 3.98Å; L427-L526 HydrophobicContact CD2-CD2 4.32Å; L522-L526 WeakPolarHBondContact O-CA 3.44Å; L522-L526 WeakPolarHBondContact O-CB 3.43Å; L522-L526 WeakPolarHBondContact O-CD1 3.42Å; L522-L526 PolarHBondContact O-N 2.97Å; F523-L526 HydrophobicContact CB-CD1 4.49Å; F523-L526 HydrophobicContact CD2-CD1 3.74Å; F523-L526 HydrophobicContact CE2-CD1 4.18Å; F523-L526 HydrophobicContact CG-CD1 4.37Å; F523-L526 WeakPolarHBondContact O-CB 3.34Å; T524-L526 VanDerWaalsContact C-N 3.3Å; L526-N528 PolarHBondContact O-N 3.09Å; L526-F530 HydrophobicContact CB-CB 4.38Å; L526-F530 HydrophobicContact CD2-CB 3.69Å; L526-F530 HydrophobicContact CD2-CD1 3.3Å; L526-F530 HydrophobicContact CD2-CD2 3.85Å; L526-F530 HydrophobicContact CD2-CE1 3.65Å; L526-F530 HydrophobicContact CD2-CE2 4.17Å; L526-F530 HydrophobicContact CD2-CG 3.38Å; L526-F530 HydrophobicContact CD2-CZ 4.06Å; L526-F530 HydrophobicContact CG-CB 3.79Å; L526-F530 HydrophobicContact CG-CD1 4.28Å; L526-F530 HydrophobicContact CG-CD2 4.06Å; L526-F530 HydrophobicContact CG-CG 3.85Å; L526-F530 VanDerWaalsContact O-CB 3.24Å; L526-F530 WeakPolarHBondContact O-CB 3.47Å
527	E	58.1	Low	64	Low	120 Å²	120	61.3 Å²	61.3	56%	0.561	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-16.1	-178.3	-64	-162.9	144.4	0	0	113.1	H401 D525	H401-E527 IonicContact CE1-OE1 2.66Å; H401-E527 PolarHBondContact CE1-OE1 2.96Å; H401-E527 IonicContact NE2-OE1 2.84Å; D525-E527 PolarHBondContact O-N 3.42Å
528	N	61.3	Low	66.1	Low	138 Å²	138	55 Å²	55	74%	0.738	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.4	-45.4	-180	-68.7	-76.5	0	0	0	114.6	D525 L526 Q531	D525-N528 PolarHBondContact O-N 3.14Å; L526-N528 PolarHBondContact O-N 3.09Å; N528-Q531 WeakPolarHBondContact O-CB 3.37Å
529	A	65.4	Low	67.9	Low	33 Å²	33	56.5 Å²	56.5	27%	0.273	32%	0.32	S	S	.	.	H	α-helix	trans	-79.9	-27.6	-174.2	0	0	0	0	0	113.3	D525 Q531 G532 K533	D525-A529 WeakPolarHBondContact O-CB 3.48Å; D525-A529 PolarHBondContact O-N 3.34Å; D525-A529 WeakPolarHBondContact OD1-CB 3.49Å; D525-A529 WeakPolarHBondContact OD2-CB 3.19Å; A529-Q531 VanDerWaalsContact C-N 3.26Å; A529-Q531 PolarHBondContact O-N 2.98Å; A529-G532 PolarHBondContact O-N 3.47Å; A529-K533 WeakPolarHBondContact O-CG 3.42Å; A529-K533 PolarHBondContact O-N 2.89Å; A529-K533 VanDerWaalsContact O-N 3.08Å
530	F	70.6	Confident	69.7	Low	18 Å²	18	58.3 Å²	58.3	8%	0.079	33%	0.325	C	S	.	.	H	α-helix	trans	-64.1	-32.1	173.7	-174	-111.5	0	0	0	112.4	L427 L430 Y431 L526 G532 K533 I534	L427-F530 HydrophobicContact CD2-CE2 4.23Å; L427-F530 HydrophobicContact CD2-CZ 3.96Å; L430-F530 HydrophobicContact CD1-CE1 4.25Å; L430-F530 HydrophobicContact CD1-CZ 3.78Å; L430-F530 HydrophobicContact CD2-CE2 3.99Å; L430-F530 HydrophobicContact CD2-CZ 3.53Å; L430-F530 HydrophobicContact CG-CZ 4.33Å; Y431-F530 HydrophobicContact CE1-CE2 4.39Å; L526-F530 HydrophobicContact CB-CB 4.38Å; L526-F530 HydrophobicContact CD2-CB 3.69Å; L526-F530 HydrophobicContact CD2-CD1 3.3Å; L526-F530 HydrophobicContact CD2-CD2 3.85Å; L526-F530 HydrophobicContact CD2-CE1 3.65Å; L526-F530 HydrophobicContact CD2-CE2 4.17Å; L526-F530 HydrophobicContact CD2-CG 3.38Å; L526-F530 HydrophobicContact CD2-CZ 4.06Å; L526-F530 HydrophobicContact CG-CB 3.79Å; L526-F530 HydrophobicContact CG-CD1 4.28Å; L526-F530 HydrophobicContact CG-CD2 4.06Å; L526-F530 HydrophobicContact CG-CG 3.85Å; L526-F530 VanDerWaalsContact O-CB 3.24Å; L526-F530 WeakPolarHBondContact O-CB 3.47Å; F530-G532 PolarHBondContact O-N 3.44Å; F530-K533 PolarHBondContact O-N 3.5Å; F530-I534 HydrophobicContact CD1-CD1 3.68Å; F530-I534 HydrophobicContact CD1-CG1 4.37Å; F530-I534 HydrophobicContact CE1-CD1 3.37Å; F530-I534 HydrophobicContact CE1-CG1 4.26Å; F530-I534 HydrophobicContact CG-CD1 4.46Å; F530-I534 HydrophobicContact CZ-CD1 3.9Å; F530-I534 HydrophobicContact CZ-CG1 4.46Å; F530-I534 PolarHBondContact O-N 2.91Å
531	Q	76.4	Confident	71.5	Confident	57 Å²	57	56.6 Å²	56.6	27%	0.266	31%	0.31	S	S	.	.	H	α-helix	trans	-55.3	-51.4	171.5	-177.2	55.7	54.6	0	0	111	Q479 N528 A529 K533 I534 D535	Q479-Q531 VanDerWaalsContact CD-CD 3.42Å; Q479-Q531 VanDerWaalsContact NE2-NE2 3.11Å; N528-Q531 WeakPolarHBondContact O-CB 3.37Å; A529-Q531 VanDerWaalsContact C-N 3.26Å; A529-Q531 PolarHBondContact O-N 2.98Å; Q531-K533 VanDerWaalsContact C-N 3.32Å; Q531-K533 PolarHBondContact O-N 3.47Å; Q531-I534 PolarHBondContact O-N 2.97Å; Q531-D535 PolarHBondContact NE2-OD1 2.82Å; Q531-D535 VanDerWaalsContact NE2-OD1 3.17Å; Q531-D535 PolarHBondContact NE2-OD2 3.46Å; Q531-D535 WeakPolarHBondContact O-CB 3.25Å; Q531-D535 PolarHBondContact O-N 3.29Å
532	G	79.9	Confident	73.2	Confident	43 Å²	43	50.7 Å²	50.7	44%	0.443	28%	0.279	S	S	.	.	H	α-helix	trans	-64.2	-34.1	176.6	0	0	0	0	0	113.4	A529 F530 A536	A529-G532 PolarHBondContact O-N 3.47Å; F530-G532 PolarHBondContact O-N 3.44Å; G532-A536 VanDerWaalsContact O-CB 3.24Å; G532-A536 WeakPolarHBondContact O-CB 3.29Å; G532-A536 PolarHBondContact O-N 3.12Å
533	K	79.3	Confident	74.9	Confident	88 Å²	88	54 Å²	54	38%	0.383	29%	0.291	S	S	.	.	H	α-helix	trans	-67.1	-42.1	175.3	-67.5	162.9	-175.8	163.8	0	111.5	D525 A529 F530 Q531 A537	D525-K533 IonicContact OD2-NZ 3.44Å; D525-K533 PolarHBondContact OD2-NZ 3.06Å; A529-K533 WeakPolarHBondContact O-CG 3.42Å; A529-K533 PolarHBondContact O-N 2.89Å; A529-K533 VanDerWaalsContact O-N 3.08Å; F530-K533 PolarHBondContact O-N 3.5Å; Q531-K533 VanDerWaalsContact C-N 3.32Å; Q531-K533 PolarHBondContact O-N 3.47Å; K533-A537 WeakPolarHBondContact O-CB 3.37Å; K533-A537 PolarHBondContact O-N 2.96Å; K533-A537 VanDerWaalsContact O-N 3.08Å
534	I	83.3	Confident	76.5	Confident	5 Å²	5	56.3 Å²	56.3	3%	0.026	30%	0.3	C	S	.	.	H	α-helix	trans	-66.2	-46.9	173.6	-72.8	175.8	0	0	0	111.1	I434 K482 V483 I486 F530 Q531 A536 A537 Y538	I434-I534 HydrophobicContact CD1-CG1 4.31Å; K482-I534 HydrophobicContact CB-CG2 4.22Å; V483-I534 HydrophobicContact CG2-CD1 3.85Å; V483-I534 HydrophobicContact CG2-CG1 4.46Å; V483-I534 HydrophobicContact CG2-CG2 4.29Å; I486-I534 HydrophobicContact CD1-CG2 4.26Å; F530-I534 HydrophobicContact CD1-CD1 3.68Å; F530-I534 HydrophobicContact CD1-CG1 4.37Å; F530-I534 HydrophobicContact CE1-CD1 3.37Å; F530-I534 HydrophobicContact CE1-CG1 4.26Å; F530-I534 HydrophobicContact CG-CD1 4.46Å; F530-I534 HydrophobicContact CZ-CD1 3.9Å; F530-I534 HydrophobicContact CZ-CG1 4.46Å; F530-I534 PolarHBondContact O-N 2.91Å; Q531-I534 PolarHBondContact O-N 2.97Å; I534-A536 VanDerWaalsContact C-N 3.32Å; I534-A536 PolarHBondContact O-N 3.01Å; I534-A537 PolarHBondContact O-N 3.39Å; I534-Y538 VanDerWaalsContact O-CB 3.31Å; I534-Y538 WeakPolarHBondContact O-CB 3.33Å; I534-Y538 PolarHBondContact O-N 3.19Å
535	D	85.8	Confident	78	Confident	53 Å²	53	52.1 Å²	52.1	28%	0.283	27%	0.274	S	S	.	.	H	α-helix	trans	-64.9	-35.5	-178.4	-72.5	-26.5	0	0	0	112.5	K482 Q531 F539	K482-D535 WeakPolarHBondContact CD-OD1 3.3Å; K482-D535 IonicContact NZ-OD1 2.65Å; K482-D535 PolarHBondContact NZ-OD1 2.79Å; K482-D535 IonicContact NZ-OD2 3.63Å; Q531-D535 PolarHBondContact NE2-OD1 2.82Å; Q531-D535 VanDerWaalsContact NE2-OD1 3.17Å; Q531-D535 PolarHBondContact NE2-OD2 3.46Å; Q531-D535 WeakPolarHBondContact O-CB 3.25Å; Q531-D535 PolarHBondContact O-N 3.29Å; D535-F539 WeakPolarHBondContact O-CB 3.41Å; D535-F539 PolarHBondContact O-N 2.77Å
536	A	85.3	Confident	79.7	Confident	61 Å²	61	49.5 Å²	49.5	50%	0.504	26%	0.26	S	S	.	.	H	α-helix	trans	-67.8	-44.4	172.4	0	0	0	0	0	112.2	G532 I534 F539 E540	G532-A536 VanDerWaalsContact O-CB 3.24Å; G532-A536 WeakPolarHBondContact O-CB 3.29Å; G532-A536 PolarHBondContact O-N 3.12Å; I534-A536 VanDerWaalsContact C-N 3.32Å; I534-A536 PolarHBondContact O-N 3.01Å; A536-F539 PolarHBondContact O-N 2.67Å; A536-E540 WeakPolarHBondContact O-CB 3.29Å; A536-E540 PolarHBondContact O-N 2.95Å
537	A	84.1	Confident	81.3	Confident	9 Å²	9	51.6 Å²	51.6	7%	0.074	27%	0.271	C	S	.	.	H	α-helix	trans	-63.6	-40.7	176.6	0	0	0	0	0	111.9	I434 I486 M506 K533 I534 T541	I434-A537 HydrophobicContact CG2-CB 4.18Å; I486-A537 HydrophobicContact CD1-CB 4.34Å; M506-A537 HydrophobicContact CE-CB 4.36Å; K533-A537 WeakPolarHBondContact O-CB 3.37Å; K533-A537 PolarHBondContact O-N 2.96Å; K533-A537 VanDerWaalsContact O-N 3.08Å; I534-A537 PolarHBondContact O-N 3.39Å; A537-T541 WeakPolarHBondContact O-CB 3.2Å; A537-T541 VanDerWaalsContact O-CG2 3.29Å; A537-T541 WeakPolarHBondContact O-CG2 3.26Å; A537-T541 PolarHBondContact O-N 3.44Å; A537-T541 PolarHBondContact O-OG1 2.97Å
538	Y	88	Confident	82.8	Confident	31 Å²	31	46.2 Å²	46.2	12%	0.122	25%	0.247	C	C	.	.	H	α-helix	trans	-56	-56.8	172	-176.6	-88.1	0	0	0	111	K482 L485 I486 I534 E540 T541 S542 D743	K482-Y538 HydrophobicContact CB-CD2 3.7Å; K482-Y538 HydrophobicContact CB-CE2 4.03Å; K482-Y538 HydrophobicContact CD-CD2 4.19Å; K482-Y538 HydrophobicContact CD-CE2 4.46Å; K482-Y538 HydrophobicContact CD-CG 4.39Å; K482-Y538 HydrophobicContact CG-CD2 3.82Å; K482-Y538 HydrophobicContact CG-CE2 3.81Å; K482-Y538 HydrophobicContact CG-CG 4.5Å; L485-Y538 HydrophobicContact CB-CE2 4.25Å; L485-Y538 HydrophobicContact CD2-CE2 3.89Å; L485-Y538 HydrophobicContact CG-CE2 4.23Å; I486-Y538 HydrophobicContact CG1-CD2 4.13Å; I534-Y538 VanDerWaalsContact O-CB 3.31Å; I534-Y538 WeakPolarHBondContact O-CB 3.33Å; I534-Y538 PolarHBondContact O-N 3.19Å; Y538-E540 PolarHBondContact O-N 3.36Å; Y538-T541 PolarHBondContact O-N 2.94Å; Y538-T541 PolarHBondContact O-OG1 2.98Å; Y538-S542 WeakPolarHBondContact O-CB 3.42Å; Y538-S542 PolarHBondContact O-N 3.49Å; Y538-S542 PolarHBondContact O-OG 3.48Å; Y538-D743 WeakPolarHBondContact CE1-OD1 3.47Å; Y538-D743 PolarHBondContact OH-OD1 3.26Å; Y538-D743 PolarHBondContact OH-OD2 3.25Å
539	F	87.1	Confident	84	Confident	110 Å²	110	39.7 Å²	39.7	48%	0.482	21%	0.212	S	C	.	.	H	α-helix	trans	-65.4	-35.9	-177.3	-174.2	-98.8	0	0	0	113.2	D535 A536 K543	D535-F539 WeakPolarHBondContact O-CB 3.41Å; D535-F539 PolarHBondContact O-N 2.77Å; A536-F539 PolarHBondContact O-N 2.67Å; F539-K543 HydrophobicContact CE1-CD 4.32Å; F539-K543 HydrophobicContact CZ-CD 4.44Å; F539-K543 WeakPolarHBondContact O-CB 3.34Å; F539-K543 PolarHBondContact O-N 3.4Å
540	E	85.8	Confident	85.1	Confident	58 Å²	58	40.4 Å²	40.4	27%	0.271	21%	0.211	S	C	.	.	H	α-helix	trans	-70.3	-41.6	175.7	-171.7	157.3	-129.9	0	0	111.9	T503 K505 A536 Y538 Y544	T503-E540 HydrophobicContact CG2-CG 4.33Å; K505-E540 WeakPolarHBondContact CD-OE1 3.37Å; K505-E540 IonicContact NZ-OE1 2.87Å; K505-E540 PolarHBondContact NZ-OE1 3.25Å; A536-E540 WeakPolarHBondContact O-CB 3.29Å; A536-E540 PolarHBondContact O-N 2.95Å; Y538-E540 PolarHBondContact O-N 3.36Å; E540-Y544 WeakPolarHBondContact O-CB 3.31Å; E540-Y544 PolarHBondContact O-N 2.87Å
541	T	86.7	Confident	85.9	Confident	5 Å²	5	46.4 Å²	46.4	3%	0.031	24%	0.237	C	C	.	.	H	α-helix	trans	-73	-48.5	-179.5	52.4	0	0	0	0	113.4	I486 I490 M506 A537 Y538 K543 Y544 L545	I486-T541 HydrophobicContact CG2-CG2 4.36Å; I490-T541 HydrophobicContact CD1-CG2 4.05Å; I490-T541 HydrophobicContact CG1-CG2 4.13Å; M506-T541 HydrophobicContact CE-CG2 3.39Å; M506-T541 HydrophobicContact SD-CG2 4.12Å; A537-T541 WeakPolarHBondContact O-CB 3.2Å; A537-T541 VanDerWaalsContact O-CG2 3.29Å; A537-T541 WeakPolarHBondContact O-CG2 3.26Å; A537-T541 PolarHBondContact O-N 3.44Å; A537-T541 PolarHBondContact O-OG1 2.97Å; Y538-T541 PolarHBondContact O-N 2.94Å; Y538-T541 PolarHBondContact O-OG1 2.98Å; T541-K543 PolarHBondContact O-N 3.17Å; T541-Y544 PolarHBondContact O-N 2.94Å; T541-L545 WeakPolarHBondContact O-CB 3.49Å; T541-L545 PolarHBondContact O-N 3.16Å
542	S	88.7	Confident	86.4	Confident	2 Å²	2	48.8 Å²	48.8	1%	0.014	25%	0.246	C	C	.	.	H	α-helix	trans	-61.3	-44.1	177.3	-64	0	0	0	0	111.6	Y538 Y544 L545 L546 Q742 D743	Y538-S542 WeakPolarHBondContact O-CB 3.42Å; Y538-S542 PolarHBondContact O-N 3.49Å; Y538-S542 PolarHBondContact O-OG 3.48Å; S542-Y544 VanDerWaalsContact C-N 3.35Å; S542-Y544 PolarHBondContact O-N 3.25Å; S542-L545 PolarHBondContact O-N 3.29Å; S542-L546 WeakPolarHBondContact O-CG 3.36Å; S542-L546 PolarHBondContact O-N 2.86Å; S542-Q742 WeakPolarHBondContact CB-O 3.46Å; S542-D743 WeakPolarHBondContact CB-OD1 3.38Å; S542-D743 PolarHBondContact OG-OD1 3.43Å
543	K	88	Confident	86.7	Confident	113 Å²	113	49.4 Å²	49.4	49%	0.491	24%	0.236	S	C	.	.	H	α-helix	trans	-62.7	-41.5	175	-177.5	177.2	176	178.4	0	111.8	F539 T541 L546 D547	F539-K543 HydrophobicContact CE1-CD 4.32Å; F539-K543 HydrophobicContact CZ-CD 4.44Å; F539-K543 WeakPolarHBondContact O-CB 3.34Å; F539-K543 PolarHBondContact O-N 3.4Å; T541-K543 PolarHBondContact O-N 3.17Å; K543-L546 PolarHBondContact O-N 2.86Å; K543-D547 WeakPolarHBondContact O-CB 3.46Å; K543-D547 PolarHBondContact O-N 3.02Å
544	Y	87.9	Confident	87.2	Confident	61 Å²	61	46.7 Å²	46.7	24%	0.239	23%	0.228	C	C	.	.	H	α-helix	trans	-65	-41.2	178	179.6	-109.4	0	0	0	112	L493 T501 E540 T541 S542 D547 V548	L493-Y544 HydrophobicContact CD1-CD1 3.72Å; L493-Y544 HydrophobicContact CD1-CE1 3.93Å; L493-Y544 HydrophobicContact CD2-CE1 4.32Å; T501-Y544 PolarHBondContact OG1-OH 3.17Å; E540-Y544 WeakPolarHBondContact O-CB 3.31Å; E540-Y544 PolarHBondContact O-N 2.87Å; T541-Y544 PolarHBondContact O-N 2.94Å; S542-Y544 VanDerWaalsContact C-N 3.35Å; S542-Y544 PolarHBondContact O-N 3.25Å; Y544-D547 PolarHBondContact O-N 3.27Å; Y544-V548 HydrophobicContact CD1-CG2 4.4Å; Y544-V548 HydrophobicContact CD2-CG2 4.41Å; Y544-V548 HydrophobicContact CE1-CG2 3.94Å; Y544-V548 HydrophobicContact CE2-CG2 3.96Å; Y544-V548 WeakPolarHBondContact O-CB 3.33Å; Y544-V548 WeakPolarHBondContact O-CG2 3.42Å; Y544-V548 PolarHBondContact O-N 3.27Å
545	L	88.8	Confident	87.6	Confident	1 Å²	1	46.5 Å²	46.5	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-58.2	-47.8	172.9	172	59.9	0	0	0	111.8	W460 F492 L493 T541 S542 V548 L549 L744	W460-L545 HydrophobicContact CH2-CD2 3.75Å; W460-L545 HydrophobicContact CZ3-CD2 4.07Å; F492-L545 HydrophobicContact CD1-CD1 3.53Å; F492-L545 HydrophobicContact CE1-CD1 3.77Å; L493-L545 HydrophobicContact CD1-CB 4.48Å; L493-L545 HydrophobicContact CD2-CD1 4.01Å; L493-L545 HydrophobicContact CG-CD1 4.13Å; T541-L545 WeakPolarHBondContact O-CB 3.49Å; T541-L545 PolarHBondContact O-N 3.16Å; S542-L545 PolarHBondContact O-N 3.29Å; L545-V548 PolarHBondContact O-N 2.73Å; L545-L549 HydrophobicContact CD1-CD1 3.81Å; L545-L549 HydrophobicContact CD1-CG 4.11Å; L545-L549 HydrophobicContact CG-CD1 4.05Å; L545-L549 WeakPolarHBondContact O-CB 3.37Å; L545-L549 WeakPolarHBondContact O-CG 3.46Å; L545-L549 PolarHBondContact O-N 3.35Å; L545-L744 HydrophobicContact CD2-CB 4.15Å; L545-L744 HydrophobicContact CD2-CD2 4.23Å
546	L	88.6	Confident	87.8	Confident	18 Å²	18	46.1 Å²	46.1	9%	0.094	23%	0.225	C	C	.	.	H	α-helix	trans	-65.3	-39.1	176.3	-66.6	-176.8	0	0	0	112.2	S542 K543 V548 L549 N550 Q742 L744 I747	S542-L546 WeakPolarHBondContact O-CG 3.36Å; S542-L546 PolarHBondContact O-N 2.86Å; K543-L546 PolarHBondContact O-N 2.86Å; L546-V548 VanDerWaalsContact C-N 3.34Å; L546-V548 PolarHBondContact O-N 3.38Å; L546-L549 PolarHBondContact O-N 2.85Å; L546-N550 VanDerWaalsContact O-CB 3.22Å; L546-N550 WeakPolarHBondContact O-CB 3.46Å; L546-N550 PolarHBondContact O-N 3.44Å; L546-N550 PolarHBondContact O-ND2 3.33Å; L546-N550 VanDerWaalsContact O-ND2 3.16Å; L546-Q742 WeakPolarHBondContact CD1-O 3.38Å; L546-L744 HydrophobicContact CD2-CD1 4.23Å; L546-I747 HydrophobicContact CD1-CD1 4.41Å; L546-I747 HydrophobicContact CD2-CD1 3.51Å
547	D	88.2	Confident	88.1	Confident	59 Å²	59	46.6 Å²	46.6	32%	0.316	22%	0.219	S	C	.	.	H	α-helix	trans	-62.3	-38.8	173.8	-103.2	-9.2	0	0	0	112	K543 Y544 K551	K543-D547 WeakPolarHBondContact O-CB 3.46Å; K543-D547 PolarHBondContact O-N 3.02Å; Y544-D547 PolarHBondContact O-N 3.27Å; D547-K551 WeakPolarHBondContact O-CB 3.35Å; D547-K551 WeakPolarHBondContact O-CD 3.11Å; D547-K551 WeakPolarHBondContact O-CG 3.49Å; D547-K551 PolarHBondContact O-N 3.06Å; D547-K551 WeakPolarHBondContact OD1-CE 3.34Å; D547-K551 IonicContact OD1-NZ 3.1Å; D547-K551 PolarHBondContact OD1-NZ 3.41Å; D547-K551 IonicContact OD2-NZ 3.72Å; D547-K551 PolarHBondContact OD2-NZ 2.9Å
548	V	89.3	Confident	88.4	Confident	7 Å²	7	46.2 Å²	46.2	4%	0.042	22%	0.216	C	C	.	.	H	α-helix	trans	-67.4	-50.8	175.4	163.9	0	0	0	0	110.9	L493 C497 D499 Y544 L545 L546 N550 K551 K552 Y553	L493-V548 HydrophobicContact CD2-CB 4.04Å; L493-V548 HydrophobicContact CD2-CG1 3.87Å; L493-V548 HydrophobicContact CD2-CG2 4.08Å; C497-V548 HydrophobicContact CB-CG1 4.26Å; D499-V548 WeakPolarHBondContact OD2-CG1 3.47Å; Y544-V548 HydrophobicContact CD1-CG2 4.4Å; Y544-V548 HydrophobicContact CD2-CG2 4.41Å; Y544-V548 HydrophobicContact CE1-CG2 3.94Å; Y544-V548 HydrophobicContact CE2-CG2 3.96Å; Y544-V548 WeakPolarHBondContact O-CB 3.33Å; Y544-V548 WeakPolarHBondContact O-CG2 3.42Å; Y544-V548 PolarHBondContact O-N 3.27Å; L545-V548 PolarHBondContact O-N 2.73Å; L546-V548 VanDerWaalsContact C-N 3.34Å; L546-V548 PolarHBondContact O-N 3.38Å; V548-N550 VanDerWaalsContact C-N 3.29Å; V548-N550 PolarHBondContact O-N 2.88Å; V548-K551 PolarHBondContact O-N 3.02Å; V548-K552 HydrophobicContact CG1-CD 4.35Å; V548-K552 WeakPolarHBondContact O-CB 3.48Å; V548-K552 PolarHBondContact O-N 2.95Å; V548-Y553 HydrophobicContact CG1-CD2 4.37Å; V548-Y553 HydrophobicContact CG1-CE2 4.18Å
549	L	87.6	Confident	88.6	Confident	1 Å²	1	44.9 Å²	44.9	1%	0.005	21%	0.21	C	C	.	.	H	α-helix	trans	-60.8	-36.6	179	-73.6	170.2	0	0	0	112.6	F492 L545 L546 Y553 S554 L555 P647 L744	F492-L549 HydrophobicContact CE1-CD2 4.14Å; F492-L549 HydrophobicContact CZ-CD2 4.44Å; L545-L549 HydrophobicContact CD1-CD1 3.81Å; L545-L549 HydrophobicContact CD1-CG 4.11Å; L545-L549 HydrophobicContact CG-CD1 4.05Å; L545-L549 WeakPolarHBondContact O-CB 3.37Å; L545-L549 WeakPolarHBondContact O-CG 3.46Å; L545-L549 PolarHBondContact O-N 3.35Å; L546-L549 PolarHBondContact O-N 2.85Å; L549-Y553 HydrophobicContact CD2-CD2 4.36Å; L549-Y553 CarbonylContact O-C 3.51Å; L549-Y553 WeakPolarHBondContact O-CA 3.42Å; L549-Y553 PolarHBondContact O-N 3.39Å; L549-S554 PolarHBondContact O-N 3.06Å; L549-S554 VanDerWaalsContact O-N 3.1Å; L549-L555 HydrophobicContact CB-CB 4.31Å; L549-L555 HydrophobicContact CB-CD2 4.15Å; L549-L555 HydrophobicContact CD1-CD2 4.34Å; L549-L555 PolarHBondContact O-N 2.76Å; L549-L555 VanDerWaalsContact O-N 3.13Å; L549-P647 HydrophobicContact CD2-CB 4.04Å; L549-L744 HydrophobicContact CD1-CD1 3.62Å; L549-L744 HydrophobicContact CD1-CD2 4.1Å; L549-L744 HydrophobicContact CD1-CG 4.46Å
550	N	88	Confident	88.8	Confident	48 Å²	48	42.9 Å²	42.9	26%	0.257	20%	0.203	S	C	.	.	H	α-helix	trans	-81	-27.7	179.6	-67.7	-23.5	0	0	0	113.7	L546 V548	L546-N550 VanDerWaalsContact O-CB 3.22Å; L546-N550 WeakPolarHBondContact O-CB 3.46Å; L546-N550 PolarHBondContact O-N 3.44Å; L546-N550 PolarHBondContact O-ND2 3.33Å; L546-N550 VanDerWaalsContact O-ND2 3.16Å; V548-N550 VanDerWaalsContact C-N 3.29Å; V548-N550 PolarHBondContact O-N 2.88Å
551	K	87.2	Confident	89.1	Confident	144 Å²	144	40.1 Å²	40.1	63%	0.626	19%	0.19	S	C	*	.	H	α-helix	trans	-101.4	-29.3	-175.4	-63.3	168.6	-164.6	169.7	0	114.8	D547 V548	D547-K551 WeakPolarHBondContact O-CB 3.35Å; D547-K551 WeakPolarHBondContact O-CD 3.11Å; D547-K551 WeakPolarHBondContact O-CG 3.49Å; D547-K551 PolarHBondContact O-N 3.06Å; D547-K551 WeakPolarHBondContact OD1-CE 3.34Å; D547-K551 IonicContact OD1-NZ 3.1Å; D547-K551 PolarHBondContact OD1-NZ 3.41Å; D547-K551 IonicContact OD2-NZ 3.72Å; D547-K551 PolarHBondContact OD2-NZ 2.9Å; V548-K551 PolarHBondContact O-N 3.02Å
552	K	86.3	Confident	89.3	Confident	107 Å²	107	39.9 Å²	39.9	47%	0.465	19%	0.188	S	C	.	.	H	α-helix	trans	-101.6	-29.3	178	-68.8	-174.5	179.1	166.1	0	113.3	D499 V548	D499-K552 IonicContact OD1-NZ 3.65Å; D499-K552 PolarHBondContact OD1-NZ 3.27Å; D499-K552 IonicContact OD2-NZ 2.73Å; D499-K552 PolarHBondContact OD2-NZ 3.47Å; V548-K552 HydrophobicContact CG1-CD 4.35Å; V548-K552 WeakPolarHBondContact O-CB 3.48Å; V548-K552 PolarHBondContact O-N 2.95Å
553	Y	87.2	Confident	89.5	Confident	56 Å²	56	42.5 Å²	42.5	22%	0.22	20%	0.198	C	C	.	.	S	Bend	trans	-123.6	13.5	-173.9	-57.6	-73.7	0	0	0	113.3	C497 V548 L549 L555 H558 P647	C497-Y553 WeakPolarHBondContact CA-OH 3.43Å; C497-Y553 HydrophobicContact CB-CE2 3.94Å; C497-Y553 PolarHBondContact O-OH 3.31Å; C497-Y553 VanDerWaalsContact O-OH 3.14Å; V548-Y553 HydrophobicContact CG1-CD2 4.37Å; V548-Y553 HydrophobicContact CG1-CE2 4.18Å; L549-Y553 HydrophobicContact CD2-CD2 4.36Å; L549-Y553 CarbonylContact O-C 3.51Å; L549-Y553 WeakPolarHBondContact O-CA 3.42Å; L549-Y553 PolarHBondContact O-N 3.39Å; Y553-L555 PolarHBondContact O-N 2.86Å; Y553-H558 PolarHBondContact O-CD2 3.36Å; Y553-P647 HydrophobicContact CD1-CG 3.54Å; Y553-P647 HydrophobicContact CD2-CG 3.81Å; Y553-P647 HydrophobicContact CE1-CG 3.59Å; Y553-P647 HydrophobicContact CE2-CG 3.87Å; Y553-P647 HydrophobicContact CG-CG 3.64Å
554	S	89.4	Confident	89.7	Confident	32 Å²	32	40 Å²	40	22%	0.224	19%	0.185	C	C	.	.			trans	43.6	37.2	170.7	-98.1	0	0	0	0	115.6	L549 L556 D557 H558	L549-S554 PolarHBondContact O-N 3.06Å; L549-S554 VanDerWaalsContact O-N 3.1Å; S554-L556 VanDerWaalsContact C-N 3.27Å; S554-L556 PolarHBondContact O-N 3.48Å; S554-L556 VanDerWaalsContact O-N 3.11Å; S554-D557 WeakPolarHBondContact CB-OD2 3.46Å; S554-D557 WeakPolarHBondContact O-CA 3.38Å; S554-D557 WeakPolarHBondContact O-CB 3.48Å; S554-D557 PolarHBondContact O-N 3.17Å; S554-D557 PolarHBondContact OG-OD2 3.06Å; S554-H558 PolarHBondContact O-CD2 3.41Å; S554-H558 PolarHBondContact O-N 3.44Å
555	L	90.8	Very high	89.8	Confident	1 Å²	1	37 Å²	37	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-52.6	-41.6	-169.4	176.3	63.5	0	0	0	113.5	L549 Y553 H558 M559 I648 V651 F652 L744	L549-L555 HydrophobicContact CB-CB 4.31Å; L549-L555 HydrophobicContact CB-CD2 4.15Å; L549-L555 HydrophobicContact CD1-CD2 4.34Å; L549-L555 PolarHBondContact O-N 2.76Å; L549-L555 VanDerWaalsContact O-N 3.13Å; Y553-L555 PolarHBondContact O-N 2.86Å; L555-H558 PolarHBondContact O-N 2.85Å; L555-M559 WeakPolarHBondContact O-CG 3.48Å; L555-M559 PolarHBondContact O-N 3.35Å; L555-I648 HydrophobicContact CD1-CG2 4.12Å; L555-V651 HydrophobicContact CD1-CB 4.32Å; L555-V651 HydrophobicContact CD1-CG1 4.48Å; L555-V651 HydrophobicContact CD1-CG2 4.18Å; L555-V651 HydrophobicContact CD2-CG2 4.27Å; L555-F652 HydrophobicContact CD1-CE2 4.33Å; L555-F652 HydrophobicContact CD1-CZ 3.87Å; L555-L744 HydrophobicContact CD2-CD1 4.48Å
556	L	90.6	Very high	90	Very high	45 Å²	45	37.1 Å²	37.1	24%	0.236	17%	0.174	C	C	.	.	H	α-helix	trans	-65.8	-37	176.5	-62.7	178.3	0	0	0	112.9	S554 M559 Q560 W735 V738	S554-L556 VanDerWaalsContact C-N 3.27Å; S554-L556 PolarHBondContact O-N 3.48Å; S554-L556 VanDerWaalsContact O-N 3.11Å; L556-M559 PolarHBondContact O-N 3.23Å; L556-Q560 PolarHBondContact O-N 2.86Å; L556-W735 HydrophobicContact CB-CH2 4.13Å; L556-W735 HydrophobicContact CB-CZ3 4.43Å; L556-W735 HydrophobicContact CD2-CZ3 4.39Å; L556-V738 HydrophobicContact CD2-CG1 3.56Å
557	D	91.2	Very high	90.2	Very high	71 Å²	71	36.8 Å²	36.8	38%	0.38	17%	0.173	S	C	.	.	H	α-helix	trans	-70.3	-36.2	177.6	-49.8	-49.6	0	0	0	110.4	S554 Q560 A561 I617	S554-D557 WeakPolarHBondContact CB-OD2 3.46Å; S554-D557 WeakPolarHBondContact O-CA 3.38Å; S554-D557 WeakPolarHBondContact O-CB 3.48Å; S554-D557 PolarHBondContact O-N 3.17Å; S554-D557 PolarHBondContact OG-OD2 3.06Å; D557-Q560 CarbonylContact O-C 3.51Å; D557-Q560 PolarHBondContact O-N 2.87Å; D557-A561 WeakPolarHBondContact O-CB 3.42Å; D557-A561 PolarHBondContact O-N 2.76Å; D557-I617 HydrophobicContact CB-CD1 3.96Å
558	H	91.9	Very high	90.4	Very high	1 Å²	1	35 Å²	35	1%	0.005	16%	0.163	C	C	.	.	H	α-helix	trans	-68.1	-40	172.1	-68.8	-69.3	0	0	0	112.6	Y553 S554 L555 Q560 A561 M562 Y642 F652	Y553-H558 PolarHBondContact O-CD2 3.36Å; S554-H558 PolarHBondContact O-CD2 3.41Å; S554-H558 PolarHBondContact O-N 3.44Å; L555-H558 PolarHBondContact O-N 2.85Å; H558-Q560 VanDerWaalsContact C-N 3.29Å; H558-Q560 PolarHBondContact O-N 2.94Å; H558-A561 WeakPolarHBondContact O-CB 3.29Å; H558-A561 PolarHBondContact O-N 3.06Å; H558-M562 PolarHBondContact O-N 3.33Å; H558-Y642 AromaticContact ND1-CE1 4Å; H558-Y642 AromaticContact ND1-CZ 3.84Å; H558-Y642 PolarHBondContact ND1-OH 3.3Å; H558-F652 HydrophobicContact CB-CE2 4.05Å
559	M	91.5	Very high	90.3	Very high	2 Å²	2	37 Å²	37	1%	0.01	19%	0.185	C	C	.	.	H	α-helix	trans	-57.8	-43.6	169.1	-73.4	-171	124.9	0	0	111.1	L555 L556 M562 R563 F652 W731 L734 V738 I747 H751	L555-M559 WeakPolarHBondContact O-CG 3.48Å; L555-M559 PolarHBondContact O-N 3.35Å; L556-M559 PolarHBondContact O-N 3.23Å; M559-M562 PolarHBondContact O-N 3.4Å; M559-R563 PolarHBondContact O-N 3.26Å; M559-F652 HydrophobicContact CE-CE1 4.24Å; M559-F652 HydrophobicContact CG-CE1 3.88Å; M559-F652 HydrophobicContact CG-CZ 3.59Å; M559-W731 HydrophobicContact CB-CH2 4.27Å; M559-W731 WeakPolarHBondContact O-CH2 3.47Å; M559-L734 HydrophobicContact CE-CD2 4.49Å; M559-V738 HydrophobicContact CE-CG2 4.26Å; M559-V738 HydrophobicContact SD-CG1 4.25Å; M559-V738 HydrophobicContact SD-CG2 4.31Å; M559-I747 HydrophobicContact CE-CG2 4.03Å; M559-H751 HydrophobicContact CE-CB 4.19Å
560	Q	91.8	Very high	90.3	Very high	69 Å²	69	38.1 Å²	38.1	32%	0.322	19%	0.19	S	C	.	.	H	α-helix	trans	-68.2	-36.4	178.1	-152.7	-170.6	31.7	0	0	112.1	L556 D557 H558 R563 R564 W731	L556-Q560 PolarHBondContact O-N 2.86Å; D557-Q560 CarbonylContact O-C 3.51Å; D557-Q560 PolarHBondContact O-N 2.87Å; H558-Q560 VanDerWaalsContact C-N 3.29Å; H558-Q560 PolarHBondContact O-N 2.94Å; Q560-R563 PolarHBondContact O-N 3.33Å; Q560-R564 VanDerWaalsContact O-CG 3.24Å; Q560-R564 WeakPolarHBondContact O-CG 3.28Å; Q560-R564 PolarHBondContact O-N 2.75Å; Q560-W731 HydrophobicContact CG-CZ2 4.4Å
561	A	91.7	Very high	90.4	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-59.4	-44.2	173.7	0	0	0	0	0	111.9	D557 H558 R563 R564 Y565 I617 Y642	D557-A561 WeakPolarHBondContact O-CB 3.42Å; D557-A561 PolarHBondContact O-N 2.76Å; H558-A561 WeakPolarHBondContact O-CB 3.29Å; H558-A561 PolarHBondContact O-N 3.06Å; A561-R563 VanDerWaalsContact C-N 3.3Å; A561-R563 PolarHBondContact O-N 2.85Å; A561-R564 PolarHBondContact O-N 3.19Å; A561-R564 VanDerWaalsContact O-N 3.12Å; A561-Y565 HydrophobicContact CB-CD2 4.2Å; A561-Y565 HydrophobicContact CB-CE2 4.28Å; A561-Y565 WeakPolarHBondContact O-CD2 3.49Å; A561-Y565 PolarHBondContact O-N 3.03Å; A561-I617 HydrophobicContact CB-CB 4.49Å; A561-I617 HydrophobicContact CB-CD1 4.18Å; A561-I617 HydrophobicContact CB-CG1 4.13Å; A561-I617 HydrophobicContact CB-CG2 3.56Å; A561-Y642 HydrophobicContact CB-CE2 4.44Å
562	M	91	Very high	90.6	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-60	-39	174.5	-66.7	-166.2	-60.2	0	0	112.1	H558 M559 L566 L567 Y642 F652 M657 Y660	H558-M562 PolarHBondContact O-N 3.33Å; M559-M562 PolarHBondContact O-N 3.4Å; M562-L566 HydrophobicContact CB-CD1 4.23Å; M562-L566 HydrophobicContact CG-CD1 4.02Å; M562-L566 WeakPolarHBondContact O-CA 3.14Å; M562-L566 WeakPolarHBondContact O-CB 3.47Å; M562-L566 PolarHBondContact O-N 2.9Å; M562-L566 HydrophobicContact SD-CD1 4.38Å; M562-L567 PolarHBondContact O-N 3.26Å; M562-L567 VanDerWaalsContact O-N 3.07Å; M562-Y642 HydrophobicContact CG-CD1 4.16Å; M562-F652 HydrophobicContact CE-CD1 3.57Å; M562-F652 HydrophobicContact CE-CD2 4.04Å; M562-F652 HydrophobicContact CE-CE1 3.3Å; M562-F652 HydrophobicContact CE-CE2 3.79Å; M562-F652 HydrophobicContact CE-CG 3.97Å; M562-F652 HydrophobicContact CE-CZ 3.44Å; M562-F652 VanDerWaalsContact CE-CZ 3.44Å; M562-F652 HydrophobicContact SD-CD1 4.37Å; M562-F652 HydrophobicContact SD-CD2 4.12Å; M562-F652 HydrophobicContact SD-CE2 4.28Å; M562-F652 HydrophobicContact SD-CG 4.2Å; M562-F652 HydrophobicContact SD-CZ 4.49Å; M562-M657 HydrophobicContact SD-SD 4.31Å; M562-Y660 HydrophobicContact CB-CE1 4.43Å; M562-Y660 HydrophobicContact CE-CE2 3.63Å; M562-Y660 WeakPolarHBondContact CE-OH 3.41Å; M562-Y660 HydrophobicContact SD-CD2 4.01Å; M562-Y660 HydrophobicContact SD-CE2 3.48Å; M562-Y660 WeakPolarHBondContact SD-CE2 3.07Å
563	R	92.8	Very high	91	Very high	56 Å²	56	28.8 Å²	28.8	21%	0.211	16%	0.163	C	C	.	.	H	α-helix	trans	-64.8	-43.6	171.9	174.3	170.9	169.8	-156.2	-6.2	112.5	M559 Q560 A561 L567 G569 E728 W731	M559-R563 PolarHBondContact O-N 3.26Å; Q560-R563 PolarHBondContact O-N 3.33Å; A561-R563 VanDerWaalsContact C-N 3.3Å; A561-R563 PolarHBondContact O-N 2.85Å; R563-L567 CarbonylContact O-C 3.55Å; R563-G569 PolarHBondContact O-N 2.73Å; R563-E728 IonicContact CZ-OE1 3.32Å; R563-E728 IonicContact CZ-OE2 3.68Å; R563-E728 IonicContact NH1-OE1 3.22Å; R563-E728 IonicContact NH2-OE1 2.79Å; R563-E728 PolarHBondContact NH2-OE1 2.98Å; R563-E728 IonicContact NH2-OE2 3.69Å; R563-E728 PolarHBondContact NH2-OE2 3.08Å; R563-W731 HydrophobicContact CB-CD2 4.45Å; R563-W731 HydrophobicContact CB-CE3 3.89Å; R563-W731 HydrophobicContact CB-CH2 4.06Å; R563-W731 HydrophobicContact CB-CZ3 3.68Å; R563-W731 HydrophobicContact CG-CD2 4.41Å; R563-W731 HydrophobicContact CG-CE3 4.22Å; R563-W731 HydrophobicContact CG-CZ3 4.48Å; R563-W731 VanDerWaalsContact NH1-NE1 3.18Å
564	R	91.3	Very high	91.3	Very high	60 Å²	60	26.5 Å²	26.5	23%	0.226	16%	0.155	C	C	.	.	H	α-helix	trans	-62.7	-46.1	-178.8	-69.4	163.5	-176.9	-132.6	15.4	112	Q560 A561 L568 G569 Q570 D613	Q560-R564 VanDerWaalsContact O-CG 3.24Å; Q560-R564 WeakPolarHBondContact O-CG 3.28Å; Q560-R564 PolarHBondContact O-N 2.75Å; A561-R564 PolarHBondContact O-N 3.19Å; A561-R564 VanDerWaalsContact O-N 3.12Å; R564-L568 CarbonylContact O-C 3.6Å; R564-G569 PolarHBondContact O-N 3.1Å; R564-Q570 HydrophobicContact CB-CB 4.42Å; R564-Q570 HydrophobicContact CB-CG 3.91Å; R564-Q570 HydrophobicContact CG-CG 3.99Å; R564-Q570 VanDerWaalsContact NH1-NE2 3.13Å; R564-Q570 PolarHBondContact O-N 2.9Å; R564-D613 IonicContact CZ-OD1 3.53Å; R564-D613 IonicContact CZ-OD2 2.81Å; R564-D613 IonicContact NH1-OD1 3.94Å; R564-D613 PolarHBondContact NH1-OD1 3.29Å; R564-D613 IonicContact NH1-OD2 3.54Å; R564-D613 PolarHBondContact NH1-OD2 2.85Å; R564-D613 IonicContact NH2-OD1 2.6Å
565	Y	91.8	Very high	91.4	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-100	-56.1	-172.1	-56.9	-63.2	0	0	0	113.6	A561 L568 Q570 F573 A610 D613 I617 L621	A561-Y565 HydrophobicContact CB-CD2 4.2Å; A561-Y565 HydrophobicContact CB-CE2 4.28Å; A561-Y565 WeakPolarHBondContact O-CD2 3.49Å; A561-Y565 PolarHBondContact O-N 3.03Å; Y565-L568 PolarHBondContact O-N 2.87Å; Y565-Q570 PolarHBondContact OH-OE1 3.36Å; Y565-F573 AromaticContact CD1-CD1 3.64Å; Y565-F573 HydrophobicContact CD1-CD1 3.64Å; Y565-F573 AromaticContact CD1-CE1 3.54Å; Y565-F573 HydrophobicContact CD1-CE1 3.54Å; Y565-F573 HydrophobicContact CD1-CG 4.38Å; Y565-F573 HydrophobicContact CD1-CZ 4.19Å; Y565-F573 AromaticContact CE1-CD1 3.84Å; Y565-F573 HydrophobicContact CE1-CD1 3.84Å; Y565-F573 HydrophobicContact CE1-CD2 4.48Å; Y565-F573 AromaticContact CE1-CE1 3.96Å; Y565-F573 HydrophobicContact CE1-CE1 3.96Å; Y565-F573 HydrophobicContact CE1-CG 4.12Å; Y565-F573 HydrophobicContact CE1-CZ 4.32Å; Y565-A610 HydrophobicContact CE1-CB 4.21Å; Y565-A610 WeakPolarHBondContact OH-CB 2.96Å; Y565-D613 PolarHBondContact OH-OD2 3.15Å; Y565-I617 HydrophobicContact CE2-CG2 3.85Å; Y565-L621 HydrophobicContact CD1-CD2 3.74Å; Y565-L621 HydrophobicContact CD2-CD1 4.48Å; Y565-L621 HydrophobicContact CD2-CD2 4.25Å; Y565-L621 HydrophobicContact CE1-CD2 3.96Å; Y565-L621 HydrophobicContact CE2-CD2 4.46Å; Y565-L621 HydrophobicContact CG-CD1 4.08Å; Y565-L621 HydrophobicContact CG-CD2 3.9Å
566	L	91.9	Very high	91.6	Very high	3 Å²	3	34.3 Å²	34.3	2%	0.016	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-27.4	-175.2	-59.3	175.8	0	0	0	113.6	M562 L568 L640 M657 Y660 F664	M562-L566 HydrophobicContact CB-CD1 4.23Å; M562-L566 HydrophobicContact CG-CD1 4.02Å; M562-L566 WeakPolarHBondContact O-CA 3.14Å; M562-L566 WeakPolarHBondContact O-CB 3.47Å; M562-L566 PolarHBondContact O-N 2.9Å; M562-L566 HydrophobicContact SD-CD1 4.38Å; L566-L568 WeakPolarHBondContact O-CD1 3.21Å; L566-L640 HydrophobicContact CD2-CB 4.42Å; L566-M657 HydrophobicContact CD1-CE 4.21Å; L566-Y660 HydrophobicContact CB-CD1 4.32Å; L566-Y660 HydrophobicContact CD1-CD1 4.38Å; L566-Y660 HydrophobicContact CD1-CG 4.12Å; L566-F664 WeakPolarHBondContact O-CD2 3.29Å
567	L	92.6	Very high	91.8	Very high	11 Å²	11	32.2 Å²	32.2	6%	0.058	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	11.9	171.7	-54.7	177.4	0	0	0	113	M562 R563 G569 Y660 V663 L667 L727 F754 I758	M562-L567 PolarHBondContact O-N 3.26Å; M562-L567 VanDerWaalsContact O-N 3.07Å; R563-L567 CarbonylContact O-C 3.55Å; L567-G569 PolarHBondContact O-N 2.6Å; L567-Y660 HydrophobicContact CD1-CE1 4.17Å; L567-Y660 HydrophobicContact CD2-CD1 4.11Å; L567-Y660 HydrophobicContact CD2-CE1 4.12Å; L567-Y660 HydrophobicContact CG-CD1 4.45Å; L567-Y660 HydrophobicContact CG-CE1 4.11Å; L567-V663 HydrophobicContact CD2-CG1 3.65Å; L567-L667 HydrophobicContact CD2-CD1 4.28Å; L567-L727 HydrophobicContact CD1-CD2 4.3Å; L567-L727 HydrophobicContact CD2-CD2 4.18Å; L567-F754 HydrophobicContact CD1-CE1 4.43Å; L567-F754 HydrophobicContact CD1-CZ 3.9Å; L567-I758 HydrophobicContact CD1-CD1 4.16Å
568	L	91.9	Very high	91.9	Very high	21 Å²	21	29.1 Å²	29.1	11%	0.11	16%	0.156	C	C	.	.			trans	58.4	26.7	174.4	-65.6	69.4	0	0	0	114.5	R564 Y565 L566 Q570 I574 F664 L667 K671	R564-L568 CarbonylContact O-C 3.6Å; Y565-L568 PolarHBondContact O-N 2.87Å; L566-L568 WeakPolarHBondContact O-CD1 3.21Å; L568-Q570 PolarHBondContact O-N 2.79Å; L568-I574 HydrophobicContact CB-CG1 4.13Å; L568-I574 HydrophobicContact CD2-CG2 4.18Å; L568-I574 HydrophobicContact CG-CD1 4.11Å; L568-I574 HydrophobicContact CG-CG1 4.11Å; L568-I574 HydrophobicContact CG-CG2 4.48Å; L568-F664 HydrophobicContact CD1-CD2 3.6Å; L568-F664 HydrophobicContact CD1-CE2 3.77Å; L568-F664 HydrophobicContact CG-CE2 4.48Å; L568-L667 HydrophobicContact CD1-CB 3.84Å; L568-L667 HydrophobicContact CD1-CD1 4.04Å; L568-L667 HydrophobicContact CD2-CB 4.16Å; L568-K671 HydrophobicContact CD2-CB 4.39Å; L568-K671 HydrophobicContact CD2-CG 3.83Å
569	G	88.1	Confident	92	Very high	50 Å²	50	32.1 Å²	32.1	52%	0.515	17%	0.171	S	C	.	.			trans	-64.8	-29.4	-179.4	0	0	0	0	0	115.2	R563 R564 L567 G571	R563-G569 PolarHBondContact O-N 2.73Å; R564-G569 PolarHBondContact O-N 3.1Å; L567-G569 PolarHBondContact O-N 2.6Å; G569-G571 PolarHBondContact O-N 3.44Å
570	Q	87.8	Confident	92.1	Very high	24 Å²	24	35.5 Å²	35.5	11%	0.112	19%	0.189	C	C	.	.			trans	-86	85.4	171.1	-84.9	175.5	-14.9	0	0	110.3	R564 Y565 L568 D572 F573 I574 D613	R564-Q570 HydrophobicContact CB-CB 4.42Å; R564-Q570 HydrophobicContact CB-CG 3.91Å; R564-Q570 HydrophobicContact CG-CG 3.99Å; R564-Q570 VanDerWaalsContact NH1-NE2 3.13Å; R564-Q570 PolarHBondContact O-N 2.9Å; Y565-Q570 PolarHBondContact OH-OE1 3.36Å; L568-Q570 PolarHBondContact O-N 2.79Å; Q570-D572 VanDerWaalsContact C-N 3.28Å; Q570-D572 PolarHBondContact O-N 2.99Å; Q570-F573 HydrophobicContact CB-CB 4Å; Q570-F573 PolarHBondContact O-N 2.87Å; Q570-I574 WeakPolarHBondContact O-CG1 3.47Å; Q570-I574 PolarHBondContact O-N 3.15Å; Q570-I574 VanDerWaalsContact O-N 3.13Å; Q570-D613 PolarHBondContact NE2-OD2 3.28Å
571	G	89.4	Confident	92.1	Very high	47 Å²	47	32.2 Å²	32.2	49%	0.485	17%	0.174	S	C	.	.	H	α-helix	trans	-61.6	-30	-178	0	0	0	0	0	114.5	G569 R575	G569-G571 PolarHBondContact O-N 3.44Å; G571-R575 WeakPolarHBondContact O-CB 3.49Å; G571-R575 PolarHBondContact O-N 2.81Å
572	D	92.4	Very high	92.1	Very high	55 Å²	55	35.1 Å²	35.1	29%	0.294	19%	0.186	S	C	.	.	H	α-helix	trans	-69.3	-47.6	176.6	65.4	-43.8	0	0	0	112	Q570 R575 H576 N609	Q570-D572 VanDerWaalsContact C-N 3.28Å; Q570-D572 PolarHBondContact O-N 2.99Å; D572-R575 PolarHBondContact O-N 3.28Å; D572-H576 PolarHBondContact O-N 2.9Å; D572-N609 WeakPolarHBondContact OD2-CB 3.24Å; D572-N609 PolarHBondContact OD2-N 3.49Å; D572-N609 PolarHBondContact OD2-ND2 2.84Å
573	F	94.2	Very high	92.1	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-57.5	-54.8	175.4	167.7	-102.9	0	0	0	111.4	Y565 Q570 R575 H576 L577 L601 A604 V605 A610 L621 L640	Y565-F573 AromaticContact CD1-CD1 3.64Å; Y565-F573 HydrophobicContact CD1-CD1 3.64Å; Y565-F573 AromaticContact CD1-CE1 3.54Å; Y565-F573 HydrophobicContact CD1-CE1 3.54Å; Y565-F573 HydrophobicContact CD1-CG 4.38Å; Y565-F573 HydrophobicContact CD1-CZ 4.19Å; Y565-F573 AromaticContact CE1-CD1 3.84Å; Y565-F573 HydrophobicContact CE1-CD1 3.84Å; Y565-F573 HydrophobicContact CE1-CD2 4.48Å; Y565-F573 AromaticContact CE1-CE1 3.96Å; Y565-F573 HydrophobicContact CE1-CE1 3.96Å; Y565-F573 HydrophobicContact CE1-CG 4.12Å; Y565-F573 HydrophobicContact CE1-CZ 4.32Å; Q570-F573 HydrophobicContact CB-CB 4Å; Q570-F573 PolarHBondContact O-N 2.87Å; F573-R575 VanDerWaalsContact C-N 3.3Å; F573-R575 PolarHBondContact O-N 2.74Å; F573-H576 PolarHBondContact O-N 3.09Å; F573-L577 HydrophobicContact CE1-CD2 3.99Å; F573-L577 HydrophobicContact CZ-CD2 3.86Å; F573-L577 VanDerWaalsContact O-CB 3.3Å; F573-L577 WeakPolarHBondContact O-CB 3.38Å; F573-L577 PolarHBondContact O-N 3.48Å; F573-L601 HydrophobicContact CE2-CD1 4.13Å; F573-L601 HydrophobicContact CZ-CD1 3.62Å; F573-A604 HydrophobicContact CE2-CB 4.17Å; F573-V605 HydrophobicContact CE2-CG2 3.74Å; F573-V605 HydrophobicContact CZ-CG2 4.48Å; F573-A610 HydrophobicContact CD2-CB 4.02Å; F573-A610 HydrophobicContact CG-CB 4.48Å; F573-L621 HydrophobicContact CZ-CD2 4.09Å; F573-L640 HydrophobicContact CE1-CD1 4.29Å
574	I	93.1	Very high	91.9	Very high	8 Å²	8	37.8 Å²	37.8	4%	0.041	21%	0.209	C	C	.	.	H	α-helix	trans	-61.4	-40.4	179.8	-61.8	-64.5	0	0	0	110.8	L568 Q570 H576 L577 M578 L640 W668	L568-I574 HydrophobicContact CB-CG1 4.13Å; L568-I574 HydrophobicContact CD2-CG2 4.18Å; L568-I574 HydrophobicContact CG-CD1 4.11Å; L568-I574 HydrophobicContact CG-CG1 4.11Å; L568-I574 HydrophobicContact CG-CG2 4.48Å; Q570-I574 WeakPolarHBondContact O-CG1 3.47Å; Q570-I574 PolarHBondContact O-N 3.15Å; Q570-I574 VanDerWaalsContact O-N 3.13Å; I574-H576 PolarHBondContact O-N 2.75Å; I574-L577 PolarHBondContact O-N 3.23Å; I574-M578 HydrophobicContact CG2-CG 4.34Å; I574-M578 HydrophobicContact CG2-SD 4.13Å; I574-M578 WeakPolarHBondContact O-CB 3.42Å; I574-M578 VanDerWaalsContact O-CG 3.3Å; I574-M578 WeakPolarHBondContact O-CG 3.33Å; I574-M578 PolarHBondContact O-N 2.74Å; I574-L640 HydrophobicContact CD1-CD1 4.41Å; I574-W668 HydrophobicContact CG2-CZ3 4.36Å
575	R	92.4	Very high	91.8	Very high	104 Å²	104	34.9 Å²	34.9	39%	0.392	20%	0.198	S	C	.	.	H	α-helix	trans	-65.8	-37.1	-178.6	-176.1	64.2	-166.5	70.3	-2.2	112.6	G571 D572 F573 D579	G571-R575 WeakPolarHBondContact O-CB 3.49Å; G571-R575 PolarHBondContact O-N 2.81Å; D572-R575 PolarHBondContact O-N 3.28Å; F573-R575 VanDerWaalsContact C-N 3.3Å; F573-R575 PolarHBondContact O-N 2.74Å; R575-D579 IonicContact CZ-OD1 3.64Å; R575-D579 IonicContact CZ-OD2 2.63Å; R575-D579 IonicContact NH1-OD1 2.88Å; R575-D579 PolarHBondContact NH1-OD1 2.92Å; R575-D579 IonicContact NH1-OD2 2.85Å; R575-D579 PolarHBondContact NH1-OD2 3.5Å; R575-D579 IonicContact NH2-OD1 3.02Å; R575-D579 IonicContact NH2-OD2 2.64Å
576	H	94.3	Very high	91.6	Very high	93 Å²	93	39.6 Å²	39.6	43%	0.431	23%	0.226	S	C	.	.	H	α-helix	trans	-78	-37.5	173.6	-78.9	-22.9	0	0	0	112.9	D572 F573 I574 M578 D579 L580 T608	D572-H576 PolarHBondContact O-N 2.9Å; F573-H576 PolarHBondContact O-N 3.09Å; I574-H576 PolarHBondContact O-N 2.75Å; H576-M578 VanDerWaalsContact C-N 3.3Å; H576-M578 PolarHBondContact O-N 3.09Å; H576-D579 PolarHBondContact O-N 3.09Å; H576-L580 PolarHBondContact O-N 3.2Å; H576-L580 VanDerWaalsContact O-N 3.13Å; H576-T608 HydrophobicContact CB-CG2 3.82Å
577	L	94.6	Very high	91.4	Very high	1 Å²	1	44 Å²	44	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-57	-43.2	173.5	-177	66.4	0	0	0	111.4	F573 I574 D579 L580 L581 L601 A604 F638 L640	F573-L577 HydrophobicContact CE1-CD2 3.99Å; F573-L577 HydrophobicContact CZ-CD2 3.86Å; F573-L577 VanDerWaalsContact O-CB 3.3Å; F573-L577 WeakPolarHBondContact O-CB 3.38Å; F573-L577 PolarHBondContact O-N 3.48Å; I574-L577 PolarHBondContact O-N 3.23Å; L577-D579 PolarHBondContact O-N 3.46Å; L577-L580 PolarHBondContact O-N 3.08Å; L577-L581 HydrophobicContact CD1-CD1 3.82Å; L577-L581 HydrophobicContact CD1-CG 4.07Å; L577-L581 HydrophobicContact CD2-CD1 4.33Å; L577-L581 HydrophobicContact CG-CD1 3.69Å; L577-L581 HydrophobicContact CG-CG 4.29Å; L577-L581 VanDerWaalsContact O-CB 3.29Å; L577-L581 WeakPolarHBondContact O-CB 3.08Å; L577-L581 VanDerWaalsContact O-CG 3.28Å; L577-L581 WeakPolarHBondContact O-CG 3.39Å; L577-L581 PolarHBondContact O-N 2.91Å; L577-L601 HydrophobicContact CD1-CD1 4.13Å; L577-L601 HydrophobicContact CD2-CD1 4.38Å; L577-A604 HydrophobicContact CB-CB 4.06Å; L577-A604 HydrophobicContact CD1-CB 3.73Å; L577-F638 HydrophobicContact CD2-CZ 4.44Å; L577-L640 HydrophobicContact CD2-CD1 4.18Å; L577-L640 HydrophobicContact CD2-CD2 4.41Å
578	M	93.6	Very high	91.1	Very high	7 Å²	7	47.3 Å²	47.3	3%	0.034	27%	0.265	C	S	.	.	H	α-helix	trans	-63.2	-38.1	176.5	-73.1	-178.2	84.6	0	0	113.9	I574 H576 K582 W635 W668 K671 Y675	I574-M578 HydrophobicContact CG2-CG 4.34Å; I574-M578 HydrophobicContact CG2-SD 4.13Å; I574-M578 WeakPolarHBondContact O-CB 3.42Å; I574-M578 VanDerWaalsContact O-CG 3.3Å; I574-M578 WeakPolarHBondContact O-CG 3.33Å; I574-M578 PolarHBondContact O-N 2.74Å; H576-M578 VanDerWaalsContact C-N 3.3Å; H576-M578 PolarHBondContact O-N 3.09Å; M578-K582 PolarHBondContact O-N 3.47Å; M578-K582 VanDerWaalsContact O-N 3.1Å; M578-W635 HydrophobicContact CE-CH2 4.37Å; M578-W635 HydrophobicContact CE-CZ3 3.93Å; M578-W668 HydrophobicContact CG-CH2 3.56Å; M578-W668 HydrophobicContact CG-CZ3 3.63Å; M578-W668 HydrophobicContact SD-CZ3 4.21Å; M578-K671 HydrophobicContact SD-CB 4.39Å; M578-Y675 HydrophobicContact CB-CD2 4.2Å; M578-Y675 HydrophobicContact CB-CE2 4.18Å; M578-Y675 HydrophobicContact CE-CD2 4.1Å; M578-Y675 HydrophobicContact CE-CG 3.83Å; M578-Y675 HydrophobicContact SD-CD2 4.38Å
579	D	93.6	Very high	90.8	Very high	63 Å²	63	46.6 Å²	46.6	34%	0.337	26%	0.262	S	S	.	.	H	α-helix	trans	-66.6	-42.2	176.6	-82.2	-21.3	0	0	0	111.7	R575 H576 L577 Y675	R575-D579 IonicContact CZ-OD1 3.64Å; R575-D579 IonicContact CZ-OD2 2.63Å; R575-D579 IonicContact NH1-OD1 2.88Å; R575-D579 PolarHBondContact NH1-OD1 2.92Å; R575-D579 IonicContact NH1-OD2 2.85Å; R575-D579 PolarHBondContact NH1-OD2 3.5Å; R575-D579 IonicContact NH2-OD1 3.02Å; R575-D579 IonicContact NH2-OD2 2.64Å; H576-D579 PolarHBondContact O-N 3.09Å; L577-D579 PolarHBondContact O-N 3.46Å; D579-Y675 VanDerWaalsContact OD1-CE2 3.25Å; D579-Y675 WeakPolarHBondContact OD1-CE2 3.34Å; D579-Y675 PolarHBondContact OD1-OH 2.83Å
580	L	93.7	Very high	90.6	Very high	74 Å²	74	49.6 Å²	49.6	39%	0.387	27%	0.27	S	S	.	.	H	α-helix	trans	-72.8	-32.7	179.9	-63.5	176.9	0	0	0	112.7	H576 L577 P583 I600 T603 A604	H576-L580 PolarHBondContact O-N 3.2Å; H576-L580 VanDerWaalsContact O-N 3.13Å; L577-L580 PolarHBondContact O-N 3.08Å; L580-P583 WeakPolarHBondContact O-CD 3.28Å; L580-I600 HydrophobicContact CB-CG2 3.62Å; L580-T603 HydrophobicContact CD1-CG2 4.15Å; L580-A604 HydrophobicContact CD1-CB 4.17Å
581	L	92.6	Very high	90.6	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-80.3	-26	178.8	-74.2	178	0	0	0	113.9	L577 P583 E584 L585 L597 I600 F638 W668	L577-L581 HydrophobicContact CD1-CD1 3.82Å; L577-L581 HydrophobicContact CD1-CG 4.07Å; L577-L581 HydrophobicContact CD2-CD1 4.33Å; L577-L581 HydrophobicContact CG-CD1 3.69Å; L577-L581 HydrophobicContact CG-CG 4.29Å; L577-L581 VanDerWaalsContact O-CB 3.29Å; L577-L581 WeakPolarHBondContact O-CB 3.08Å; L577-L581 VanDerWaalsContact O-CG 3.28Å; L577-L581 WeakPolarHBondContact O-CG 3.39Å; L577-L581 PolarHBondContact O-N 2.91Å; L581-P583 VanDerWaalsContact C-CD 3.4Å; L581-P583 VanDerWaalsContact C-N 3.33Å; L581-P583 VanDerWaalsContact O-N 3.15Å; L581-E584 WeakPolarHBondContact O-CB 3.43Å; L581-E584 PolarHBondContact O-N 3.17Å; L581-L585 HydrophobicContact CB-CD1 3.69Å; L581-L585 HydrophobicContact CB-CG 3.96Å; L581-L585 HydrophobicContact CD1-CD1 4.26Å; L581-L585 WeakPolarHBondContact O-CG 3.36Å; L581-L585 PolarHBondContact O-N 2.69Å; L581-L597 HydrophobicContact CD2-CD2 3.68Å; L581-I600 HydrophobicContact CD2-CB 4.15Å; L581-I600 HydrophobicContact CD2-CD1 4.2Å; L581-I600 HydrophobicContact CD2-CG2 3.67Å; L581-I600 HydrophobicContact CG-CG2 3.98Å; L581-F638 HydrophobicContact CD1-CD1 4.4Å; L581-F638 HydrophobicContact CD1-CD2 4.22Å; L581-F638 HydrophobicContact CD1-CE1 3.83Å; L581-F638 HydrophobicContact CD1-CE2 3.61Å; L581-F638 HydrophobicContact CD1-CZ 3.39Å; L581-F638 HydrophobicContact CD2-CE2 4.4Å; L581-W668 HydrophobicContact CD1-CH2 4.34Å
582	K	91.1	Very high	90.4	Very high	60 Å²	60	49.6 Å²	49.6	26%	0.261	26%	0.262	S	S	.	.	H	α-helix	trans	-46.8	-43.7	-177.8	-178.6	-176.6	-166.3	175.8	0	114.6	M578 E584 V586 W635 Y675 D679	M578-K582 PolarHBondContact O-N 3.47Å; M578-K582 VanDerWaalsContact O-N 3.1Å; K582-E584 VanDerWaalsContact C-N 3.29Å; K582-E584 PolarHBondContact O-N 3.39Å; K582-V586 HydrophobicContact CG-CG2 4.44Å; K582-V586 VanDerWaalsContact O-CG2 3.28Å; K582-V586 WeakPolarHBondContact O-CG2 3.31Å; K582-V586 PolarHBondContact O-N 2.62Å; K582-W635 HydrophobicContact CB-CZ2 4.24Å; K582-W635 HydrophobicContact CG-CZ2 4.2Å; K582-Y675 HydrophobicContact CD-CE1 3.92Å; K582-D679 IonicContact NZ-OD1 3.79Å; K582-D679 IonicContact NZ-OD2 2.73Å; K582-D679 PolarHBondContact NZ-OD2 3.46Å
583	P	90.4	Very high	90	Very high	83 Å²	83	53.6 Å²	53.6	54%	0.539	27%	0.274	S	S	.	.	H	α-helix	trans	-72.6	-16.7	-179.4	-17.1	33.5	0	0	0	114.7	L580 L581 R587	L580-P583 WeakPolarHBondContact O-CD 3.28Å; L581-P583 VanDerWaalsContact C-CD 3.4Å; L581-P583 VanDerWaalsContact C-N 3.33Å; L581-P583 VanDerWaalsContact O-N 3.15Å; P583-R587 VanDerWaalsContact O-CZ 3.32Å; P583-R587 PolarHBondContact O-NE 2.9Å; P583-R587 PolarHBondContact O-NH2 2.85Å
584	E	88.9	Confident	89.7	Confident	29 Å²	29	58.4 Å²	58.4	14%	0.136	30%	0.297	C	S	.	.	H	α-helix	trans	-87.4	-53.5	169.8	-65.9	-63	133.7	0	0	110.1	L581 K582 V586 R587 L592 L597 I600	L581-E584 WeakPolarHBondContact O-CB 3.43Å; L581-E584 PolarHBondContact O-N 3.17Å; K582-E584 VanDerWaalsContact C-N 3.29Å; K582-E584 PolarHBondContact O-N 3.39Å; E584-V586 PolarHBondContact O-N 3.29Å; E584-V586 VanDerWaalsContact O-N 3.13Å; E584-R587 VanDerWaalsContact CD-CZ 3.45Å; E584-R587 VanDerWaalsContact CD-NH2 3.26Å; E584-R587 VanDerWaalsContact O-CB 3.29Å; E584-R587 WeakPolarHBondContact O-CB 3.47Å; E584-R587 WeakPolarHBondContact O-CG 3.37Å; E584-R587 PolarHBondContact O-N 3.46Å; E584-R587 IonicContact OE1-CZ 3.35Å; E584-R587 IonicContact OE1-NH1 2.87Å; E584-R587 PolarHBondContact OE1-NH1 3.4Å; E584-R587 IonicContact OE1-NH2 2.72Å; E584-R587 PolarHBondContact OE1-NH2 3.24Å; E584-R587 IonicContact OE2-CZ 2.69Å; E584-R587 IonicContact OE2-NH1 2.78Å; E584-R587 PolarHBondContact OE2-NH1 3.36Å; E584-R587 IonicContact OE2-NH2 3.29Å; E584-L592 HydrophobicContact CB-CD2 4.01Å; E584-L597 HydrophobicContact CB-CD2 4.19Å; E584-L597 HydrophobicContact CG-CD2 4.42Å; E584-I600 HydrophobicContact CG-CD1 3.63Å
585	L	88.7	Confident	89.6	Confident	0 Å²	0	64 Å²	64	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-66.8	-18.6	-169.4	-61.4	-179.3	0	0	0	115.2	L581 R587 L592 G634 W635 F638 W668	L581-L585 HydrophobicContact CB-CD1 3.69Å; L581-L585 HydrophobicContact CB-CG 3.96Å; L581-L585 HydrophobicContact CD1-CD1 4.26Å; L581-L585 WeakPolarHBondContact O-CG 3.36Å; L581-L585 PolarHBondContact O-N 2.69Å; L585-R587 PolarHBondContact O-N 3Å; L585-L592 HydrophobicContact CD2-CD1 4.22Å; L585-G634 WeakPolarHBondContact O-CA 3.23Å; L585-G634 PolarHBondContact O-N 3.38Å; L585-G634 VanDerWaalsContact O-N 3.07Å; L585-W635 HydrophobicContact CB-CD2 3.76Å; L585-W635 HydrophobicContact CB-CE3 4.41Å; L585-W635 HydrophobicContact CB-CG 3.82Å; L585-W635 HydrophobicContact CB-CZ2 4.25Å; L585-W635 HydrophobicContact CD1-CD2 3.87Å; L585-W635 HydrophobicContact CD1-CE3 3.65Å; L585-W635 HydrophobicContact CD1-CG 4.48Å; L585-W635 HydrophobicContact CD1-CH2 4.21Å; L585-W635 HydrophobicContact CD1-CZ2 4.41Å; L585-W635 HydrophobicContact CD1-CZ3 3.82Å; L585-W635 HydrophobicContact CG-CD2 4.49Å; L585-W635 PolarHBondContact O-N 3.41Å; L585-F638 HydrophobicContact CD2-CB 3.63Å; L585-F638 HydrophobicContact CD2-CD2 4.33Å; L585-F638 HydrophobicContact CD2-CG 4.04Å; L585-W668 HydrophobicContact CD1-CZ2 3.86Å
586	V	88.1	Confident	89.5	Confident	99 Å²	99	62.3 Å²	62.3	60%	0.6	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-16.5	172.2	169	0	0	0	0	112.5	K582 E584	K582-V586 HydrophobicContact CG-CG2 4.44Å; K582-V586 VanDerWaalsContact O-CG2 3.28Å; K582-V586 WeakPolarHBondContact O-CG2 3.31Å; K582-V586 PolarHBondContact O-N 2.62Å; E584-V586 PolarHBondContact O-N 3.29Å; E584-V586 VanDerWaalsContact O-N 3.13Å
587	R	88.6	Confident	89.3	Confident	95 Å²	95	58 Å²	58	36%	0.358	30%	0.301	S	S	.	.	S	Bend	trans	-77.8	160.3	177.5	-54.7	178.6	-159.9	150.7	16.4	111.5	P583 E584 L585 T591 G634	P583-R587 VanDerWaalsContact O-CZ 3.32Å; P583-R587 PolarHBondContact O-NE 2.9Å; P583-R587 PolarHBondContact O-NH2 2.85Å; E584-R587 VanDerWaalsContact CD-CZ 3.45Å; E584-R587 VanDerWaalsContact CD-NH2 3.26Å; E584-R587 VanDerWaalsContact O-CB 3.29Å; E584-R587 WeakPolarHBondContact O-CB 3.47Å; E584-R587 WeakPolarHBondContact O-CG 3.37Å; E584-R587 PolarHBondContact O-N 3.46Å; E584-R587 IonicContact OE1-CZ 3.35Å; E584-R587 IonicContact OE1-NH1 2.87Å; E584-R587 PolarHBondContact OE1-NH1 3.4Å; E584-R587 IonicContact OE1-NH2 2.72Å; E584-R587 PolarHBondContact OE1-NH2 3.24Å; E584-R587 IonicContact OE2-CZ 2.69Å; E584-R587 IonicContact OE2-NH1 2.78Å; E584-R587 PolarHBondContact OE2-NH1 3.36Å; E584-R587 IonicContact OE2-NH2 3.29Å; L585-R587 PolarHBondContact O-N 3Å; R587-T591 WeakPolarHBondContact CB-OG1 3.36Å; R587-G634 PolarHBondContact O-N 3.35Å; R587-G634 VanDerWaalsContact O-N 3.11Å
588	P	86.5	Confident	89.2	Confident	80 Å²	80	59.8 Å²	59.8	52%	0.519	31%	0.313	S	S	.	.	B	Isolated β-bridge	trans	-58.3	137.2	170.2	-21.8	33.7	0	0	0	110.9	T590 T591	P588-T590 PolarHBondContact O-N 3.2Å; P588-T590 VanDerWaalsContact O-N 3.07Å; P588-T591 PolarHBondContact O-N 3.26Å; P588-T591 PolarHBondContact O-OG1 3.04Å
589	A	84.7	Confident	89.1	Confident	7 Å²	7	61.2 Å²	61.2	6%	0.058	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-58.6	-27	-173.2	0	0	0	0	0	114.1	T591 L592 V628 D632 V637	A589-T591 PolarHBondContact O-N 3.1Å; A589-T591 VanDerWaalsContact O-N 3.12Å; A589-L592 PolarHBondContact O-N 3.34Å; A589-V628 HydrophobicContact CB-CG1 3.74Å; A589-V628 HydrophobicContact CB-CG2 4.09Å; A589-D632 HydrophobicContact CB-CB 4.23Å; A589-D632 WeakPolarHBondContact CB-O 3.27Å; A589-D632 PolarHBondContact N-O 2.88Å; A589-V637 HydrophobicContact CB-CB 4.14Å; A589-V637 HydrophobicContact CB-CG1 4.46Å; A589-V637 HydrophobicContact CB-CG2 3.68Å
590	T	84.8	Confident	89.1	Confident	112 Å²	112	59.7 Å²	59.7	69%	0.687	32%	0.32	S	S	*	.	G	3₁₀ helix	trans	-62.8	-13.2	174.2	57.2	0	0	0	0	114.7	P588 V628	P588-T590 PolarHBondContact O-N 3.2Å; P588-T590 VanDerWaalsContact O-N 3.07Å; T590-V628 HydrophobicContact CG2-CG1 4.22Å
591	T	85.9	Confident	89.1	Confident	59 Å²	59	56.5 Å²	56.5	36%	0.362	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-99.7	-2.2	179	65.5	0	0	0	0	113.6	R587 P588 A589	R587-T591 WeakPolarHBondContact CB-OG1 3.36Å; P588-T591 PolarHBondContact O-N 3.26Å; P588-T591 PolarHBondContact O-OG1 3.04Å; A589-T591 PolarHBondContact O-N 3.1Å; A589-T591 VanDerWaalsContact O-N 3.12Å
592	L	85.4	Confident	89	Confident	13 Å²	13	60.3 Å²	60.3	7%	0.068	32%	0.321	C	S	.	.			trans	-87.9	131.6	-178.8	-65.9	-173.7	0	0	0	112	E584 L585 A589 L597 G634	E584-L592 HydrophobicContact CB-CD2 4.01Å; L585-L592 HydrophobicContact CD2-CD1 4.22Å; A589-L592 PolarHBondContact O-N 3.34Å; L592-L597 HydrophobicContact CB-CD1 4.48Å; L592-G634 VanDerWaalsContact CD1-CA 3.47Å
593	Y	85.5	Confident	89.2	Confident	138 Å²	138	60.9 Å²	60.9	54%	0.541	33%	0.33	S	S	.	.			trans	-114.9	130.8	174.1	-61.5	-82.6	0	0	0	110.5	H595 N596 L597	Y593-H595 VanDerWaalsContact CB-CE1 3.42Å; Y593-H595 WeakPolarHBondContact CB-CE1 3.31Å; Y593-H595 AromaticContact CG-CE1 3.86Å; Y593-H595 PolarHBondContact O-N 3.2Å; Y593-H595 VanDerWaalsContact O-N 3.17Å; Y593-N596 PolarHBondContact O-N 3.25Å; Y593-N596 VanDerWaalsContact O-N 3.09Å; Y593-L597 PolarHBondContact O-N 2.86Å
594	Q	87.9	Confident	89.3	Confident	102 Å²	102	57 Å²	57	48%	0.477	30%	0.304	S	S	.	.	H	α-helix	trans	-53	-39.4	-177.6	-167.5	-177	9.8	0	0	112.8	N596 L597 T598 V623 L625	Q594-N596 VanDerWaalsContact C-N 3.32Å; Q594-N596 PolarHBondContact O-N 2.88Å; Q594-L597 PolarHBondContact O-N 2.8Å; Q594-L597 VanDerWaalsContact O-N 3.12Å; Q594-T598 HydrophobicContact CG-CG2 4.49Å; Q594-T598 PolarHBondContact O-N 3.29Å; Q594-T598 PolarHBondContact O-OG1 2.82Å; Q594-V623 PolarHBondContact NE2-O 3.42Å; Q594-L625 HydrophobicContact CB-CD1 4.3Å
595	H	89.6	Confident	89.5	Confident	126 Å²	126	56 Å²	56	58%	0.583	30%	0.301	S	S	*	.	H	α-helix	trans	-64.7	-29	-178.7	63.4	-105.4	0	0	0	114.4	Y593 T598 G599	Y593-H595 VanDerWaalsContact CB-CE1 3.42Å; Y593-H595 WeakPolarHBondContact CB-CE1 3.31Å; Y593-H595 AromaticContact CG-CE1 3.86Å; Y593-H595 PolarHBondContact O-N 3.2Å; Y593-H595 VanDerWaalsContact O-N 3.17Å; H595-T598 WeakPolarHBondContact CA-OG1 3.38Å; H595-T598 PolarHBondContact O-OG1 3.46Å; H595-G599 PolarHBondContact O-N 2.99Å
596	N	90	Very high	89.7	Confident	68 Å²	68	63.8 Å²	63.8	36%	0.364	33%	0.33	S	S	.	.	H	α-helix	trans	-73.7	-39.1	174.1	-70.7	-23.8	0	0	0	110.5	Y593 Q594 G599 I600	Y593-N596 PolarHBondContact O-N 3.25Å; Y593-N596 VanDerWaalsContact O-N 3.09Å; Q594-N596 VanDerWaalsContact C-N 3.32Å; Q594-N596 PolarHBondContact O-N 2.88Å; N596-G599 PolarHBondContact O-N 2.78Å; N596-I600 WeakPolarHBondContact O-CG1 3.36Å; N596-I600 PolarHBondContact O-N 3.06Å
597	L	90.9	Very high	89.9	Confident	1 Å²	1	62.1 Å²	62.1	1%	0.005	33%	0.326	C	S	.	.	H	α-helix	trans	-71.3	-37.7	-178.6	-57.9	169.6	0	0	0	111.7	L581 E584 L592 Y593 Q594 I600 L601 V623 L625 F638	L581-L597 HydrophobicContact CD2-CD2 3.68Å; E584-L597 HydrophobicContact CB-CD2 4.19Å; E584-L597 HydrophobicContact CG-CD2 4.42Å; L592-L597 HydrophobicContact CB-CD1 4.48Å; Y593-L597 PolarHBondContact O-N 2.86Å; Q594-L597 PolarHBondContact O-N 2.8Å; Q594-L597 VanDerWaalsContact O-N 3.12Å; L597-I600 PolarHBondContact O-N 3.22Å; L597-L601 WeakPolarHBondContact O-CB 3.39Å; L597-L601 PolarHBondContact O-N 2.92Å; L597-V623 HydrophobicContact CB-CB 4.32Å; L597-V623 HydrophobicContact CB-CG1 3.86Å; L597-V623 HydrophobicContact CB-CG2 4.15Å; L597-V623 HydrophobicContact CD1-CG1 4.1Å; L597-L625 HydrophobicContact CD1-CD2 3.77Å; L597-F638 HydrophobicContact CD1-CD2 4.43Å
598	T	91.5	Very high	90.1	Very high	40 Å²	40	58 Å²	58	25%	0.245	31%	0.312	C	S	.	.	H	α-helix	trans	-67.8	-35.5	171.7	54.6	0	0	0	0	112	Q594 H595 I600 L601 E602 V623	Q594-T598 HydrophobicContact CG-CG2 4.49Å; Q594-T598 PolarHBondContact O-N 3.29Å; Q594-T598 PolarHBondContact O-OG1 2.82Å; H595-T598 WeakPolarHBondContact CA-OG1 3.38Å; H595-T598 PolarHBondContact O-OG1 3.46Å; T598-I600 PolarHBondContact O-N 2.86Å; T598-L601 WeakPolarHBondContact O-CB 3.47Å; T598-L601 PolarHBondContact O-N 3.29Å; T598-E602 PolarHBondContact O-N 3.18Å; T598-V623 HydrophobicContact CG2-CB 4.01Å; T598-V623 HydrophobicContact CG2-CG2 4.01Å
599	G	92.6	Very high	90.2	Very high	36 Å²	36	58.8 Å²	58.8	37%	0.371	31%	0.312	S	S	.	.	H	α-helix	trans	-61.9	-38.5	170.7	0	0	0	0	0	113.8	H595 N596 T603	H595-G599 PolarHBondContact O-N 2.99Å; N596-G599 PolarHBondContact O-N 2.78Å; G599-T603 PolarHBondContact O-N 2.69Å; G599-T603 PolarHBondContact O-OG1 3.04Å
600	I	93.3	Very high	90.4	Very high	31 Å²	31	58.5 Å²	58.5	16%	0.159	31%	0.309	C	S	.	.	H	α-helix	trans	-70	-41.4	173.4	-68.7	164.8	0	0	0	111.2	L580 L581 E584 N596 L597 T598 T603 A604	L580-I600 HydrophobicContact CB-CG2 3.62Å; L581-I600 HydrophobicContact CD2-CB 4.15Å; L581-I600 HydrophobicContact CD2-CD1 4.2Å; L581-I600 HydrophobicContact CD2-CG2 3.67Å; L581-I600 HydrophobicContact CG-CG2 3.98Å; E584-I600 HydrophobicContact CG-CD1 3.63Å; N596-I600 WeakPolarHBondContact O-CG1 3.36Å; N596-I600 PolarHBondContact O-N 3.06Å; L597-I600 PolarHBondContact O-N 3.22Å; T598-I600 PolarHBondContact O-N 2.86Å; I600-T603 WeakPolarHBondContact O-CB 2.97Å; I600-T603 PolarHBondContact O-N 2.91Å; I600-T603 VanDerWaalsContact O-N 3.16Å; I600-A604 PolarHBondContact O-N 3.41Å
601	L	93.4	Very high	90.5	Very high	7 Å²	7	58.1 Å²	58.1	4%	0.037	30%	0.3	C	S	.	.	H	α-helix	trans	-57.8	-50.4	175.6	176.7	61.2	0	0	0	111.6	F573 L577 L597 T598 T603 A604 V605 L621 V623 L640	F573-L601 HydrophobicContact CE2-CD1 4.13Å; F573-L601 HydrophobicContact CZ-CD1 3.62Å; L577-L601 HydrophobicContact CD1-CD1 4.13Å; L577-L601 HydrophobicContact CD2-CD1 4.38Å; L597-L601 WeakPolarHBondContact O-CB 3.39Å; L597-L601 PolarHBondContact O-N 2.92Å; T598-L601 WeakPolarHBondContact O-CB 3.47Å; T598-L601 PolarHBondContact O-N 3.29Å; L601-T603 PolarHBondContact O-N 2.99Å; L601-A604 WeakPolarHBondContact O-CB 3.34Å; L601-A604 PolarHBondContact O-N 2.98Å; L601-A604 VanDerWaalsContact O-N 3.1Å; L601-V605 HydrophobicContact CD1-CG2 4.46Å; L601-V605 WeakPolarHBondContact O-CG2 3.03Å; L601-V605 PolarHBondContact O-N 3.1Å; L601-L621 HydrophobicContact CD1-CD2 4.23Å; L601-L621 HydrophobicContact CD2-CG 4.35Å; L601-L621 WeakPolarHBondContact CD2-O 3.43Å; L601-V623 HydrophobicContact CB-CG2 4.17Å; L601-V623 HydrophobicContact CD2-CG2 3.71Å; L601-L640 HydrophobicContact CD1-CD2 4.15Å; L601-L640 HydrophobicContact CD2-CD2 4.34Å
602	E	91.8	Very high	90.6	Very high	80 Å²	80	62.4 Å²	62.4	37%	0.374	31%	0.314	S	S	.	.	H	α-helix	trans	-56.7	-37	174.5	-84.6	-71.5	145.8	0	0	112.6	T598 R606	T598-E602 PolarHBondContact O-N 3.18Å; E602-R606 WeakPolarHBondContact O-CD 3.21Å; E602-R606 WeakPolarHBondContact O-CG 3.43Å; E602-R606 PolarHBondContact O-N 3.33Å; E602-R606 VanDerWaalsContact O-N 3.16Å; E602-R606 IonicContact OE2-CZ 2.76Å; E602-R606 IonicContact OE2-NE 2.6Å; E602-R606 PolarHBondContact OE2-NE 2.93Å; E602-R606 IonicContact OE2-NH2 2.9Å; E602-R606 PolarHBondContact OE2-NH2 3.4Å
603	T	94	Very high	90.8	Very high	73 Å²	73	63 Å²	63	45%	0.448	32%	0.317	S	S	.	.	H	α-helix	trans	-71.1	-39.5	176.9	-58.7	0	0	0	0	111.4	L580 G599 I600 L601 R606 A607	L580-T603 HydrophobicContact CD1-CG2 4.15Å; G599-T603 PolarHBondContact O-N 2.69Å; G599-T603 PolarHBondContact O-OG1 3.04Å; I600-T603 WeakPolarHBondContact O-CB 2.97Å; I600-T603 PolarHBondContact O-N 2.91Å; I600-T603 VanDerWaalsContact O-N 3.16Å; L601-T603 PolarHBondContact O-N 2.99Å; T603-R606 PolarHBondContact O-N 2.9Å; T603-A607 VanDerWaalsContact O-CB 3.3Å; T603-A607 WeakPolarHBondContact O-CB 3.48Å; T603-A607 PolarHBondContact O-N 2.9Å; T603-A607 VanDerWaalsContact O-N 3.09Å
604	A	93.9	Very high	90.9	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-65.7	-42	174.8	0	0	0	0	0	112.2	F573 L577 L580 I600 L601 R606 A607 T608	F573-A604 HydrophobicContact CE2-CB 4.17Å; L577-A604 HydrophobicContact CB-CB 4.06Å; L577-A604 HydrophobicContact CD1-CB 3.73Å; L580-A604 HydrophobicContact CD1-CB 4.17Å; I600-A604 PolarHBondContact O-N 3.41Å; L601-A604 WeakPolarHBondContact O-CB 3.34Å; L601-A604 PolarHBondContact O-N 2.98Å; L601-A604 VanDerWaalsContact O-N 3.1Å; A604-R606 PolarHBondContact O-N 3.18Å; A604-A607 PolarHBondContact O-N 3.04Å; A604-T608 WeakPolarHBondContact O-CB 3.49Å; A604-T608 WeakPolarHBondContact O-CG2 3.24Å; A604-T608 PolarHBondContact O-N 3.38Å; A604-T608 PolarHBondContact O-OG1 3.32Å
605	V	92.5	Very high	90.7	Very high	9 Å²	9	57.6 Å²	57.6	6%	0.055	31%	0.308	C	S	.	.	H	α-helix	trans	-58.1	-48.9	175.3	169.1	0	0	0	0	110.7	F573 L601 A607 T608 A610 Q611 L618	F573-V605 HydrophobicContact CE2-CG2 3.74Å; F573-V605 HydrophobicContact CZ-CG2 4.48Å; L601-V605 HydrophobicContact CD1-CG2 4.46Å; L601-V605 WeakPolarHBondContact O-CG2 3.03Å; L601-V605 PolarHBondContact O-N 3.1Å; V605-A607 VanDerWaalsContact C-N 3.29Å; V605-A607 PolarHBondContact O-N 3.4Å; V605-T608 PolarHBondContact O-N 3.1Å; V605-T608 PolarHBondContact O-OG1 2.89Å; V605-A610 HydrophobicContact CG1-CB 4.21Å; V605-Q611 PolarHBondContact O-N 2.96Å; V605-L618 HydrophobicContact CG1-CD1 3.85Å; V605-L618 HydrophobicContact CG1-CD2 3.74Å; V605-L618 HydrophobicContact CG1-CG 4.37Å; V605-L618 HydrophobicContact CG2-CD2 4.38Å
606	R	92.3	Very high	90.5	Very high	163 Å²	163	56.2 Å²	56.2	62%	0.615	30%	0.302	S	S	*	.	H	α-helix	trans	-70	-21.8	-179.2	-65.8	167.5	-165.5	171	0.2	114	E602 T603 A604	E602-R606 WeakPolarHBondContact O-CD 3.21Å; E602-R606 WeakPolarHBondContact O-CG 3.43Å; E602-R606 PolarHBondContact O-N 3.33Å; E602-R606 VanDerWaalsContact O-N 3.16Å; E602-R606 IonicContact OE2-CZ 2.76Å; E602-R606 IonicContact OE2-NE 2.6Å; E602-R606 PolarHBondContact OE2-NE 2.93Å; E602-R606 IonicContact OE2-NH2 2.9Å; E602-R606 PolarHBondContact OE2-NH2 3.4Å; T603-R606 PolarHBondContact O-N 2.9Å; A604-R606 PolarHBondContact O-N 3.18Å
607	A	92.8	Very high	90.4	Very high	64 Å²	64	53.4 Å²	53.4	53%	0.529	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-4.5	178.8	0	0	0	0	0	114.1	T603 A604 V605	T603-A607 VanDerWaalsContact O-CB 3.3Å; T603-A607 WeakPolarHBondContact O-CB 3.48Å; T603-A607 PolarHBondContact O-N 2.9Å; T603-A607 VanDerWaalsContact O-N 3.09Å; A604-A607 PolarHBondContact O-N 3.04Å; V605-A607 VanDerWaalsContact C-N 3.29Å; V605-A607 PolarHBondContact O-N 3.4Å
608	T	93.1	Very high	90.3	Very high	8 Å²	8	54.9 Å²	54.9	5%	0.049	30%	0.295	C	S	.	.	S	Bend	trans	-129.9	177.2	-169.2	58.9	0	0	0	0	111.3	H576 A604 V605 A610 Q611	H576-T608 HydrophobicContact CB-CG2 3.82Å; A604-T608 WeakPolarHBondContact O-CB 3.49Å; A604-T608 WeakPolarHBondContact O-CG2 3.24Å; A604-T608 PolarHBondContact O-N 3.38Å; A604-T608 PolarHBondContact O-OG1 3.32Å; V605-T608 PolarHBondContact O-N 3.1Å; V605-T608 PolarHBondContact O-OG1 2.89Å; T608-A610 PolarHBondContact O-N 2.66Å; T608-A610 VanDerWaalsContact O-N 3.15Å; T608-Q611 WeakPolarHBondContact O-CG 3.16Å; T608-Q611 PolarHBondContact O-N 2.96Å
609	N	89.3	Confident	90.2	Very high	98 Å²	98	62.2 Å²	62.2	52%	0.524	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-67.6	-10.9	178.2	-64.3	-72.7	0	0	0	113.4	D572 Q611 F612	D572-N609 WeakPolarHBondContact OD2-CB 3.24Å; D572-N609 PolarHBondContact OD2-N 3.49Å; D572-N609 PolarHBondContact OD2-ND2 2.84Å; N609-Q611 PolarHBondContact O-N 3.17Å; N609-F612 HydrophobicContact CB-CD2 4.45Å; N609-F612 WeakPolarHBondContact O-CD2 3.49Å; N609-F612 PolarHBondContact O-N 2.98Å; N609-F612 VanDerWaalsContact O-N 3.16Å
610	A	87.6	Confident	90.1	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-58.7	-23.9	172.7	0	0	0	0	0	113.3	Y565 F573 V605 T608 F612 D613	Y565-A610 HydrophobicContact CE1-CB 4.21Å; Y565-A610 WeakPolarHBondContact OH-CB 2.96Å; F573-A610 HydrophobicContact CD2-CB 4.02Å; F573-A610 HydrophobicContact CG-CB 4.48Å; V605-A610 HydrophobicContact CG1-CB 4.21Å; T608-A610 PolarHBondContact O-N 2.66Å; T608-A610 VanDerWaalsContact O-N 3.15Å; A610-F612 PolarHBondContact O-N 3.4Å; A610-F612 VanDerWaalsContact O-N 3.07Å; A610-D613 PolarHBondContact O-N 2.9Å; A610-D613 VanDerWaalsContact O-N 3.12Å
611	Q	87.3	Confident	90	Very high	104 Å²	104	61.4 Å²	61.4	49%	0.486	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-59.7	-17.1	174.8	75.7	-179.4	-31.3	0	0	114.6	V605 T608 N609	V605-Q611 PolarHBondContact O-N 2.96Å; T608-Q611 WeakPolarHBondContact O-CG 3.16Å; T608-Q611 PolarHBondContact O-N 2.96Å; N609-Q611 PolarHBondContact O-N 3.17Å
612	F	88.3	Confident	89.8	Confident	150 Å²	150	64.4 Å²	64.4	66%	0.658	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-93.6	-4.8	-179.9	-59.4	-63.8	0	0	0	113.6	N609 A610	N609-F612 HydrophobicContact CB-CD2 4.45Å; N609-F612 WeakPolarHBondContact O-CD2 3.49Å; N609-F612 PolarHBondContact O-N 2.98Å; N609-F612 VanDerWaalsContact O-N 3.16Å; A610-F612 PolarHBondContact O-N 3.4Å; A610-F612 VanDerWaalsContact O-N 3.07Å
613	D	88.6	Confident	89.8	Confident	26 Å²	26	60.7 Å²	60.7	14%	0.139	30%	0.301	C	S	.	.	S	Bend	trans	-79.5	162.6	175.6	-72.3	-18.7	0	0	0	111.4	R564 Y565 Q570 A610	R564-D613 IonicContact CZ-OD1 3.53Å; R564-D613 IonicContact CZ-OD2 2.81Å; R564-D613 IonicContact NH1-OD1 3.94Å; R564-D613 PolarHBondContact NH1-OD1 3.29Å; R564-D613 IonicContact NH1-OD2 3.54Å; R564-D613 PolarHBondContact NH1-OD2 2.85Å; R564-D613 IonicContact NH2-OD1 2.6Å; Y565-D613 PolarHBondContact OH-OD2 3.15Å; Q570-D613 PolarHBondContact NE2-OD2 3.28Å; A610-D613 PolarHBondContact O-N 2.9Å; A610-D613 VanDerWaalsContact O-N 3.12Å
614	S	87.4	Confident	89.6	Confident	41 Å²	41	62.4 Å²	62.4	29%	0.287	30%	0.3	S	S	.	.			trans	-63.9	144	-171.9	83.6	0	0	0	0	111.4	E616 I617 L618	S614-E616 PolarHBondContact O-N 2.96Å; S614-E616 VanDerWaalsContact O-N 3.09Å; S614-I617 WeakPolarHBondContact O-CB 3.07Å; S614-I617 PolarHBondContact O-N 2.96Å; S614-I617 WeakPolarHBondContact OG-CD1 3.36Å; S614-I617 WeakPolarHBondContact OG-CG1 3.43Å; S614-I617 PolarHBondContact OG-N 3.26Å; S614-L618 PolarHBondContact O-N 3.23Å; S614-L618 VanDerWaalsContact O-N 3.13Å
615	P	85.3	Confident	89.3	Confident	84 Å²	84	65.2 Å²	65.2	55%	0.545	31%	0.314	S	S	.	.	H	α-helix	trans	-63.3	-20.5	-179.7	26.2	-35	0	0	0	112.4	R619	P615-R619 WeakPolarHBondContact O-CB 3.35Å; P615-R619 WeakPolarHBondContact O-CD 3.46Å; P615-R619 WeakPolarHBondContact O-CG 3.43Å; P615-R619 PolarHBondContact O-N 3.08Å
616	E	85.2	Confident	89	Confident	98 Å²	98	67.4 Å²	67.4	46%	0.458	33%	0.325	S	S	.	.	H	α-helix	trans	-78.6	-28	174.2	-60	-171.9	169.1	0	0	112.8	S614 R620	S614-E616 PolarHBondContact O-N 2.96Å; S614-E616 VanDerWaalsContact O-N 3.09Å; E616-R620 VanDerWaalsContact O-CD 3.28Å; E616-R620 WeakPolarHBondContact O-CD 3.47Å; E616-R620 WeakPolarHBondContact O-CG 3.32Å
617	I	88.2	Confident	88.5	Confident	9 Å²	9	68.7 Å²	68.7	5%	0.046	34%	0.339	C	S	.	.	H	α-helix	trans	-69.8	-45	169.1	-74.7	163.9	0	0	0	110.2	D557 A561 Y565 S614 R620 L621 Y642	D557-I617 HydrophobicContact CB-CD1 3.96Å; A561-I617 HydrophobicContact CB-CB 4.49Å; A561-I617 HydrophobicContact CB-CD1 4.18Å; A561-I617 HydrophobicContact CB-CG1 4.13Å; A561-I617 HydrophobicContact CB-CG2 3.56Å; Y565-I617 HydrophobicContact CE2-CG2 3.85Å; S614-I617 WeakPolarHBondContact O-CB 3.07Å; S614-I617 PolarHBondContact O-N 2.96Å; S614-I617 WeakPolarHBondContact OG-CD1 3.36Å; S614-I617 WeakPolarHBondContact OG-CG1 3.43Å; S614-I617 PolarHBondContact OG-N 3.26Å; I617-R620 PolarHBondContact O-N 3.45Å; I617-L621 PolarHBondContact O-N 2.95Å; I617-Y642 WeakPolarHBondContact CA-OH 3.45Å; I617-Y642 HydrophobicContact CG2-CE2 4.45Å; I617-Y642 WeakPolarHBondContact O-CE2 3.41Å
618	L	88.6	Confident	88	Confident	32 Å²	32	68.9 Å²	68.9	17%	0.168	33%	0.333	C	S	.	.	H	α-helix	trans	-68.6	-40.9	-176.4	-62	177.1	0	0	0	112.4	V605 S614 R620 L621	V605-L618 HydrophobicContact CG1-CD1 3.85Å; V605-L618 HydrophobicContact CG1-CD2 3.74Å; V605-L618 HydrophobicContact CG1-CG 4.37Å; V605-L618 HydrophobicContact CG2-CD2 4.38Å; S614-L618 PolarHBondContact O-N 3.23Å; S614-L618 VanDerWaalsContact O-N 3.13Å; L618-R620 PolarHBondContact O-N 2.91Å; L618-L621 PolarHBondContact O-N 3.25Å
619	R	88.9	Confident	87.3	Confident	194 Å²	194	71.7 Å²	71.7	73%	0.732	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-14.2	173.3	-77.5	169.5	-176.2	166	1.5	114.9	P615	P615-R619 WeakPolarHBondContact O-CB 3.35Å; P615-R619 WeakPolarHBondContact O-CD 3.46Å; P615-R619 WeakPolarHBondContact O-CG 3.43Å; P615-R619 PolarHBondContact O-N 3.08Å
620	R	90.4	Very high	86.3	Confident	37 Å²	37	73.9 Å²	73.9	14%	0.14	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-10.8	178.5	-66	174.9	-178.2	-70.8	-0.6	112.8	E616 I617 L618 D622 Y642 H643 D645	E616-R620 VanDerWaalsContact O-CD 3.28Å; E616-R620 WeakPolarHBondContact O-CD 3.47Å; E616-R620 WeakPolarHBondContact O-CG 3.32Å; I617-R620 PolarHBondContact O-N 3.45Å; L618-R620 PolarHBondContact O-N 2.91Å; R620-D622 PolarHBondContact O-N 3.49Å; R620-Y642 HydrophobicContact CB-CD2 4.15Å; R620-Y642 HydrophobicContact CB-CE1 4.18Å; R620-Y642 HydrophobicContact CB-CE2 3.65Å; R620-Y642 CarbonylContact O-C 3.16Å; R620-Y642 WeakPolarHBondContact O-CA 3.35Å; R620-H643 WeakPolarHBondContact CB-O 3.31Å; R620-H643 WeakPolarHBondContact CD-O 3.3Å; R620-H643 VanDerWaalsContact CG-O 3.22Å; R620-H643 WeakPolarHBondContact CG-O 3.37Å; R620-H643 PolarHBondContact NH1-O 3.06Å; R620-H643 PolarHBondContact O-N 3.13Å; R620-D645 IonicContact CZ-OD1 3.87Å; R620-D645 VanDerWaalsContact NH1-CG 3.31Å; R620-D645 IonicContact NH1-OD1 3.59Å; R620-D645 PolarHBondContact NH1-OD1 3.12Å; R620-D645 IonicContact NH1-OD2 2.81Å; R620-D645 IonicContact NH2-OD1 2.73Å; R620-D645 PolarHBondContact NH2-OD1 2.73Å
621	L	91.4	Very high	85.6	Confident	12 Å²	12	77.5 Å²	77.5	6%	0.063	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	105.2	-179	-177.5	65	0	0	0	109.5	Y565 F573 L601 I617 L618 L640 Y642	Y565-L621 HydrophobicContact CD1-CD2 3.74Å; Y565-L621 HydrophobicContact CD2-CD1 4.48Å; Y565-L621 HydrophobicContact CD2-CD2 4.25Å; Y565-L621 HydrophobicContact CE1-CD2 3.96Å; Y565-L621 HydrophobicContact CE2-CD2 4.46Å; Y565-L621 HydrophobicContact CG-CD1 4.08Å; Y565-L621 HydrophobicContact CG-CD2 3.9Å; F573-L621 HydrophobicContact CZ-CD2 4.09Å; L601-L621 HydrophobicContact CD1-CD2 4.23Å; L601-L621 HydrophobicContact CD2-CG 4.35Å; L601-L621 WeakPolarHBondContact CD2-O 3.43Å; I617-L621 PolarHBondContact O-N 2.95Å; L618-L621 PolarHBondContact O-N 3.25Å; L621-L640 HydrophobicContact CD1-CD1 4.48Å; L621-Y642 HydrophobicContact CB-CD2 4.48Å; L621-Y642 HydrophobicContact CD1-CD2 4.4Å
622	D	90.1	Very high	85.3	Confident	70 Å²	70	74.8 Å²	74.8	37%	0.374	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	160.6	-173.1	-109.4	-46.6	0	0	0	112.5	R620 D641	R620-D622 PolarHBondContact O-N 3.49Å; D622-D641 PolarHBondContact N-O 3.5Å; D622-D641 PolarHBondContact O-N 2.9Å
623	V	91.6	Very high	85.2	Confident	2 Å²	2	69.9 Å²	69.9	1%	0.012	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	127.6	169.8	-177.9	0	0	0	0	109.8	Q594 L597 T598 L601 F638 L640	Q594-V623 PolarHBondContact NE2-O 3.42Å; L597-V623 HydrophobicContact CB-CB 4.32Å; L597-V623 HydrophobicContact CB-CG1 3.86Å; L597-V623 HydrophobicContact CB-CG2 4.15Å; L597-V623 HydrophobicContact CD1-CG1 4.1Å; T598-V623 HydrophobicContact CG2-CB 4.01Å; T598-V623 HydrophobicContact CG2-CG2 4.01Å; L601-V623 HydrophobicContact CB-CG2 4.17Å; L601-V623 HydrophobicContact CD2-CG2 3.71Å; V623-F638 HydrophobicContact CG1-CD2 3.8Å; V623-F638 HydrophobicContact CG1-CE2 3.64Å; V623-F638 HydrophobicContact CG2-CE2 4.12Å; V623-L640 HydrophobicContact CG2-CD2 4.5Å
624	R	89.6	Confident	85	Confident	110 Å²	110	68.6 Å²	68.6	42%	0.415	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	134.5	173.3	177.8	167.3	173.2	-177.8	-2.8	110.7	S639 D641	R624-S639 PolarHBondContact N-O 2.93Å; R624-S639 PolarHBondContact O-N 3.37Å; R624-D641 HydrophobicContact CB-CB 3.83Å; R624-D641 WeakPolarHBondContact CD-OD2 3.35Å; R624-D641 IonicContact CZ-OD2 3.59Å; R624-D641 IonicContact NE-OD2 2.82Å; R624-D641 IonicContact NH1-OD2 3.23Å; R624-D641 PolarHBondContact NH1-OD2 3.26Å
625	L	87.4	Confident	85	Confident	58 Å²	58	67.4 Å²	67.4	30%	0.304	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	138.3	170.2	-63.2	171.5	0	0	0	109	Q594 L597 V637	Q594-L625 HydrophobicContact CB-CD1 4.3Å; L597-L625 HydrophobicContact CD1-CD2 3.77Å; L625-V637 HydrophobicContact CB-CG1 4.16Å; L625-V637 HydrophobicContact CD2-CG1 4.05Å
626	L	86.1	Confident	85	Confident	55 Å²	55	65.2 Å²	65.2	29%	0.288	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-82.7	172.4	171	-58.6	179.2	0	0	0	111.1	V637	L626-V637 HydrophobicContact CB-CG1 4.45Å; L626-V637 PolarHBondContact N-O 2.84Å; L626-V637 WeakPolarHBondContact O-CG1 3.26Å
627	E	81.4	Confident	85.2	Confident	191 Å²	191	60.8 Å²	60.8	89%	0.893	33%	0.326	S	S	*	.	P	Polyproline II helix	trans	-68.4	130	174.3	-67.7	174.3	-166.8	0	0	110.2
628	V	83.1	Confident	85.4	Confident	68 Å²	68	60.4 Å²	60.4	41%	0.412	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-91	123.4	-170.2	-179.7	0	0	0	0	111.4	A589 T590 D632 V637	A589-V628 HydrophobicContact CB-CG1 3.74Å; A589-V628 HydrophobicContact CB-CG2 4.09Å; T590-V628 HydrophobicContact CG2-CG1 4.22Å; V628-D632 HydrophobicContact CG1-CB 4.49Å; V628-V637 HydrophobicContact CG2-CG1 3.91Å; V628-V637 HydrophobicContact CG2-CG2 4.18Å
629	S	77.3	Confident	85.5	Confident	67 Å²	67	58.9 Å²	58.9	47%	0.469	32%	0.316	S	S	.	.	P	Polyproline II helix	trans	-91.4	150.3	169.6	-57.1	0	0	0	0	111.7	G631 D632	S629-G631 PolarHBondContact O-N 3.44Å; S629-D632 WeakPolarHBondContact CA-OD2 3.2Å; S629-D632 VanDerWaalsContact CB-OD2 3.28Å; S629-D632 WeakPolarHBondContact CB-OD2 3.36Å; S629-D632 PolarHBondContact N-OD2 3.03Å; S629-D632 PolarHBondContact O-N 3.28Å; S629-D632 VanDerWaalsContact O-N 3.11Å
630	P	69	Low	85.7	Confident	143 Å²	143	49.7 Å²	49.7	93%	0.929	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	103.3	178.7	27.8	-34.3	0	0	0	111
631	G	72	Confident	85.7	Confident	76 Å²	76	49.5 Å²	49.5	78%	0.784	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	130	-14.9	-175.6	0	0	0	0	0	113.6	S629	S629-G631 PolarHBondContact O-N 3.44Å
632	D	82.3	Confident	85.7	Confident	48 Å²	48	49.1 Å²	49.1	26%	0.257	28%	0.282	S	S	.	.			trans	-67.1	133.2	-174.7	-68.9	-13.1	0	0	0	113.2	A589 V628 S629 V637	A589-D632 HydrophobicContact CB-CB 4.23Å; A589-D632 WeakPolarHBondContact CB-O 3.27Å; A589-D632 PolarHBondContact N-O 2.88Å; V628-D632 HydrophobicContact CG1-CB 4.49Å; S629-D632 WeakPolarHBondContact CA-OD2 3.2Å; S629-D632 VanDerWaalsContact CB-OD2 3.28Å; S629-D632 WeakPolarHBondContact CB-OD2 3.36Å; S629-D632 PolarHBondContact N-OD2 3.03Å; S629-D632 PolarHBondContact O-N 3.28Å; S629-D632 VanDerWaalsContact O-N 3.11Å; D632-V637 HydrophobicContact CB-CG2 3.94Å
633	T	84.8	Confident	85.7	Confident	46 Å²	46	51.1 Å²	51.1	28%	0.282	29%	0.288	S	S	.	.	B	Isolated β-bridge	trans	-82	152.3	167.4	72.8	0	0	0	0	110.2	W635 D636 R672	T633-W635 PolarHBondContact O-N 3.02Å; T633-D636 PolarHBondContact O-N 3.39Å; T633-D636 PolarHBondContact OG1-OD2 3.03Å; T633-R672 PolarHBondContact OG1-NH2 2.83Å; T633-R672 VanDerWaalsContact OG1-NH2 3.08Å
634	G	85.2	Confident	85.5	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-51.6	-33.9	178.9	0	0	0	0	0	114.6	L585 R587 L592 D636 V637 F638	L585-G634 WeakPolarHBondContact O-CA 3.23Å; L585-G634 PolarHBondContact O-N 3.38Å; L585-G634 VanDerWaalsContact O-N 3.07Å; R587-G634 PolarHBondContact O-N 3.35Å; R587-G634 VanDerWaalsContact O-N 3.11Å; L592-G634 VanDerWaalsContact CD1-CA 3.47Å; G634-D636 PolarHBondContact O-N 3.31Å; G634-D636 VanDerWaalsContact O-N 3.15Å; G634-V637 PolarHBondContact O-N 2.82Å; G634-F638 WeakPolarHBondContact O-CB 3.43Å; G634-F638 PolarHBondContact O-N 2.92Å
635	W	88	Confident	85	Confident	15 Å²	15	50.7 Å²	50.7	6%	0.057	30%	0.295	C	S	.	.	H	α-helix	trans	-54.2	-28	174.9	-71.2	98.9	0	0	0	115.5	M578 K582 L585 T633 W668 R672	M578-W635 HydrophobicContact CE-CH2 4.37Å; M578-W635 HydrophobicContact CE-CZ3 3.93Å; K582-W635 HydrophobicContact CB-CZ2 4.24Å; K582-W635 HydrophobicContact CG-CZ2 4.2Å; L585-W635 HydrophobicContact CB-CD2 3.76Å; L585-W635 HydrophobicContact CB-CE3 4.41Å; L585-W635 HydrophobicContact CB-CG 3.82Å; L585-W635 HydrophobicContact CB-CZ2 4.25Å; L585-W635 HydrophobicContact CD1-CD2 3.87Å; L585-W635 HydrophobicContact CD1-CE3 3.65Å; L585-W635 HydrophobicContact CD1-CG 4.48Å; L585-W635 HydrophobicContact CD1-CH2 4.21Å; L585-W635 HydrophobicContact CD1-CZ2 4.41Å; L585-W635 HydrophobicContact CD1-CZ3 3.82Å; L585-W635 HydrophobicContact CG-CD2 4.49Å; L585-W635 PolarHBondContact O-N 3.41Å; T633-W635 PolarHBondContact O-N 3.02Å; W635-W668 HydrophobicContact CE3-CZ2 4.1Å; W635-W668 AromaticContact CZ3-CZ2 3.97Å; W635-W668 HydrophobicContact CZ3-CZ2 3.97Å; W635-W668 PolarHBondContact O-NE1 3.23Å; W635-R672 HydrophobicContact CD2-CG 4.2Å; W635-R672 HydrophobicContact CE3-CB 4.4Å; W635-R672 HydrophobicContact CE3-CG 3.86Å; W635-R672 HydrophobicContact CZ3-CG 4.29Å
636	D	85.4	Confident	84.8	Confident	39 Å²	39	50.1 Å²	50.1	21%	0.209	30%	0.303	C	S	.	.	H	α-helix	trans	-94.5	-17	-173.2	-68.4	-69.8	0	0	0	113.3	T633 G634 R669 R672	T633-D636 PolarHBondContact O-N 3.39Å; T633-D636 PolarHBondContact OG1-OD2 3.03Å; G634-D636 PolarHBondContact O-N 3.31Å; G634-D636 VanDerWaalsContact O-N 3.15Å; D636-R669 VanDerWaalsContact CA-NH2 3.34Å; D636-R669 PolarHBondContact O-NH2 3.35Å; D636-R669 IonicContact OD1-CZ 2.76Å; D636-R669 IonicContact OD1-NE 3.38Å; D636-R669 PolarHBondContact OD1-NE 3.04Å; D636-R669 IonicContact OD1-NH2 3.23Å; D636-R669 PolarHBondContact OD1-NH2 2.78Å; D636-R669 VanDerWaalsContact OD1-NH2 3.1Å; D636-R672 IonicContact OD1-NH1 3.21Å; D636-R672 PolarHBondContact OD1-NH1 3.4Å; D636-R672 VanDerWaalsContact OD1-NH1 3.1Å; D636-R672 IonicContact OD2-CZ 3.12Å; D636-R672 IonicContact OD2-NH1 2.77Å; D636-R672 PolarHBondContact OD2-NH1 2.92Å; D636-R672 IonicContact OD2-NH2 2.67Å
637	V	88.3	Confident	84.6	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.024	29%	0.292	C	S	.	.	H	α-helix	trans	-104.9	-26.9	-176.7	173.7	0	0	0	0	112.1	A589 L625 L626 V628 D632 G634 S639	A589-V637 HydrophobicContact CB-CB 4.14Å; A589-V637 HydrophobicContact CB-CG1 4.46Å; A589-V637 HydrophobicContact CB-CG2 3.68Å; L625-V637 HydrophobicContact CB-CG1 4.16Å; L625-V637 HydrophobicContact CD2-CG1 4.05Å; L626-V637 HydrophobicContact CB-CG1 4.45Å; L626-V637 PolarHBondContact N-O 2.84Å; L626-V637 WeakPolarHBondContact O-CG1 3.26Å; V628-V637 HydrophobicContact CG2-CG1 3.91Å; V628-V637 HydrophobicContact CG2-CG2 4.18Å; D632-V637 HydrophobicContact CB-CG2 3.94Å; G634-V637 PolarHBondContact O-N 2.82Å; V637-S639 PolarHBondContact O-N 3.27Å
638	F	91.9	Very high	84.9	Confident	1 Å²	1	39 Å²	39	0%	0.004	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	127.6	175.6	171.9	-91.3	0	0	0	112.1	L577 L581 L585 L597 V623 G634 L640 F664 W668	L577-F638 HydrophobicContact CD2-CZ 4.44Å; L581-F638 HydrophobicContact CD1-CD1 4.4Å; L581-F638 HydrophobicContact CD1-CD2 4.22Å; L581-F638 HydrophobicContact CD1-CE1 3.83Å; L581-F638 HydrophobicContact CD1-CE2 3.61Å; L581-F638 HydrophobicContact CD1-CZ 3.39Å; L581-F638 HydrophobicContact CD2-CE2 4.4Å; L585-F638 HydrophobicContact CD2-CB 3.63Å; L585-F638 HydrophobicContact CD2-CD2 4.33Å; L585-F638 HydrophobicContact CD2-CG 4.04Å; L597-F638 HydrophobicContact CD1-CD2 4.43Å; V623-F638 HydrophobicContact CG1-CD2 3.8Å; V623-F638 HydrophobicContact CG1-CE2 3.64Å; V623-F638 HydrophobicContact CG2-CE2 4.12Å; G634-F638 WeakPolarHBondContact O-CB 3.43Å; G634-F638 PolarHBondContact O-N 2.92Å; F638-L640 HydrophobicContact CE1-CG 4.41Å; F638-L640 HydrophobicContact CZ-CD2 3.8Å; F638-L640 HydrophobicContact CZ-CG 4.16Å; F638-F664 HydrophobicContact CE1-CZ 4.5Å; F638-W668 HydrophobicContact CD1-CD2 4.47Å; F638-W668 AromaticContact CD1-CE2 3.68Å; F638-W668 HydrophobicContact CD1-CH2 4.16Å; F638-W668 AromaticContact CD1-CZ2 3.51Å; F638-W668 HydrophobicContact CD1-CZ2 3.51Å; F638-W668 AromaticContact CD1-NE1 3.88Å; F638-W668 AromaticContact CE1-CH2 3.8Å; F638-W668 HydrophobicContact CE1-CH2 3.8Å; F638-W668 AromaticContact CE1-CZ2 3.65Å; F638-W668 HydrophobicContact CE1-CZ2 3.65Å; F638-W668 HydrophobicContact CE1-CZ3 4.33Å
639	S	91.8	Very high	85	Confident	0 Å²	0	37 Å²	37	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	150.8	167.1	-165.2	0	0	0	0	111.1	R624 V637 L661 F664	R624-S639 PolarHBondContact N-O 2.93Å; R624-S639 PolarHBondContact O-N 3.37Å; V637-S639 PolarHBondContact O-N 3.27Å; S639-L661 WeakPolarHBondContact OG-CD1 3.5Å; S639-F664 WeakPolarHBondContact OG-CD1 3.34Å
640	L	92	Very high	85.5	Confident	1 Å²	1	34.3 Å²	34.3	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	148.1	157.4	-63	178.2	0	0	0	108.8	L566 F573 I574 L577 L601 L621 V623 F638 F664	L566-L640 HydrophobicContact CD2-CB 4.42Å; F573-L640 HydrophobicContact CE1-CD1 4.29Å; I574-L640 HydrophobicContact CD1-CD1 4.41Å; L577-L640 HydrophobicContact CD2-CD1 4.18Å; L577-L640 HydrophobicContact CD2-CD2 4.41Å; L601-L640 HydrophobicContact CD1-CD2 4.15Å; L601-L640 HydrophobicContact CD2-CD2 4.34Å; L621-L640 HydrophobicContact CD1-CD1 4.48Å; V623-L640 HydrophobicContact CG2-CD2 4.5Å; F638-L640 HydrophobicContact CE1-CG 4.41Å; F638-L640 HydrophobicContact CZ-CD2 3.8Å; F638-L640 HydrophobicContact CZ-CG 4.16Å; L640-F664 HydrophobicContact CB-CE2 4.02Å; L640-F664 HydrophobicContact CB-CZ 4.03Å; L640-F664 HydrophobicContact CD1-CE2 3.96Å; L640-F664 HydrophobicContact CD1-CZ 4.19Å; L640-F664 HydrophobicContact CG-CE2 4.08Å; L640-F664 HydrophobicContact CG-CZ 3.91Å
641	D	90.6	Very high	86.4	Confident	34 Å²	34	27.5 Å²	27.5	18%	0.182	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	160.7	169.7	-153.9	-18.1	0	0	0	109	D622 R624	D622-D641 PolarHBondContact N-O 3.5Å; D622-D641 PolarHBondContact O-N 2.9Å; R624-D641 HydrophobicContact CB-CB 3.83Å; R624-D641 WeakPolarHBondContact CD-OD2 3.35Å; R624-D641 IonicContact CZ-OD2 3.59Å; R624-D641 IonicContact NE-OD2 2.82Å; R624-D641 IonicContact NH1-OD2 3.23Å; R624-D641 PolarHBondContact NH1-OD2 3.26Å
642	Y	92.5	Very high	87.2	Confident	4 Å²	4	24.1 Å²	24.1	2%	0.016	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	107	-177.9	-162.6	-105.8	0	0	0	110.3	H558 A561 M562 I617 R620 L621 V644 M657	H558-Y642 AromaticContact ND1-CE1 4Å; H558-Y642 AromaticContact ND1-CZ 3.84Å; H558-Y642 PolarHBondContact ND1-OH 3.3Å; A561-Y642 HydrophobicContact CB-CE2 4.44Å; M562-Y642 HydrophobicContact CG-CD1 4.16Å; I617-Y642 WeakPolarHBondContact CA-OH 3.45Å; I617-Y642 HydrophobicContact CG2-CE2 4.45Å; I617-Y642 WeakPolarHBondContact O-CE2 3.41Å; R620-Y642 HydrophobicContact CB-CD2 4.15Å; R620-Y642 HydrophobicContact CB-CE1 4.18Å; R620-Y642 HydrophobicContact CB-CE2 3.65Å; R620-Y642 CarbonylContact O-C 3.16Å; R620-Y642 WeakPolarHBondContact O-CA 3.35Å; L621-Y642 HydrophobicContact CB-CD2 4.48Å; L621-Y642 HydrophobicContact CD1-CD2 4.4Å; Y642-V644 HydrophobicContact CD1-CG2 4.07Å; Y642-V644 PolarHBondContact O-N 3.36Å; Y642-V644 VanDerWaalsContact O-N 3.1Å; Y642-M657 WeakPolarHBondContact O-CE 3.25Å
643	H	90.2	Very high	87.4	Confident	112 Å²	112	23.1 Å²	23.1	52%	0.519	14%	0.137	S	C	.	.			trans	-75.8	102.1	-173.4	-165.3	68.9	0	0	0	111.5	R620	R620-H643 WeakPolarHBondContact CB-O 3.31Å; R620-H643 WeakPolarHBondContact CD-O 3.3Å; R620-H643 VanDerWaalsContact CG-O 3.22Å; R620-H643 WeakPolarHBondContact CG-O 3.37Å; R620-H643 PolarHBondContact NH1-O 3.06Å; R620-H643 PolarHBondContact O-N 3.13Å
644	V	85.5	Confident	87.5	Confident	26 Å²	26	31.6 Å²	31.6	16%	0.158	16%	0.164	C	C	.	.			trans	-94.8	126	174.9	-161.3	0	0	0	0	109.5	Y642 I648 A649 F652 M657	Y642-V644 HydrophobicContact CD1-CG2 4.07Å; Y642-V644 PolarHBondContact O-N 3.36Å; Y642-V644 VanDerWaalsContact O-N 3.1Å; V644-I648 VanDerWaalsContact CG1-C 3.45Å; V644-I648 HydrophobicContact CG1-CB 3.63Å; V644-I648 HydrophobicContact CG1-CG2 3.59Å; V644-A649 HydrophobicContact CG1-CB 4.05Å; V644-A649 VanDerWaalsContact CG1-N 3.34Å; V644-F652 HydrophobicContact CB-CB 4.48Å; V644-F652 HydrophobicContact CG1-CB 4.21Å; V644-F652 HydrophobicContact CG1-CD2 3.9Å; V644-F652 HydrophobicContact CG2-CB 3.97Å; V644-F652 HydrophobicContact CG2-CD2 3.87Å; V644-F652 HydrophobicContact CG2-CG 4.42Å; V644-M657 HydrophobicContact CG2-SD 4.13Å
645	D	80.4	Confident	87.5	Confident	77 Å²	77	37.5 Å²	37.5	41%	0.412	19%	0.192	S	C	.	.			trans	-132.4	176.6	174.1	67.6	8.3	0	0	0	110.9	R620 I648	R620-D645 IonicContact CZ-OD1 3.87Å; R620-D645 VanDerWaalsContact NH1-CG 3.31Å; R620-D645 IonicContact NH1-OD1 3.59Å; R620-D645 PolarHBondContact NH1-OD1 3.12Å; R620-D645 IonicContact NH1-OD2 2.81Å; R620-D645 IonicContact NH2-OD1 2.73Å; R620-D645 PolarHBondContact NH2-OD1 2.73Å; D645-I648 PolarHBondContact O-N 2.96Å
646	G	82.3	Confident	87.6	Confident	45 Å²	45	37.1 Å²	37.1	46%	0.464	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	57.5	-143.6	175.7	0	0	0	0	0	113.7	I648 A649	G646-I648 PolarHBondContact O-N 2.97Å; G646-A649 PolarHBondContact O-N 3.49Å
647	P	83.4	Confident	87.9	Confident	9 Å²	9	36.5 Å²	36.5	6%	0.058	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-65.8	-23.6	-175.4	25	-32.8	0	0	0	113.8	F492 V496 L549 Y553 A649 T650	F492-P647 HydrophobicContact CE1-CB 4.04Å; F492-P647 HydrophobicContact CE2-CB 4.5Å; F492-P647 HydrophobicContact CZ-CB 3.55Å; V496-P647 HydrophobicContact CG1-CB 3.84Å; L549-P647 HydrophobicContact CD2-CB 4.04Å; Y553-P647 HydrophobicContact CD1-CG 3.54Å; Y553-P647 HydrophobicContact CD2-CG 3.81Å; Y553-P647 HydrophobicContact CE1-CG 3.59Å; Y553-P647 HydrophobicContact CE2-CG 3.87Å; Y553-P647 HydrophobicContact CG-CG 3.64Å; P647-A649 VanDerWaalsContact C-N 3.3Å; P647-A649 PolarHBondContact O-N 3.08Å; P647-T650 WeakPolarHBondContact O-CB 3.45Å; P647-T650 PolarHBondContact O-N 3.42Å
648	I	85.9	Confident	88	Confident	4 Å²	4	39 Å²	39	2%	0.021	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-70.5	-30.9	-176.6	-48	174.8	0	0	0	110.6	L555 V644 D645 G646 T650 V651 F652	L555-I648 HydrophobicContact CD1-CG2 4.12Å; V644-I648 VanDerWaalsContact CG1-C 3.45Å; V644-I648 HydrophobicContact CG1-CB 3.63Å; V644-I648 HydrophobicContact CG1-CG2 3.59Å; D645-I648 PolarHBondContact O-N 2.96Å; G646-I648 PolarHBondContact O-N 2.97Å; I648-T650 PolarHBondContact O-N 3.31Å; I648-T650 VanDerWaalsContact O-N 3.16Å; I648-V651 PolarHBondContact O-N 3.19Å; I648-F652 HydrophobicContact CG2-CD2 3.56Å; I648-F652 HydrophobicContact CG2-CE2 3.42Å; I648-F652 VanDerWaalsContact CG2-CE2 3.42Å; I648-F652 HydrophobicContact CG2-CZ 4.36Å; I648-F652 PolarHBondContact O-N 3.4Å
649	A	86.7	Confident	88	Confident	27 Å²	27	41.2 Å²	41.2	22%	0.223	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-65.7	-16.3	178.5	0	0	0	0	0	113.6	V644 G646 P647 V651 F652	V644-A649 HydrophobicContact CG1-CB 4.05Å; V644-A649 VanDerWaalsContact CG1-N 3.34Å; G646-A649 PolarHBondContact O-N 3.49Å; P647-A649 VanDerWaalsContact C-N 3.3Å; P647-A649 PolarHBondContact O-N 3.08Å; A649-V651 VanDerWaalsContact C-N 3.34Å; A649-F652 CarbonylContact O-C 3.55Å
650	T	86.7	Confident	88.1	Confident	9 Å²	9	41.3 Å²	41.3	6%	0.055	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-71.2	-28.9	171.8	-68.9	0	0	0	0	112.6	W460 F492 P647 I648 L744	W460-T650 HydrophobicContact CB-CG2 3.45Å; W460-T650 VanDerWaalsContact CB-CG2 3.45Å; W460-T650 HydrophobicContact CD2-CG2 4.15Å; W460-T650 HydrophobicContact CG-CG2 3.65Å; F492-T650 HydrophobicContact CD2-CG2 4.5Å; F492-T650 HydrophobicContact CE2-CG2 3.87Å; F492-T650 WeakPolarHBondContact CE2-OG1 3.44Å; P647-T650 WeakPolarHBondContact O-CB 3.45Å; P647-T650 PolarHBondContact O-N 3.42Å; I648-T650 PolarHBondContact O-N 3.31Å; I648-T650 VanDerWaalsContact O-N 3.16Å; T650-L744 HydrophobicContact CG2-CD2 4.44Å
651	V	87.9	Confident	88.1	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.006	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-47.9	173.6	-175.4	0	0	0	0	110.4	L555 I648 A649 T653 L744 I747 I748	L555-V651 HydrophobicContact CD1-CB 4.32Å; L555-V651 HydrophobicContact CD1-CG1 4.48Å; L555-V651 HydrophobicContact CD1-CG2 4.18Å; L555-V651 HydrophobicContact CD2-CG2 4.27Å; I648-V651 PolarHBondContact O-N 3.19Å; A649-V651 VanDerWaalsContact C-N 3.34Å; V651-T653 VanDerWaalsContact C-N 3.35Å; V651-T653 PolarHBondContact O-N 2.88Å; V651-T653 VanDerWaalsContact O-N 3.11Å; V651-L744 HydrophobicContact CG2-CD1 3.64Å; V651-L744 HydrophobicContact CG2-CG 4.34Å; V651-I747 HydrophobicContact CG1-CG2 4.32Å; V651-I748 HydrophobicContact CG1-CG1 4.22Å; V651-I748 HydrophobicContact CG2-CG1 4.47Å
652	F	88.9	Confident	88.1	Confident	5 Å²	5	46 Å²	46	2%	0.022	23%	0.232	C	C	.	.	S	Bend	trans	-90.5	76	179.7	-50.7	-33	0	0	0	110.2	L555 H558 M559 M562 V644 I648 A649 M657 H751	L555-F652 HydrophobicContact CD1-CE2 4.33Å; L555-F652 HydrophobicContact CD1-CZ 3.87Å; H558-F652 HydrophobicContact CB-CE2 4.05Å; M559-F652 HydrophobicContact CE-CE1 4.24Å; M559-F652 HydrophobicContact CG-CE1 3.88Å; M559-F652 HydrophobicContact CG-CZ 3.59Å; M562-F652 HydrophobicContact CE-CD1 3.57Å; M562-F652 HydrophobicContact CE-CD2 4.04Å; M562-F652 HydrophobicContact CE-CE1 3.3Å; M562-F652 HydrophobicContact CE-CE2 3.79Å; M562-F652 HydrophobicContact CE-CG 3.97Å; M562-F652 HydrophobicContact CE-CZ 3.44Å; M562-F652 VanDerWaalsContact CE-CZ 3.44Å; M562-F652 HydrophobicContact SD-CD1 4.37Å; M562-F652 HydrophobicContact SD-CD2 4.12Å; M562-F652 HydrophobicContact SD-CE2 4.28Å; M562-F652 HydrophobicContact SD-CG 4.2Å; M562-F652 HydrophobicContact SD-CZ 4.49Å; V644-F652 HydrophobicContact CB-CB 4.48Å; V644-F652 HydrophobicContact CG1-CB 4.21Å; V644-F652 HydrophobicContact CG1-CD2 3.9Å; V644-F652 HydrophobicContact CG2-CB 3.97Å; V644-F652 HydrophobicContact CG2-CD2 3.87Å; V644-F652 HydrophobicContact CG2-CG 4.42Å; I648-F652 HydrophobicContact CG2-CD2 3.56Å; I648-F652 HydrophobicContact CG2-CE2 3.42Å; I648-F652 VanDerWaalsContact CG2-CE2 3.42Å; I648-F652 HydrophobicContact CG2-CZ 4.36Å; I648-F652 PolarHBondContact O-N 3.4Å; A649-F652 CarbonylContact O-C 3.55Å; F652-M657 HydrophobicContact CB-SD 4.4Å; F652-H751 AromaticContact CD1-CE1 3.87Å
653	T	86.4	Confident	88.2	Confident	26 Å²	26	45.8 Å²	45.8	16%	0.16	23%	0.232	C	C	.	.			trans	-57.7	156.5	178.7	79.3	0	0	0	0	111.4	V651 E655 C656 M657	V651-T653 VanDerWaalsContact C-N 3.35Å; V651-T653 PolarHBondContact O-N 2.88Å; V651-T653 VanDerWaalsContact O-N 3.11Å; T653-E655 PolarHBondContact O-N 2.87Å; T653-E655 VanDerWaalsContact O-N 3.09Å; T653-E655 PolarHBondContact OG1-N 2.92Å; T653-C656 WeakPolarHBondContact O-CB 3.45Å; T653-C656 PolarHBondContact O-N 3.4Å; T653-C656 VanDerWaalsContact O-N 3.12Å; T653-C656 PolarHBondContact OG1-N 3.07Å; T653-C656 VanDerWaalsContact OG1-N 3.15Å; T653-C656 PolarHBondContact OG1-SG 2.79Å; T653-C656 VanDerWaalsContact OG1-SG 3.35Å; T653-M657 PolarHBondContact O-N 3.34Å
654	R	86.6	Confident	88.3	Confident	225 Å²	225	40.4 Å²	40.4	85%	0.849	21%	0.207	S	C	*	.	H	α-helix	trans	-55.6	-27.4	174.3	-178.2	173.6	174.5	171	-1.2	112.9	S658	R654-S658 PolarHBondContact O-N 3.32Å; R654-S658 VanDerWaalsContact O-N 3.12Å
655	E	86.9	Confident	88.6	Confident	124 Å²	124	40.1 Å²	40.1	58%	0.579	21%	0.205	S	C	*	.	H	α-helix	trans	-76.1	-47.2	178.8	-68.6	167.5	-141.9	0	0	109.9	R458 T653 M657 S658 H659	R458-E655 IonicContact NH2-OE1 2.66Å; T653-E655 PolarHBondContact O-N 2.87Å; T653-E655 VanDerWaalsContact O-N 3.09Å; T653-E655 PolarHBondContact OG1-N 2.92Å; E655-M657 VanDerWaalsContact C-N 3.3Å; E655-M657 PolarHBondContact O-N 3.49Å; E655-S658 WeakPolarHBondContact O-CB 3.48Å; E655-S658 PolarHBondContact O-N 3.12Å; E655-S658 PolarHBondContact O-OG 2.96Å; E655-H659 PolarHBondContact O-N 2.85Å
656	C	90	Very high	89.1	Confident	7 Å²	7	37.2 Å²	37.2	5%	0.047	19%	0.188	C	C	.	.	H	α-helix	trans	-55.6	-41.7	170.5	-65.6	0	0	0	0	112.7	T653 H659 Y660 L755	T653-C656 WeakPolarHBondContact O-CB 3.45Å; T653-C656 PolarHBondContact O-N 3.4Å; T653-C656 VanDerWaalsContact O-N 3.12Å; T653-C656 PolarHBondContact OG1-N 3.07Å; T653-C656 VanDerWaalsContact OG1-N 3.15Å; T653-C656 PolarHBondContact OG1-SG 2.79Å; T653-C656 VanDerWaalsContact OG1-SG 3.35Å; C656-H659 WeakPolarHBondContact O-CB 3.48Å; C656-H659 PolarHBondContact O-N 3.5Å; C656-Y660 WeakPolarHBondContact O-CD2 3.47Å; C656-Y660 PolarHBondContact O-N 3.15Å; C656-L755 HydrophobicContact CB-CD1 3.62Å
657	M	90.7	Very high	89.6	Confident	25 Å²	25	35.5 Å²	35.5	12%	0.123	17%	0.168	C	C	.	.	H	α-helix	trans	-66.8	-35	175.9	-70.3	-54.6	-58.3	0	0	112.9	M562 L566 Y642 V644 F652 T653 E655 H659 Y660 L661	M562-M657 HydrophobicContact SD-SD 4.31Å; L566-M657 HydrophobicContact CD1-CE 4.21Å; Y642-M657 WeakPolarHBondContact O-CE 3.25Å; V644-M657 HydrophobicContact CG2-SD 4.13Å; F652-M657 HydrophobicContact CB-SD 4.4Å; T653-M657 PolarHBondContact O-N 3.34Å; E655-M657 VanDerWaalsContact C-N 3.3Å; E655-M657 PolarHBondContact O-N 3.49Å; M657-H659 VanDerWaalsContact C-N 3.28Å; M657-H659 PolarHBondContact O-N 3.42Å; M657-Y660 PolarHBondContact O-N 3.45Å; M657-Y660 HydrophobicContact SD-CD2 4.27Å; M657-L661 WeakPolarHBondContact O-CB 3.14Å; M657-L661 PolarHBondContact O-N 3.01Å
658	S	90.5	Very high	90.1	Very high	57 Å²	57	35.1 Å²	35.1	40%	0.399	17%	0.166	S	C	.	.	H	α-helix	trans	-66.5	-32.2	172.5	83.5	0	0	0	0	112.5	R654 E655 R662	R654-S658 PolarHBondContact O-N 3.32Å; R654-S658 VanDerWaalsContact O-N 3.12Å; E655-S658 WeakPolarHBondContact O-CB 3.48Å; E655-S658 PolarHBondContact O-N 3.12Å; E655-S658 PolarHBondContact O-OG 2.96Å; S658-R662 WeakPolarHBondContact O-CG 3.34Å; S658-R662 PolarHBondContact O-N 2.97Å; S658-R662 VanDerWaalsContact O-N 3.11Å
659	H	92	Very high	90.3	Very high	47 Å²	47	38.4 Å²	38.4	22%	0.218	18%	0.178	C	C	.	.	H	α-helix	trans	-70.2	-47	175.7	-79.5	-162.7	0	0	0	111.3	E655 C656 M657 L661 R662 V663 L755 D756 I759	E655-H659 PolarHBondContact O-N 2.85Å; C656-H659 WeakPolarHBondContact O-CB 3.48Å; C656-H659 PolarHBondContact O-N 3.5Å; M657-H659 VanDerWaalsContact C-N 3.28Å; M657-H659 PolarHBondContact O-N 3.42Å; H659-L661 VanDerWaalsContact C-N 3.33Å; H659-L661 PolarHBondContact O-N 3.23Å; H659-R662 PolarHBondContact O-N 3.02Å; H659-V663 WeakPolarHBondContact O-CG2 3.31Å; H659-V663 PolarHBondContact O-N 3.01Å; H659-V663 VanDerWaalsContact O-N 3.08Å; H659-L755 HydrophobicContact CB-CD1 4.25Å; H659-D756 IonicContact CE1-OD1 3.37Å; H659-D756 IonicContact ND1-OD1 3.65Å; H659-I759 HydrophobicContact CB-CD1 3.76Å; H659-I759 VanDerWaalsContact CG-CD1 3.45Å; H659-I759 VanDerWaalsContact ND1-CD1 3.29Å; H659-I759 WeakPolarHBondContact ND1-CD1 3.41Å
660	Y	93.3	Very high	90.5	Very high	2 Å²	2	37.3 Å²	37.3	1%	0.008	17%	0.169	C	C	.	.	H	α-helix	trans	-57.1	-43.4	170	-82.3	-63.6	0	0	0	112.8	M562 L566 L567 C656 M657 R662 V663 F664 H751 L755	M562-Y660 HydrophobicContact CB-CE1 4.43Å; M562-Y660 HydrophobicContact CE-CE2 3.63Å; M562-Y660 WeakPolarHBondContact CE-OH 3.41Å; M562-Y660 HydrophobicContact SD-CD2 4.01Å; M562-Y660 HydrophobicContact SD-CE2 3.48Å; M562-Y660 WeakPolarHBondContact SD-CE2 3.07Å; L566-Y660 HydrophobicContact CB-CD1 4.32Å; L566-Y660 HydrophobicContact CD1-CD1 4.38Å; L566-Y660 HydrophobicContact CD1-CG 4.12Å; L567-Y660 HydrophobicContact CD1-CE1 4.17Å; L567-Y660 HydrophobicContact CD2-CD1 4.11Å; L567-Y660 HydrophobicContact CD2-CE1 4.12Å; L567-Y660 HydrophobicContact CG-CD1 4.45Å; L567-Y660 HydrophobicContact CG-CE1 4.11Å; C656-Y660 WeakPolarHBondContact O-CD2 3.47Å; C656-Y660 PolarHBondContact O-N 3.15Å; M657-Y660 PolarHBondContact O-N 3.45Å; M657-Y660 HydrophobicContact SD-CD2 4.27Å; Y660-R662 VanDerWaalsContact C-N 3.32Å; Y660-R662 PolarHBondContact O-N 3.4Å; Y660-V663 PolarHBondContact O-N 3.4Å; Y660-F664 WeakPolarHBondContact O-CB 3.31Å; Y660-F664 PolarHBondContact O-N 2.84Å; Y660-H751 AromaticContact CE2-CE1 3.74Å; Y660-H751 AromaticContact CE2-NE2 3.53Å; Y660-H751 AromaticContact CZ-NE2 3.59Å; Y660-H751 PolarHBondContact OH-NE2 3.03Å; Y660-L755 HydrophobicContact CD1-CD2 4.01Å; Y660-L755 HydrophobicContact CD2-CD1 4.43Å; Y660-L755 HydrophobicContact CD2-CD2 4.15Å; Y660-L755 HydrophobicContact CE1-CD2 3.79Å; Y660-L755 HydrophobicContact CE2-CD1 4.19Å; Y660-L755 HydrophobicContact CE2-CD2 3.94Å; Y660-L755 HydrophobicContact CG-CD2 4.18Å
661	L	91.9	Very high	90.8	Very high	29 Å²	29	39.2 Å²	39.2	15%	0.152	18%	0.176	C	C	.	.	H	α-helix	trans	-60.8	-39.6	178.3	-176.5	64	0	0	0	112.2	S639 M657 H659 N665	S639-L661 WeakPolarHBondContact OG-CD1 3.5Å; M657-L661 WeakPolarHBondContact O-CB 3.14Å; M657-L661 PolarHBondContact O-N 3.01Å; H659-L661 VanDerWaalsContact C-N 3.33Å; H659-L661 PolarHBondContact O-N 3.23Å; L661-N665 WeakPolarHBondContact CD1-ND2 3.37Å; L661-N665 WeakPolarHBondContact O-CB 3.43Å; L661-N665 PolarHBondContact O-N 3.41Å; L661-N665 VanDerWaalsContact O-N 3.11Å; L661-N665 PolarHBondContact O-ND2 3.36Å
662	R	91.6	Very high	91	Very high	104 Å²	104	40.3 Å²	40.3	39%	0.392	18%	0.18	S	C	.	.	H	α-helix	trans	-63.6	-43.7	173.9	-75.8	169	62.3	-159.7	-2.4	111.9	S658 H659 Y660 F666 L764	S658-R662 WeakPolarHBondContact O-CG 3.34Å; S658-R662 PolarHBondContact O-N 2.97Å; S658-R662 VanDerWaalsContact O-N 3.11Å; H659-R662 PolarHBondContact O-N 3.02Å; Y660-R662 VanDerWaalsContact C-N 3.32Å; Y660-R662 PolarHBondContact O-N 3.4Å; R662-F666 PolarHBondContact O-N 3.43Å; R662-L764 PolarHBondContact NH2-O 3.18Å
663	V	93.4	Very high	91.2	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-67.2	-48.5	179.1	174.9	0	0	0	0	111	L567 H659 Y660 N665 F666 L667 I758 I759 L764	L567-V663 HydrophobicContact CD2-CG1 3.65Å; H659-V663 WeakPolarHBondContact O-CG2 3.31Å; H659-V663 PolarHBondContact O-N 3.01Å; H659-V663 VanDerWaalsContact O-N 3.08Å; Y660-V663 PolarHBondContact O-N 3.4Å; V663-N665 VanDerWaalsContact C-N 3.32Å; V663-N665 PolarHBondContact O-N 3.5Å; V663-F666 WeakPolarHBondContact O-CB 3.31Å; V663-F666 PolarHBondContact O-N 2.92Å; V663-F666 VanDerWaalsContact O-N 3.07Å; V663-L667 HydrophobicContact CG1-CD1 3.73Å; V663-L667 HydrophobicContact CG1-CG 4.07Å; V663-L667 WeakPolarHBondContact O-CG 3.4Å; V663-L667 PolarHBondContact O-N 3.3Å; V663-I758 HydrophobicContact CG1-CG2 3.85Å; V663-I758 HydrophobicContact CG2-CG2 3.79Å; V663-I759 HydrophobicContact CG2-CG1 4.01Å; V663-L764 HydrophobicContact CG2-CD1 3.99Å
664	F	93.7	Very high	91.5	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-54.2	-47.9	176.1	179	-87.3	0	0	0	111.3	L566 L568 F638 S639 L640 Y660 F666 L667 W668	L566-F664 WeakPolarHBondContact O-CD2 3.29Å; L568-F664 HydrophobicContact CD1-CD2 3.6Å; L568-F664 HydrophobicContact CD1-CE2 3.77Å; L568-F664 HydrophobicContact CG-CE2 4.48Å; F638-F664 HydrophobicContact CE1-CZ 4.5Å; S639-F664 WeakPolarHBondContact OG-CD1 3.34Å; L640-F664 HydrophobicContact CB-CE2 4.02Å; L640-F664 HydrophobicContact CB-CZ 4.03Å; L640-F664 HydrophobicContact CD1-CE2 3.96Å; L640-F664 HydrophobicContact CD1-CZ 4.19Å; L640-F664 HydrophobicContact CG-CE2 4.08Å; L640-F664 HydrophobicContact CG-CZ 3.91Å; Y660-F664 WeakPolarHBondContact O-CB 3.31Å; Y660-F664 PolarHBondContact O-N 2.84Å; F664-F666 PolarHBondContact O-N 3.1Å; F664-F666 VanDerWaalsContact O-N 3.14Å; F664-L667 PolarHBondContact O-N 3.25Å; F664-W668 HydrophobicContact CD1-CB 4.28Å; F664-W668 HydrophobicContact CE1-CB 3.86Å; F664-W668 HydrophobicContact CE1-CD2 4.34Å; F664-W668 HydrophobicContact CE1-CG 4.02Å; F664-W668 HydrophobicContact CZ-CB 4.17Å; F664-W668 HydrophobicContact CZ-CD2 4.15Å; F664-W668 AromaticContact CZ-CE3 3.99Å; F664-W668 HydrophobicContact CZ-CE3 3.99Å; F664-W668 HydrophobicContact CZ-CG 4.25Å; F664-W668 WeakPolarHBondContact O-CB 3.31Å; F664-W668 PolarHBondContact O-N 3.02Å
665	N	91.2	Very high	91.8	Very high	20 Å²	20	31.7 Å²	31.7	11%	0.107	15%	0.147	C	C	.	.	H	α-helix	trans	-63.8	-19.1	-179.1	-88.3	-74.6	0	0	0	114.8	L661 V663 R669	L661-N665 WeakPolarHBondContact CD1-ND2 3.37Å; L661-N665 WeakPolarHBondContact O-CB 3.43Å; L661-N665 PolarHBondContact O-N 3.41Å; L661-N665 VanDerWaalsContact O-N 3.11Å; L661-N665 PolarHBondContact O-ND2 3.36Å; V663-N665 VanDerWaalsContact C-N 3.32Å; V663-N665 PolarHBondContact O-N 3.5Å; N665-R669 WeakPolarHBondContact O-CD 3.43Å; N665-R669 WeakPolarHBondContact O-CG 3.39Å; N665-R669 PolarHBondContact O-NH1 3.31Å; N665-R669 PolarHBondContact OD1-NH1 3.34Å
666	F	91.9	Very high	92	Very high	15 Å²	15	26.6 Å²	26.6	7%	0.066	12%	0.124	C	C	.	.	H	α-helix	trans	-87.4	-49.9	171.2	171.6	-104.4	0	0	0	111.6	R662 V663 F664 W668 R669 A670 I722 C762 L764 L772 L775	R662-F666 PolarHBondContact O-N 3.43Å; V663-F666 WeakPolarHBondContact O-CB 3.31Å; V663-F666 PolarHBondContact O-N 2.92Å; V663-F666 VanDerWaalsContact O-N 3.07Å; F664-F666 PolarHBondContact O-N 3.1Å; F664-F666 VanDerWaalsContact O-N 3.14Å; F666-W668 VanDerWaalsContact C-N 3.31Å; F666-W668 PolarHBondContact O-N 3.09Å; F666-R669 PolarHBondContact O-N 3.42Å; F666-A670 PolarHBondContact O-N 2.81Å; F666-I722 HydrophobicContact CE1-CD1 3.76Å; F666-I722 HydrophobicContact CE1-CG1 4.4Å; F666-I722 HydrophobicContact CZ-CD1 3.96Å; F666-C762 HydrophobicContact CD1-CB 4.18Å; F666-C762 HydrophobicContact CE1-CB 4Å; F666-C762 WeakPolarHBondContact CE1-O 3.16Å; F666-C762 WeakPolarHBondContact CZ-O 3.4Å; F666-L764 HydrophobicContact CB-CD1 4.11Å; F666-L764 HydrophobicContact CB-CD2 3.95Å; F666-L764 HydrophobicContact CB-CG 4.5Å; F666-L764 HydrophobicContact CD1-CD1 4.41Å; F666-L764 HydrophobicContact CD2-CD2 4.29Å; F666-L764 HydrophobicContact CG-CD1 4.35Å; F666-L764 HydrophobicContact CG-CD2 4.15Å; F666-L764 HydrophobicContact CG-CG 4.47Å; F666-L772 HydrophobicContact CD2-CD1 4.42Å; F666-L772 HydrophobicContact CE2-CD1 4.49Å; F666-L775 HydrophobicContact CE2-CD1 4.29Å; F666-L775 HydrophobicContact CE2-CD2 3.84Å; F666-L775 HydrophobicContact CZ-CD1 4.31Å
667	L	92.9	Very high	92.1	Very high	10 Å²	10	26.5 Å²	26.5	5%	0.052	12%	0.123	C	C	.	.	H	α-helix	trans	-58.8	-41.9	178	-64.6	179	0	0	0	111.9	L567 L568 V663 F664 A670 K671 I722 L727	L567-L667 HydrophobicContact CD2-CD1 4.28Å; L568-L667 HydrophobicContact CD1-CB 3.84Å; L568-L667 HydrophobicContact CD1-CD1 4.04Å; L568-L667 HydrophobicContact CD2-CB 4.16Å; V663-L667 HydrophobicContact CG1-CD1 3.73Å; V663-L667 HydrophobicContact CG1-CG 4.07Å; V663-L667 WeakPolarHBondContact O-CG 3.4Å; V663-L667 PolarHBondContact O-N 3.3Å; F664-L667 PolarHBondContact O-N 3.25Å; L667-A670 PolarHBondContact O-N 2.96Å; L667-K671 PolarHBondContact O-N 3.11Å; L667-I722 HydrophobicContact CD2-CG2 3.4Å; L667-L727 HydrophobicContact CD1-CD1 4.06Å; L667-L727 HydrophobicContact CD2-CD1 4.16Å
668	W	92.7	Very high	92.2	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-60.9	-43.9	176	-178.2	-113.2	0	0	0	112.2	I574 M578 L581 L585 W635 F638 F664 F666 K671 R672	I574-W668 HydrophobicContact CG2-CZ3 4.36Å; M578-W668 HydrophobicContact CG-CH2 3.56Å; M578-W668 HydrophobicContact CG-CZ3 3.63Å; M578-W668 HydrophobicContact SD-CZ3 4.21Å; L581-W668 HydrophobicContact CD1-CH2 4.34Å; L585-W668 HydrophobicContact CD1-CZ2 3.86Å; W635-W668 HydrophobicContact CE3-CZ2 4.1Å; W635-W668 AromaticContact CZ3-CZ2 3.97Å; W635-W668 HydrophobicContact CZ3-CZ2 3.97Å; W635-W668 PolarHBondContact O-NE1 3.23Å; F638-W668 HydrophobicContact CD1-CD2 4.47Å; F638-W668 AromaticContact CD1-CE2 3.68Å; F638-W668 HydrophobicContact CD1-CH2 4.16Å; F638-W668 AromaticContact CD1-CZ2 3.51Å; F638-W668 HydrophobicContact CD1-CZ2 3.51Å; F638-W668 AromaticContact CD1-NE1 3.88Å; F638-W668 AromaticContact CE1-CH2 3.8Å; F638-W668 HydrophobicContact CE1-CH2 3.8Å; F638-W668 AromaticContact CE1-CZ2 3.65Å; F638-W668 HydrophobicContact CE1-CZ2 3.65Å; F638-W668 HydrophobicContact CE1-CZ3 4.33Å; F664-W668 HydrophobicContact CD1-CB 4.28Å; F664-W668 HydrophobicContact CE1-CB 3.86Å; F664-W668 HydrophobicContact CE1-CD2 4.34Å; F664-W668 HydrophobicContact CE1-CG 4.02Å; F664-W668 HydrophobicContact CZ-CB 4.17Å; F664-W668 HydrophobicContact CZ-CD2 4.15Å; F664-W668 AromaticContact CZ-CE3 3.99Å; F664-W668 HydrophobicContact CZ-CE3 3.99Å; F664-W668 HydrophobicContact CZ-CG 4.25Å; F664-W668 WeakPolarHBondContact O-CB 3.31Å; F664-W668 PolarHBondContact O-N 3.02Å; F666-W668 VanDerWaalsContact C-N 3.31Å; F666-W668 PolarHBondContact O-N 3.09Å; W668-K671 PolarHBondContact O-N 3.45Å; W668-R672 WeakPolarHBondContact O-CB 3.48Å; W668-R672 PolarHBondContact O-N 3.1Å
669	R	91.3	Very high	92.1	Very high	73 Å²	73	28.5 Å²	28.5	28%	0.275	13%	0.132	S	C	.	.	H	α-helix	trans	-66.1	-41.3	174.8	-75.5	179.4	172.6	81.7	3	112	D636 N665 F666 K671 R672 M673 F779	D636-R669 VanDerWaalsContact CA-NH2 3.34Å; D636-R669 PolarHBondContact O-NH2 3.35Å; D636-R669 IonicContact OD1-CZ 2.76Å; D636-R669 IonicContact OD1-NE 3.38Å; D636-R669 PolarHBondContact OD1-NE 3.04Å; D636-R669 IonicContact OD1-NH2 3.23Å; D636-R669 PolarHBondContact OD1-NH2 2.78Å; D636-R669 VanDerWaalsContact OD1-NH2 3.1Å; N665-R669 WeakPolarHBondContact O-CD 3.43Å; N665-R669 WeakPolarHBondContact O-CG 3.39Å; N665-R669 PolarHBondContact O-NH1 3.31Å; N665-R669 PolarHBondContact OD1-NH1 3.34Å; F666-R669 PolarHBondContact O-N 3.42Å; R669-K671 VanDerWaalsContact C-N 3.32Å; R669-K671 PolarHBondContact O-N 3.2Å; R669-R672 WeakPolarHBondContact O-CB 3.49Å; R669-R672 PolarHBondContact O-N 3.37Å; R669-M673 PolarHBondContact O-N 3.19Å; R669-F779 HydrophobicContact CB-CD2 4.41Å; R669-F779 HydrophobicContact CB-CE2 4.18Å
670	A	91.1	Very high	92	Very high	4 Å²	4	26.9 Å²	26.9	3%	0.033	13%	0.125	C	C	.	.	H	α-helix	trans	-63.1	-37.1	174.9	0	0	0	0	0	112.2	F666 L667 E674 Q719 F779	F666-A670 PolarHBondContact O-N 2.81Å; L667-A670 PolarHBondContact O-N 2.96Å; A670-E674 PolarHBondContact O-N 3.36Å; A670-Q719 PolarHBondContact O-NE2 2.81Å; A670-F779 HydrophobicContact CB-CE2 4.4Å; A670-F779 HydrophobicContact CB-CZ 3.98Å
671	K	92.1	Very high	91.7	Very high	50 Å²	50	34.3 Å²	34.3	22%	0.217	15%	0.153	C	C	.	.	H	α-helix	trans	-75	-32.6	174.1	-74.9	-60.4	-173.8	-166.7	0	113.5	L568 M578 L667 W668 R669 M673 E674 Y675	L568-K671 HydrophobicContact CD2-CB 4.39Å; L568-K671 HydrophobicContact CD2-CG 3.83Å; M578-K671 HydrophobicContact SD-CB 4.39Å; L667-K671 PolarHBondContact O-N 3.11Å; W668-K671 PolarHBondContact O-N 3.45Å; R669-K671 VanDerWaalsContact C-N 3.32Å; R669-K671 PolarHBondContact O-N 3.2Å; K671-M673 VanDerWaalsContact C-N 3.26Å; K671-M673 PolarHBondContact O-N 2.78Å; K671-E674 WeakPolarHBondContact CD-OE2 3.46Å; K671-E674 IonicContact NZ-OE1 3.87Å; K671-E674 PolarHBondContact NZ-OE1 3.31Å; K671-E674 IonicContact NZ-OE2 2.77Å; K671-E674 PolarHBondContact NZ-OE2 3Å; K671-E674 PolarHBondContact O-N 2.99Å; K671-Y675 VanDerWaalsContact O-CB 3.32Å; K671-Y675 WeakPolarHBondContact O-CB 3.33Å; K671-Y675 PolarHBondContact O-N 3.28Å
672	R	92.2	Very high	91.6	Very high	24 Å²	24	39.4 Å²	39.4	9%	0.091	17%	0.174	C	C	.	.	H	α-helix	trans	-54.6	-43.2	168.6	-177.1	-170.4	177.7	175.1	6.3	110.7	T633 W635 D636 W668 R669 Y675 I676	T633-R672 PolarHBondContact OG1-NH2 2.83Å; T633-R672 VanDerWaalsContact OG1-NH2 3.08Å; W635-R672 HydrophobicContact CD2-CG 4.2Å; W635-R672 HydrophobicContact CE3-CB 4.4Å; W635-R672 HydrophobicContact CE3-CG 3.86Å; W635-R672 HydrophobicContact CZ3-CG 4.29Å; D636-R672 IonicContact OD1-NH1 3.21Å; D636-R672 PolarHBondContact OD1-NH1 3.4Å; D636-R672 VanDerWaalsContact OD1-NH1 3.1Å; D636-R672 IonicContact OD2-CZ 3.12Å; D636-R672 IonicContact OD2-NH1 2.77Å; D636-R672 PolarHBondContact OD2-NH1 2.92Å; D636-R672 IonicContact OD2-NH2 2.67Å; W668-R672 WeakPolarHBondContact O-CB 3.48Å; W668-R672 PolarHBondContact O-N 3.1Å; R669-R672 WeakPolarHBondContact O-CB 3.49Å; R669-R672 PolarHBondContact O-N 3.37Å; R672-Y675 PolarHBondContact O-N 3.18Å; R672-I676 HydrophobicContact CG-CD1 3.88Å; R672-I676 WeakPolarHBondContact O-CB 3.32Å; R672-I676 VanDerWaalsContact O-CG1 3.28Å; R672-I676 WeakPolarHBondContact O-CG1 3.4Å; R672-I676 PolarHBondContact O-N 3.05Å
673	M	92.9	Very high	91.3	Very high	4 Å²	4	35.6 Å²	35.6	2%	0.02	17%	0.167	C	C	.	.	H	α-helix	trans	-66.9	-44.6	177.2	-63.5	-53.2	111.1	0	0	113	R669 K671 Y675 I676 L677 I715 F779 I782 I783	R669-M673 PolarHBondContact O-N 3.19Å; K671-M673 VanDerWaalsContact C-N 3.26Å; K671-M673 PolarHBondContact O-N 2.78Å; M673-Y675 VanDerWaalsContact C-N 3.3Å; M673-Y675 PolarHBondContact O-N 2.92Å; M673-I676 HydrophobicContact CE-CD1 4.07Å; M673-I676 PolarHBondContact O-N 3.36Å; M673-L677 WeakPolarHBondContact O-CB 3.47Å; M673-L677 WeakPolarHBondContact O-CG 3.41Å; M673-L677 PolarHBondContact O-N 2.94Å; M673-I715 HydrophobicContact CB-CD1 4.12Å; M673-I715 HydrophobicContact CB-CG1 4.47Å; M673-F779 HydrophobicContact CE-CB 4.43Å; M673-F779 HydrophobicContact CG-CB 3.93Å; M673-F779 HydrophobicContact CG-CD1 3.62Å; M673-F779 HydrophobicContact CG-CD2 3.98Å; M673-F779 HydrophobicContact CG-CE1 4.05Å; M673-F779 HydrophobicContact CG-CE2 4.37Å; M673-F779 HydrophobicContact CG-CG 3.57Å; M673-F779 HydrophobicContact CG-CZ 4.39Å; M673-F779 HydrophobicContact SD-CB 3.83Å; M673-F779 HydrophobicContact SD-CG 4.18Å; M673-I782 HydrophobicContact CB-CD1 4.29Å; M673-I782 HydrophobicContact CG-CD1 4.34Å; M673-I782 HydrophobicContact SD-CB 3.98Å; M673-I782 HydrophobicContact SD-CD1 4.32Å; M673-I782 HydrophobicContact SD-CG2 3.85Å; M673-I783 HydrophobicContact CE-CD1 3.96Å; M673-I783 HydrophobicContact CE-CG1 4.04Å; M673-I783 HydrophobicContact SD-CG1 4.33Å
674	E	91.9	Very high	91	Very high	51 Å²	51	35.9 Å²	35.9	24%	0.238	17%	0.169	C	C	.	.	H	α-helix	trans	-59.4	-41.1	174.8	-175.4	-178.6	132.4	0	0	111.8	A670 K671 T678 I715 Q719	A670-E674 PolarHBondContact O-N 3.36Å; K671-E674 WeakPolarHBondContact CD-OE2 3.46Å; K671-E674 IonicContact NZ-OE1 3.87Å; K671-E674 PolarHBondContact NZ-OE1 3.31Å; K671-E674 IonicContact NZ-OE2 2.77Å; K671-E674 PolarHBondContact NZ-OE2 3Å; K671-E674 PolarHBondContact O-N 2.99Å; E674-T678 WeakPolarHBondContact O-CB 3.28Å; E674-T678 PolarHBondContact O-N 2.86Å; E674-T678 PolarHBondContact O-OG1 2.99Å; E674-I715 HydrophobicContact CB-CG2 4.11Å; E674-Q719 WeakPolarHBondContact OE2-CG 3.4Å; E674-Q719 PolarHBondContact OE2-NE2 2.87Å; E674-Q719 PolarHBondContact OE2-OE1 2.79Å
675	Y	92.7	Very high	90.6	Very high	20 Å²	20	40.8 Å²	40.8	8%	0.078	19%	0.192	C	C	.	.	H	α-helix	trans	-66.9	-46.9	177	-175.6	-86.6	0	0	0	112.4	M578 D579 K582 K671 R672 M673 T678 D679	M578-Y675 HydrophobicContact CB-CD2 4.2Å; M578-Y675 HydrophobicContact CB-CE2 4.18Å; M578-Y675 HydrophobicContact CE-CD2 4.1Å; M578-Y675 HydrophobicContact CE-CG 3.83Å; M578-Y675 HydrophobicContact SD-CD2 4.38Å; D579-Y675 VanDerWaalsContact OD1-CE2 3.25Å; D579-Y675 WeakPolarHBondContact OD1-CE2 3.34Å; D579-Y675 PolarHBondContact OD1-OH 2.83Å; K582-Y675 HydrophobicContact CD-CE1 3.92Å; K671-Y675 VanDerWaalsContact O-CB 3.32Å; K671-Y675 WeakPolarHBondContact O-CB 3.33Å; K671-Y675 PolarHBondContact O-N 3.28Å; R672-Y675 PolarHBondContact O-N 3.18Å; M673-Y675 VanDerWaalsContact C-N 3.3Å; M673-Y675 PolarHBondContact O-N 2.92Å; Y675-T678 WeakPolarHBondContact O-CB 3.4Å; Y675-T678 PolarHBondContact O-N 2.84Å; Y675-D679 PolarHBondContact O-N 2.93Å
676	I	91.7	Very high	90.4	Very high	17 Å²	17	43 Å²	43	9%	0.087	21%	0.209	C	C	.	.	H	α-helix	trans	-59.9	-49	176.1	-74.9	168	0	0	0	110.7	R672 M673 T678 D679 I680 I782 Q786	R672-I676 HydrophobicContact CG-CD1 3.88Å; R672-I676 WeakPolarHBondContact O-CB 3.32Å; R672-I676 VanDerWaalsContact O-CG1 3.28Å; R672-I676 WeakPolarHBondContact O-CG1 3.4Å; R672-I676 PolarHBondContact O-N 3.05Å; M673-I676 HydrophobicContact CE-CD1 4.07Å; M673-I676 PolarHBondContact O-N 3.36Å; I676-T678 PolarHBondContact O-N 3.42Å; I676-D679 PolarHBondContact O-N 3.16Å; I676-D679 VanDerWaalsContact O-N 3.12Å; I676-I680 HydrophobicContact CG2-CD1 3.71Å; I676-I680 HydrophobicContact CG2-CG1 4.41Å; I676-I680 WeakPolarHBondContact O-CG1 3.36Å; I676-I680 PolarHBondContact O-N 2.85Å; I676-I782 HydrophobicContact CG2-CG2 4.17Å; I676-Q786 HydrophobicContact CG2-CB 4.29Å; I676-Q786 HydrophobicContact CG2-CG 4.29Å; I676-Q786 VanDerWaalsContact CG2-OE1 3.24Å
677	L	92.5	Very high	90	Very high	5 Å²	5	43.4 Å²	43.4	3%	0.026	21%	0.212	C	C	.	.	H	α-helix	trans	-63.5	-30.4	177.8	-72	171.3	0	0	0	112.7	M673 I680 R681 M711 V712 I715 I782	M673-L677 WeakPolarHBondContact O-CB 3.47Å; M673-L677 WeakPolarHBondContact O-CG 3.41Å; M673-L677 PolarHBondContact O-N 2.94Å; L677-I680 HydrophobicContact CD2-CD1 4.28Å; L677-R681 VanDerWaalsContact O-CB 3.27Å; L677-R681 WeakPolarHBondContact O-CB 3.47Å; L677-R681 PolarHBondContact O-N 3.14Å; L677-M711 HydrophobicContact CD1-CB 4.25Å; L677-M711 HydrophobicContact CD2-CB 3.98Å; L677-V712 HydrophobicContact CB-CG2 3.86Å; L677-V712 HydrophobicContact CD1-CG2 4.24Å; L677-V712 HydrophobicContact CD2-CG2 4.34Å; L677-V712 HydrophobicContact CG-CG2 4.38Å; L677-I715 HydrophobicContact CD1-CB 4Å; L677-I715 HydrophobicContact CD1-CG1 3.67Å; L677-I715 HydrophobicContact CD1-CG2 4.42Å; L677-I782 HydrophobicContact CD1-CD1 4.11Å; L677-I782 HydrophobicContact CD1-CG2 4.44Å; L677-I782 HydrophobicContact CD2-CG2 3.94Å; L677-I782 HydrophobicContact CG-CG2 3.94Å
678	T	91.9	Very high	89.6	Confident	70 Å²	70	44.5 Å²	44.5	43%	0.429	22%	0.222	S	C	.	.	H	α-helix	trans	-68	-41.5	172.8	-62.2	0	0	0	0	111.9	E674 Y675 I676 R681 K682	E674-T678 WeakPolarHBondContact O-CB 3.28Å; E674-T678 PolarHBondContact O-N 2.86Å; E674-T678 PolarHBondContact O-OG1 2.99Å; Y675-T678 WeakPolarHBondContact O-CB 3.4Å; Y675-T678 PolarHBondContact O-N 2.84Å; I676-T678 PolarHBondContact O-N 3.42Å; T678-R681 PolarHBondContact O-N 3.19Å; T678-K682 PolarHBondContact O-N 3.27Å
679	D	90.2	Very high	89.3	Confident	53 Å²	53	52.3 Å²	52.3	28%	0.283	26%	0.256	S	S	.	.	H	α-helix	trans	-71.6	-39.7	178	-153.2	37.2	0	0	0	111.7	K582 Y675 I676 R681 K682 G683	K582-D679 IonicContact NZ-OD1 3.79Å; K582-D679 IonicContact NZ-OD2 2.73Å; K582-D679 PolarHBondContact NZ-OD2 3.46Å; Y675-D679 PolarHBondContact O-N 2.93Å; I676-D679 PolarHBondContact O-N 3.16Å; I676-D679 VanDerWaalsContact O-N 3.12Å; D679-R681 VanDerWaalsContact C-N 3.34Å; D679-R681 PolarHBondContact O-N 3.42Å; D679-K682 WeakPolarHBondContact O-CB 3.16Å; D679-K682 PolarHBondContact O-N 3.05Å; D679-G683 PolarHBondContact O-N 2.96Å
680	I	89.6	Confident	88.9	Confident	14 Å²	14	53.5 Å²	53.5	7%	0.072	27%	0.268	C	S	.	.	H	α-helix	trans	-54.4	-49.7	167.5	-73.2	166.8	0	0	0	110.4	I676 L677 K682 G683 H684 A708 Q786	I676-I680 HydrophobicContact CG2-CD1 3.71Å; I676-I680 HydrophobicContact CG2-CG1 4.41Å; I676-I680 WeakPolarHBondContact O-CG1 3.36Å; I676-I680 PolarHBondContact O-N 2.85Å; L677-I680 HydrophobicContact CD2-CD1 4.28Å; I680-K682 VanDerWaalsContact C-N 3.29Å; I680-K682 PolarHBondContact O-N 3.38Å; I680-G683 PolarHBondContact O-N 3.24Å; I680-H684 WeakPolarHBondContact O-CB 3.49Å; I680-H684 PolarHBondContact O-CD2 3.18Å; I680-H684 VanDerWaalsContact O-CG 3.27Å; I680-H684 PolarHBondContact O-N 3.31Å; I680-A708 HydrophobicContact CG2-CB 4.23Å; I680-Q786 HydrophobicContact CD1-CB 3.97Å; I680-Q786 HydrophobicContact CD1-CG 4.13Å; I680-Q786 HydrophobicContact CG1-CG 4.25Å
681	R	87.5	Confident	88.6	Confident	158 Å²	158	53.4 Å²	53.4	60%	0.596	27%	0.266	S	S	*	.	H	α-helix	trans	-63.7	-33.3	179.5	-172.9	176.9	-179.5	-170.2	0.7	112.5	L677 T678 D679 H684 M685	L677-R681 VanDerWaalsContact O-CB 3.27Å; L677-R681 WeakPolarHBondContact O-CB 3.47Å; L677-R681 PolarHBondContact O-N 3.14Å; T678-R681 PolarHBondContact O-N 3.19Å; D679-R681 VanDerWaalsContact C-N 3.34Å; D679-R681 PolarHBondContact O-N 3.42Å; R681-H684 WeakPolarHBondContact O-CB 3.37Å; R681-M685 WeakPolarHBondContact O-CG 3.41Å; R681-M685 PolarHBondContact O-N 3.3Å
682	K	89	Confident	88.1	Confident	135 Å²	135	61 Å²	61	59%	0.587	29%	0.294	S	S	*	.	H	α-helix	trans	-67.6	-50	172.4	177.8	-173	170.3	-164.8	0	111	T678 D679 I680 H684 M685 C686	T678-K682 PolarHBondContact O-N 3.27Å; D679-K682 WeakPolarHBondContact O-CB 3.16Å; D679-K682 PolarHBondContact O-N 3.05Å; I680-K682 VanDerWaalsContact C-N 3.29Å; I680-K682 PolarHBondContact O-N 3.38Å; K682-H684 VanDerWaalsContact C-N 3.33Å; K682-H684 PolarHBondContact O-N 3.08Å; K682-M685 PolarHBondContact O-N 3.42Å; K682-M685 VanDerWaalsContact O-N 3.09Å; K682-C686 PolarHBondContact O-N 3.48Å; K682-C686 VanDerWaalsContact O-N 3.07Å
683	G	86.1	Confident	87.4	Confident	24 Å²	24	65.2 Å²	65.2	25%	0.247	32%	0.318	C	S	.	.	H	α-helix	trans	-55.7	-45.9	174.9	0	0	0	0	0	112.3	D679 I680 M685 C686 N687	D679-G683 PolarHBondContact O-N 2.96Å; I680-G683 PolarHBondContact O-N 3.24Å; G683-M685 VanDerWaalsContact C-N 3.33Å; G683-M685 PolarHBondContact O-N 3.17Å; G683-C686 PolarHBondContact O-N 2.6Å; G683-C686 VanDerWaalsContact O-N 3.16Å; G683-N687 VanDerWaalsContact O-CB 3.31Å; G683-N687 WeakPolarHBondContact O-CB 3.42Å; G683-N687 PolarHBondContact O-N 2.87Å
684	H	85.9	Confident	86.8	Confident	7 Å²	7	65.2 Å²	65.2	3%	0.032	32%	0.318	C	S	.	.	H	α-helix	trans	-50.8	-46.7	171.8	-81.4	-168.6	0	0	0	113	I680 R681 K682 A688 C704 H705 Q789 Y793	I680-H684 WeakPolarHBondContact O-CB 3.49Å; I680-H684 PolarHBondContact O-CD2 3.18Å; I680-H684 VanDerWaalsContact O-CG 3.27Å; I680-H684 PolarHBondContact O-N 3.31Å; R681-H684 WeakPolarHBondContact O-CB 3.37Å; K682-H684 VanDerWaalsContact C-N 3.33Å; K682-H684 PolarHBondContact O-N 3.08Å; H684-A688 WeakPolarHBondContact O-CB 3.45Å; H684-A688 PolarHBondContact O-N 2.85Å; H684-A688 VanDerWaalsContact O-N 3.12Å; H684-C704 PolarHBondContact CE1-O 3.19Å; H684-C704 PolarHBondContact NE2-SG 3.46Å; H684-H705 AromaticContact CE1-ND1 3.95Å; H684-H705 AromaticContact CG-CE1 3.82Å; H684-H705 AromaticContact CG-ND1 3.49Å; H684-H705 AromaticContact ND1-ND1 3.25Å; H684-H705 PolarHBondContact ND1-ND1 3.08Å; H684-Q789 PolarHBondContact NE2-NE2 3.43Å; H684-Y793 AromaticContact CD2-CE2 3.69Å; H684-Y793 AromaticContact CD2-CZ 3.73Å; H684-Y793 PolarHBondContact CD2-OH 3.05Å; H684-Y793 AromaticContact NE2-CE2 3.93Å; H684-Y793 PolarHBondContact NE2-OH 3.41Å
685	M	85.8	Confident	86.3	Confident	102 Å²	102	67.6 Å²	67.6	50%	0.502	34%	0.338	S	S	.	.	H	α-helix	trans	-76.4	-22	-178.8	-66.1	-65.1	97.5	0	0	114.1	R681 K682 G683 K689	R681-M685 WeakPolarHBondContact O-CG 3.41Å; R681-M685 PolarHBondContact O-N 3.3Å; K682-M685 PolarHBondContact O-N 3.42Å; K682-M685 VanDerWaalsContact O-N 3.09Å; G683-M685 VanDerWaalsContact C-N 3.33Å; G683-M685 PolarHBondContact O-N 3.17Å; M685-K689 WeakPolarHBondContact O-CD 3.45Å; M685-K689 WeakPolarHBondContact O-CG 3.4Å
686	C	86.5	Confident	85.8	Confident	66 Å²	66	70.1 Å²	70.1	45%	0.446	35%	0.35	S	S	.	.	H	α-helix	trans	-79.9	-54.4	170.9	-70.7	0	0	0	0	111	K682 G683 A688 K689 L690	K682-C686 PolarHBondContact O-N 3.48Å; K682-C686 VanDerWaalsContact O-N 3.07Å; G683-C686 PolarHBondContact O-N 2.6Å; G683-C686 VanDerWaalsContact O-N 3.16Å; C686-A688 PolarHBondContact O-N 3.24Å; C686-K689 WeakPolarHBondContact O-CB 3.2Å; C686-K689 PolarHBondContact O-N 3.48Å; C686-L690 PolarHBondContact O-N 3.46Å
687	N	84.7	Confident	85.5	Confident	24 Å²	24	69.3 Å²	69.3	13%	0.128	35%	0.346	C	S	.	.	H	α-helix	trans	-65.6	-36.9	-173.1	-64.3	-6.4	0	0	0	111.7	G683 K689 L690 L691 Y793	G683-N687 VanDerWaalsContact O-CB 3.31Å; G683-N687 WeakPolarHBondContact O-CB 3.42Å; G683-N687 PolarHBondContact O-N 2.87Å; N687-K689 PolarHBondContact O-N 2.96Å; N687-L690 PolarHBondContact O-N 2.9Å; N687-L691 HydrophobicContact CB-CD1 4.08Å; N687-L691 VanDerWaalsContact O-CB 3.3Å; N687-L691 WeakPolarHBondContact O-CB 3.31Å; N687-L691 WeakPolarHBondContact O-CG 3.27Å; N687-L691 PolarHBondContact O-N 3.45Å; N687-Y793 HydrophobicContact CB-CD1 3.87Å; N687-Y793 HydrophobicContact CB-CE1 3.79Å; N687-Y793 VanDerWaalsContact ND2-CD1 3.28Å; N687-Y793 WeakPolarHBondContact ND2-CD1 3.08Å
688	A	83.9	Confident	85.1	Confident	33 Å²	33	72.4 Å²	72.4	27%	0.273	37%	0.368	S	S	.	.	H	α-helix	trans	-64.1	-21.5	174.9	0	0	0	0	0	114	H684 C686 L701	H684-A688 WeakPolarHBondContact O-CB 3.45Å; H684-A688 PolarHBondContact O-N 2.85Å; H684-A688 VanDerWaalsContact O-N 3.12Å; C686-A688 PolarHBondContact O-N 3.24Å; A688-L701 HydrophobicContact CB-CD1 4.5Å
689	K	85.1	Confident	84.7	Confident	164 Å²	164	71 Å²	71	71%	0.713	37%	0.367	S	S	*	.	H	α-helix	trans	-81.6	-41.8	173.1	-67	174.5	-177.4	177.4	0	111.8	M685 C686 N687 R692	M685-K689 WeakPolarHBondContact O-CD 3.45Å; M685-K689 WeakPolarHBondContact O-CG 3.4Å; C686-K689 WeakPolarHBondContact O-CB 3.2Å; C686-K689 PolarHBondContact O-N 3.48Å; N687-K689 PolarHBondContact O-N 2.96Å; K689-R692 WeakPolarHBondContact O-CB 3.31Å
690	L	84.1	Confident	84.5	Confident	99 Å²	99	68.5 Å²	68.5	52%	0.518	35%	0.354	S	S	.	.	H	α-helix	trans	-69.1	-47	179.8	-63.2	172.9	0	0	0	111.6	C686 N687 R692 L797 L800	C686-L690 PolarHBondContact O-N 3.46Å; N687-L690 PolarHBondContact O-N 2.9Å; L690-R692 PolarHBondContact O-N 2.91Å; L690-R692 VanDerWaalsContact O-N 3.15Å; L690-L797 HydrophobicContact CB-CD2 4.44Å; L690-L797 HydrophobicContact CD1-CD2 4.22Å; L690-L800 HydrophobicContact CB-CD2 4.09Å; L690-L800 WeakPolarHBondContact O-CD2 3.49Å
691	L	83.5	Confident	84.3	Confident	1 Å²	1	68.5 Å²	68.5	1%	0.005	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-77.5	5.5	-176.2	-64	163.2	0	0	0	113.5	N687 N693 M694 F697 L701 Y793 A796 L797 L800	N687-L691 HydrophobicContact CB-CD1 4.08Å; N687-L691 VanDerWaalsContact O-CB 3.3Å; N687-L691 WeakPolarHBondContact O-CB 3.31Å; N687-L691 WeakPolarHBondContact O-CG 3.27Å; N687-L691 PolarHBondContact O-N 3.45Å; L691-N693 PolarHBondContact O-N 2.97Å; L691-N693 VanDerWaalsContact O-N 3.12Å; L691-M694 HydrophobicContact CD2-CE 3.84Å; L691-M694 PolarHBondContact O-N 3.46Å; L691-F697 HydrophobicContact CB-CD1 4.46Å; L691-F697 HydrophobicContact CD1-CD1 3.9Å; L691-F697 HydrophobicContact CD1-CE1 3.71Å; L691-L701 HydrophobicContact CB-CD1 4.45Å; L691-L701 HydrophobicContact CD1-CD2 4.39Å; L691-Y793 HydrophobicContact CD1-CD1 4.11Å; L691-Y793 HydrophobicContact CD1-CE1 4.28Å; L691-A796 HydrophobicContact CD1-CB 4.28Å; L691-A796 HydrophobicContact CD2-CB 3.95Å; L691-A796 WeakPolarHBondContact CD2-O 3.47Å; L691-L797 HydrophobicContact CD2-CD2 4.22Å; L691-L797 HydrophobicContact CG-CD2 4.29Å; L691-L800 HydrophobicContact CD2-CB 4.15Å; L691-L800 HydrophobicContact CD2-CD2 4.08Å
692	R	81.7	Confident	84.3	Confident	210 Å²	210	66.9 Å²	66.9	79%	0.792	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-56.8	-28.1	179.1	-175.3	178	179.2	-167.1	-1.2	113	K689 L690 M694	K689-R692 WeakPolarHBondContact O-CB 3.31Å; L690-R692 PolarHBondContact O-N 2.91Å; L690-R692 VanDerWaalsContact O-N 3.15Å; R692-M694 PolarHBondContact O-N 3.08Å
693	N	77.7	Confident	84.2	Confident	112 Å²	112	63.1 Å²	63.1	60%	0.599	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-73.7	-9.7	178.6	-64.5	7.6	0	0	0	113.2	L691 P695 L800	L691-N693 PolarHBondContact O-N 2.97Å; L691-N693 VanDerWaalsContact O-N 3.12Å; N693-P695 WeakPolarHBondContact O-CD 3.38Å; N693-L800 HydrophobicContact CB-CD1 4.3Å
694	M	80.7	Confident	84.2	Confident	5 Å²	5	62 Å²	62	3%	0.025	33%	0.326	C	S	.	.			trans	-114.1	83.3	177.9	-61.8	-152.3	-63.8	0	0	111	L691 R692 E696 F697 A796 E799 L800 R803 F836	L691-M694 HydrophobicContact CD2-CE 3.84Å; L691-M694 PolarHBondContact O-N 3.46Å; R692-M694 PolarHBondContact O-N 3.08Å; M694-E696 PolarHBondContact O-N 3.19Å; M694-E696 VanDerWaalsContact O-N 3.15Å; M694-F697 HydrophobicContact CB-CB 4.39Å; M694-F697 PolarHBondContact O-N 3.48Å; M694-A796 WeakPolarHBondContact CE-O 3.33Å; M694-E799 HydrophobicContact CE-CG 4.37Å; M694-E799 HydrophobicContact SD-CG 4.18Å; M694-L800 HydrophobicContact CE-CB 4.25Å; M694-L800 HydrophobicContact CG-CD1 4.3Å; M694-R803 VanDerWaalsContact SD-CZ 3.52Å; M694-R803 PolarHBondContact SD-NH1 3.37Å; M694-F836 HydrophobicContact CE-CE1 3.99Å; M694-F836 HydrophobicContact CE-CZ 3.98Å; M694-F836 HydrophobicContact SD-CE1 4.29Å
695	P	80.7	Confident	84.3	Confident	100 Å²	100	63.8 Å²	63.8	65%	0.649	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-60.7	-28.4	-176.5	25	-34.7	0	0	0	112.9	N693 F697 S698	N693-P695 WeakPolarHBondContact O-CD 3.38Å; P695-F697 PolarHBondContact O-N 3.14Å; P695-S698 WeakPolarHBondContact O-CB 3.14Å; P695-S698 PolarHBondContact O-N 3.48Å; P695-S698 VanDerWaalsContact O-N 3.09Å
696	E	83.6	Confident	84.4	Confident	73 Å²	73	62.6 Å²	62.6	34%	0.341	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-56.1	-34.1	175.7	-64.6	154.4	-176.9	0	0	112.6	M694 R803 K837 I840	M694-E696 PolarHBondContact O-N 3.19Å; M694-E696 VanDerWaalsContact O-N 3.15Å; E696-R803 IonicContact OE2-NH1 2.8Å; E696-K837 WeakPolarHBondContact OE1-CE 3.36Å; E696-K837 IonicContact OE1-NZ 2.67Å; E696-K837 PolarHBondContact OE1-NZ 3.33Å; E696-K837 WeakPolarHBondContact OE2-CE 3.38Å; E696-K837 IonicContact OE2-NZ 2.7Å; E696-I840 HydrophobicContact CB-CD1 4.07Å
697	F	84.1	Confident	84.6	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-84.3	-10.8	-178.8	-164.8	-110.1	0	0	0	113.3	L691 M694 P695 G699 V700 L701 I792 Y793 A796 F836 M843	L691-F697 HydrophobicContact CB-CD1 4.46Å; L691-F697 HydrophobicContact CD1-CD1 3.9Å; L691-F697 HydrophobicContact CD1-CE1 3.71Å; M694-F697 HydrophobicContact CB-CB 4.39Å; M694-F697 PolarHBondContact O-N 3.48Å; P695-F697 PolarHBondContact O-N 3.14Å; F697-G699 VanDerWaalsContact C-N 3.26Å; F697-G699 PolarHBondContact O-N 3.31Å; F697-V700 HydrophobicContact CD2-CB 3.97Å; F697-V700 HydrophobicContact CD2-CG1 4.49Å; F697-V700 HydrophobicContact CD2-CG2 3.84Å; F697-V700 HydrophobicContact CE2-CB 3.8Å; F697-V700 HydrophobicContact CE2-CG1 3.82Å; F697-V700 HydrophobicContact CE2-CG2 3.94Å; F697-V700 HydrophobicContact CG-CB 4.44Å; F697-V700 HydrophobicContact CZ-CB 4.13Å; F697-V700 HydrophobicContact CZ-CG1 3.97Å; F697-V700 WeakPolarHBondContact O-CB 3.34Å; F697-V700 PolarHBondContact O-N 3.38Å; F697-L701 HydrophobicContact CD1-CD1 4.03Å; F697-L701 HydrophobicContact CD1-CD2 3.99Å; F697-L701 HydrophobicContact CD1-CG 3.64Å; F697-L701 HydrophobicContact CE1-CD2 3.65Å; F697-L701 HydrophobicContact CE1-CG 3.79Å; F697-L701 PolarHBondContact O-N 2.94Å; F697-L701 VanDerWaalsContact O-N 3.09Å; F697-I792 HydrophobicContact CE2-CG2 4.33Å; F697-I792 HydrophobicContact CZ-CG2 3.74Å; F697-Y793 HydrophobicContact CE1-CE1 4.32Å; F697-A796 HydrophobicContact CD1-CB 4.33Å; F697-A796 HydrophobicContact CD2-CB 4.32Å; F697-A796 HydrophobicContact CE1-CB 3.86Å; F697-A796 HydrophobicContact CE2-CB 3.85Å; F697-A796 HydrophobicContact CZ-CB 3.6Å; F697-F836 HydrophobicContact CD2-CZ 4.15Å; F697-M843 HydrophobicContact CE2-CE 3.87Å; F697-M843 HydrophobicContact CE2-SD 4.42Å; F697-M843 HydrophobicContact CZ-CE 4.5Å
698	S	84.1	Confident	84.8	Confident	71 Å²	71	58.6 Å²	58.6	50%	0.497	31%	0.307	S	S	.	.	H	α-helix	trans	-56.9	-36.8	-177.9	-171.7	0	0	0	0	113.1	P695 V700 L701 H702	P695-S698 WeakPolarHBondContact O-CB 3.14Å; P695-S698 PolarHBondContact O-N 3.48Å; P695-S698 VanDerWaalsContact O-N 3.09Å; S698-V700 VanDerWaalsContact C-N 3.34Å; S698-V700 PolarHBondContact O-N 3.31Å; S698-L701 PolarHBondContact O-N 3.39Å; S698-H702 WeakPolarHBondContact O-CB 3.48Å; S698-H702 PolarHBondContact O-N 3.01Å
699	G	84.3	Confident	85	Confident	39 Å²	39	60.6 Å²	60.6	40%	0.402	32%	0.32	S	S	.	.	H	α-helix	trans	-66.9	-31.3	176.5	0	0	0	0	0	114	F697 Q703	F697-G699 VanDerWaalsContact C-N 3.26Å; F697-G699 PolarHBondContact O-N 3.31Å; G699-Q703 PolarHBondContact O-N 2.89Å; G699-Q703 PolarHBondContact O-NE2 2.81Å
700	V	85.9	Confident	85.2	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.006	29%	0.292	C	S	.	.	H	α-helix	trans	-72.3	-48.2	174.8	-171	0	0	0	0	109.4	F697 S698 H702 Q703 C704 I792 I840 L847	F697-V700 HydrophobicContact CD2-CB 3.97Å; F697-V700 HydrophobicContact CD2-CG1 4.49Å; F697-V700 HydrophobicContact CD2-CG2 3.84Å; F697-V700 HydrophobicContact CE2-CB 3.8Å; F697-V700 HydrophobicContact CE2-CG1 3.82Å; F697-V700 HydrophobicContact CE2-CG2 3.94Å; F697-V700 HydrophobicContact CG-CB 4.44Å; F697-V700 HydrophobicContact CZ-CB 4.13Å; F697-V700 HydrophobicContact CZ-CG1 3.97Å; F697-V700 WeakPolarHBondContact O-CB 3.34Å; F697-V700 PolarHBondContact O-N 3.38Å; S698-V700 VanDerWaalsContact C-N 3.34Å; S698-V700 PolarHBondContact O-N 3.31Å; V700-H702 VanDerWaalsContact C-N 3.31Å; V700-H702 PolarHBondContact O-N 3.47Å; V700-Q703 PolarHBondContact O-N 2.79Å; V700-C704 VanDerWaalsContact O-CB 3.24Å; V700-C704 WeakPolarHBondContact O-CB 3.38Å; V700-C704 PolarHBondContact O-N 3.22Å; V700-I792 HydrophobicContact CG1-CG2 4.2Å; V700-I840 HydrophobicContact CG2-CG2 3.79Å; V700-L847 HydrophobicContact CG1-CD1 3.74Å
701	L	85.6	Confident	85.6	Confident	15 Å²	15	49.4 Å²	49.4	8%	0.079	27%	0.267	C	S	.	.	H	α-helix	trans	-53.8	-47.1	175.2	-69.7	174.8	0	0	0	111.7	A688 L691 F697 S698 C704 H705 Y793	A688-L701 HydrophobicContact CB-CD1 4.5Å; L691-L701 HydrophobicContact CB-CD1 4.45Å; L691-L701 HydrophobicContact CD1-CD2 4.39Å; F697-L701 HydrophobicContact CD1-CD1 4.03Å; F697-L701 HydrophobicContact CD1-CD2 3.99Å; F697-L701 HydrophobicContact CD1-CG 3.64Å; F697-L701 HydrophobicContact CE1-CD2 3.65Å; F697-L701 HydrophobicContact CE1-CG 3.79Å; F697-L701 PolarHBondContact O-N 2.94Å; F697-L701 VanDerWaalsContact O-N 3.09Å; S698-L701 PolarHBondContact O-N 3.39Å; L701-C704 WeakPolarHBondContact O-CB 3.36Å; L701-C704 PolarHBondContact O-N 2.8Å; L701-H705 WeakPolarHBondContact O-CB 3.38Å; L701-H705 PolarHBondContact O-CD2 3.48Å; L701-H705 PolarHBondContact O-N 2.95Å; L701-Y793 HydrophobicContact CD2-CE1 3.63Å
702	H	87.4	Confident	85.9	Confident	123 Å²	123	50.5 Å²	50.5	57%	0.569	27%	0.274	S	S	*	.	H	α-helix	trans	-62.8	-48.3	-178.9	-175.3	66.7	0	0	0	112.7	S698 V700 C704 H705 V706	S698-H702 WeakPolarHBondContact O-CB 3.48Å; S698-H702 PolarHBondContact O-N 3.01Å; V700-H702 VanDerWaalsContact C-N 3.31Å; V700-H702 PolarHBondContact O-N 3.47Å; H702-C704 VanDerWaalsContact C-N 3.28Å; H702-C704 PolarHBondContact O-N 3.27Å; H702-H705 PolarHBondContact O-N 2.77Å; H702-V706 WeakPolarHBondContact O-CG2 3.21Å; H702-V706 PolarHBondContact O-N 2.87Å
703	Q	86.3	Confident	86.3	Confident	56 Å²	56	44 Å²	44	26%	0.262	25%	0.252	S	S	.	.	H	α-helix	trans	-57.9	-42.6	175.1	-76	166.8	81.5	0	0	111.3	G699 V700 V706 L707	G699-Q703 PolarHBondContact O-N 2.89Å; G699-Q703 PolarHBondContact O-NE2 2.81Å; V700-Q703 PolarHBondContact O-N 2.79Å; Q703-V706 PolarHBondContact O-N 2.66Å; Q703-L707 PolarHBondContact O-N 2.81Å; Q703-L707 VanDerWaalsContact O-N 3.09Å
704	C	87.5	Confident	87	Confident	1 Å²	1	38.9 Å²	38.9	1%	0.007	23%	0.225	C	C	.	.	H	α-helix	trans	-64	-43.1	178.3	-164.1	0	0	0	0	113	H684 V700 L701 H702 A708 Q789 L847	H684-C704 PolarHBondContact CE1-O 3.19Å; H684-C704 PolarHBondContact NE2-SG 3.46Å; V700-C704 VanDerWaalsContact O-CB 3.24Å; V700-C704 WeakPolarHBondContact O-CB 3.38Å; V700-C704 PolarHBondContact O-N 3.22Å; L701-C704 WeakPolarHBondContact O-CB 3.36Å; L701-C704 PolarHBondContact O-N 2.8Å; H702-C704 VanDerWaalsContact C-N 3.28Å; H702-C704 PolarHBondContact O-N 3.27Å; C704-A708 WeakPolarHBondContact O-CB 3.34Å; C704-A708 PolarHBondContact O-N 2.98Å; C704-A708 VanDerWaalsContact O-N 3.15Å; C704-Q789 VanDerWaalsContact SG-CG 3.56Å; C704-Q789 PolarHBondContact SG-NE2 3.17Å; C704-L847 HydrophobicContact CB-CD1 4.27Å
705	H	87.2	Confident	87.6	Confident	45 Å²	45	38.9 Å²	38.9	21%	0.208	22%	0.224	C	C	.	.	H	α-helix	trans	-64.8	-38.8	175	-66.8	-41.9	0	0	0	112.4	H684 L701 H702 S709	H684-H705 AromaticContact CE1-ND1 3.95Å; H684-H705 AromaticContact CG-CE1 3.82Å; H684-H705 AromaticContact CG-ND1 3.49Å; H684-H705 AromaticContact ND1-ND1 3.25Å; H684-H705 PolarHBondContact ND1-ND1 3.08Å; L701-H705 WeakPolarHBondContact O-CB 3.38Å; L701-H705 PolarHBondContact O-CD2 3.48Å; L701-H705 PolarHBondContact O-N 2.95Å; H702-H705 PolarHBondContact O-N 2.77Å; H705-S709 WeakPolarHBondContact O-CB 3.36Å; H705-S709 PolarHBondContact O-N 2.91Å; H705-S709 PolarHBondContact O-OG 2.93Å
706	V	88.8	Confident	88	Confident	76 Å²	76	37.4 Å²	37.4	46%	0.461	21%	0.209	S	C	.	.	H	α-helix	trans	-65.1	-52.6	178.6	170.5	0	0	0	0	110.8	H702 Q703 A708 S709 E710	H702-V706 WeakPolarHBondContact O-CG2 3.21Å; H702-V706 PolarHBondContact O-N 2.87Å; Q703-V706 PolarHBondContact O-N 2.66Å; V706-A708 PolarHBondContact O-N 2.95Å; V706-S709 WeakPolarHBondContact O-CB 3.39Å; V706-S709 PolarHBondContact O-N 3.02Å; V706-E710 PolarHBondContact O-N 2.9Å
707	L	88.9	Confident	88.3	Confident	1 Å²	1	35.4 Å²	35.4	1%	0.005	20%	0.2	C	C	.	.	H	α-helix	trans	-60.3	-44.8	-179.4	179.8	58.7	0	0	0	112.1	Q703 S709 E710 M711 L785 L850 T851 Y854	Q703-L707 PolarHBondContact O-N 2.81Å; Q703-L707 VanDerWaalsContact O-N 3.09Å; L707-S709 VanDerWaalsContact C-N 3.27Å; L707-S709 PolarHBondContact O-N 3.29Å; L707-E710 WeakPolarHBondContact O-CB 3.49Å; L707-E710 PolarHBondContact O-N 3.07Å; L707-M711 HydrophobicContact CD1-CE 4.19Å; L707-M711 HydrophobicContact CG-CE 4.35Å; L707-M711 PolarHBondContact O-N 3.36Å; L707-M711 VanDerWaalsContact O-N 3.08Å; L707-L785 HydrophobicContact CD2-CD1 3.7Å; L707-L785 HydrophobicContact CD2-CD2 4.11Å; L707-L785 HydrophobicContact CG-CD1 4.46Å; L707-L785 HydrophobicContact CG-CD2 4.01Å; L707-L850 HydrophobicContact CD2-CB 4.1Å; L707-T851 HydrophobicContact CD1-CG2 4.33Å; L707-Y854 HydrophobicContact CD1-CD1 4.08Å; L707-Y854 HydrophobicContact CD1-CG 4.42Å
708	A	89.6	Confident	88.6	Confident	5 Å²	5	35.8 Å²	35.8	4%	0.041	20%	0.201	C	C	.	.	H	α-helix	trans	-64.2	-31	175.6	0	0	0	0	0	112.7	I680 C704 V706 V712	I680-A708 HydrophobicContact CG2-CB 4.23Å; C704-A708 WeakPolarHBondContact O-CB 3.34Å; C704-A708 PolarHBondContact O-N 2.98Å; C704-A708 VanDerWaalsContact O-N 3.15Å; V706-A708 PolarHBondContact O-N 2.95Å; A708-V712 VanDerWaalsContact O-CB 3.31Å; A708-V712 WeakPolarHBondContact O-CB 3.46Å; A708-V712 WeakPolarHBondContact O-CG2 3.31Å; A708-V712 PolarHBondContact O-N 3.28Å
709	S	89	Confident	88.9	Confident	76 Å²	76	33.1 Å²	33.1	53%	0.531	18%	0.181	S	C	.	.	H	α-helix	trans	-71.5	-34.8	175	-59.1	0	0	0	0	112.3	H705 V706 L707 H713	H705-S709 WeakPolarHBondContact O-CB 3.36Å; H705-S709 PolarHBondContact O-N 2.91Å; H705-S709 PolarHBondContact O-OG 2.93Å; V706-S709 WeakPolarHBondContact O-CB 3.39Å; V706-S709 PolarHBondContact O-N 3.02Å; L707-S709 VanDerWaalsContact C-N 3.27Å; L707-S709 PolarHBondContact O-N 3.29Å; S709-H713 WeakPolarHBondContact O-CB 3.38Å; S709-H713 PolarHBondContact O-N 3.16Å
710	E	89	Confident	89.1	Confident	28 Å²	28	36.6 Å²	36.6	13%	0.131	18%	0.183	C	C	.	.	H	α-helix	trans	-65	-44.8	174.6	-153.5	177.8	175.5	0	0	110.8	V706 L707 H713 F714 Y854 Q855 H885 Y886	V706-E710 PolarHBondContact O-N 2.9Å; L707-E710 WeakPolarHBondContact O-CB 3.49Å; L707-E710 PolarHBondContact O-N 3.07Å; E710-H713 PolarHBondContact O-N 3.41Å; E710-F714 PolarHBondContact O-N 3.05Å; E710-F714 VanDerWaalsContact O-N 3.15Å; E710-Y854 HydrophobicContact CB-CE1 4.14Å; E710-Y854 HydrophobicContact CG-CE1 3.82Å; E710-Y854 PolarHBondContact O-OH 3.27Å; E710-Q855 PolarHBondContact OE1-NE2 3.09Å; E710-H885 IonicContact OE1-CE1 2.69Å; E710-H885 PolarHBondContact OE1-CE1 2.69Å; E710-H885 IonicContact OE1-ND1 3.65Å; E710-Y886 PolarHBondContact OE1-OH 3.08Å
711	M	91.5	Very high	89.4	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-65.7	-43.1	174	-69.6	-177.9	175.2	0	0	113.2	L677 L707 H713 F714 I715 Q781 I782 L785 Y854	L677-M711 HydrophobicContact CD1-CB 4.25Å; L677-M711 HydrophobicContact CD2-CB 3.98Å; L707-M711 HydrophobicContact CD1-CE 4.19Å; L707-M711 HydrophobicContact CG-CE 4.35Å; L707-M711 PolarHBondContact O-N 3.36Å; L707-M711 VanDerWaalsContact O-N 3.08Å; M711-H713 VanDerWaalsContact C-N 3.31Å; M711-H713 PolarHBondContact O-N 3.32Å; M711-F714 PolarHBondContact O-N 3.4Å; M711-I715 PolarHBondContact O-N 3.17Å; M711-Q781 HydrophobicContact CE-CG 3.94Å; M711-I782 HydrophobicContact CB-CG1 4.38Å; M711-I782 HydrophobicContact CE-CG1 4.46Å; M711-I782 HydrophobicContact CG-CG1 4.24Å; M711-I782 HydrophobicContact SD-CB 4.41Å; M711-I782 HydrophobicContact SD-CG1 3.62Å; M711-L785 HydrophobicContact CE-CB 4.2Å; M711-L785 HydrophobicContact CE-CD2 3.9Å; M711-L785 HydrophobicContact SD-CB 4.27Å; M711-L785 HydrophobicContact SD-CD2 3.35Å; M711-L785 WeakPolarHBondContact SD-CD2 3.46Å; M711-L785 HydrophobicContact SD-CG 4.43Å; M711-Y854 WeakPolarHBondContact CA-OH 3.49Å; M711-Y854 HydrophobicContact CE-CD2 3.58Å; M711-Y854 HydrophobicContact CE-CE2 4.21Å; M711-Y854 HydrophobicContact CE-CG 3.79Å; M711-Y854 HydrophobicContact CG-CD2 3.94Å; M711-Y854 HydrophobicContact CG-CE1 4.26Å; M711-Y854 HydrophobicContact CG-CE2 3.57Å; M711-Y854 HydrophobicContact CG-CG 4.41Å
712	V	91.2	Very high	89.6	Confident	23 Å²	23	36.1 Å²	36.1	14%	0.139	18%	0.18	C	C	.	.	H	α-helix	trans	-60.3	-41	175.1	163.8	0	0	0	0	111.3	L677 A708 H716	L677-V712 HydrophobicContact CB-CG2 3.86Å; L677-V712 HydrophobicContact CD1-CG2 4.24Å; L677-V712 HydrophobicContact CD2-CG2 4.34Å; L677-V712 HydrophobicContact CG-CG2 4.38Å; A708-V712 VanDerWaalsContact O-CB 3.31Å; A708-V712 WeakPolarHBondContact O-CB 3.46Å; A708-V712 WeakPolarHBondContact O-CG2 3.31Å; A708-V712 PolarHBondContact O-N 3.28Å; V712-H716 VanDerWaalsContact CG1-CE1 3.42Å; V712-H716 WeakPolarHBondContact CG1-CE1 3.45Å; V712-H716 VanDerWaalsContact O-CB 3.3Å; V712-H716 WeakPolarHBondContact O-CB 3.24Å; V712-H716 PolarHBondContact O-N 3.37Å
713	H	89.8	Confident	89.7	Confident	75 Å²	75	32.4 Å²	32.4	35%	0.347	17%	0.166	S	C	.	.	H	α-helix	trans	-62.4	-48.1	176.1	-178.3	84.2	0	0	0	111.7	S709 E710 M711 H716 Q717	S709-H713 WeakPolarHBondContact O-CB 3.38Å; S709-H713 PolarHBondContact O-N 3.16Å; E710-H713 PolarHBondContact O-N 3.41Å; M711-H713 VanDerWaalsContact C-N 3.31Å; M711-H713 PolarHBondContact O-N 3.32Å; H713-H716 PolarHBondContact O-N 2.97Å; H713-Q717 WeakPolarHBondContact O-CG 3.36Å; H713-Q717 PolarHBondContact O-N 3.29Å
714	F	91.7	Very high	89.7	Confident	4 Å²	4	35.5 Å²	35.5	2%	0.018	18%	0.179	C	C	.	.	H	α-helix	trans	-58.7	-53.4	178.4	180	-87.6	0	0	0	111.9	E710 M711 H716 Q717 M718 V778 Y854 V858 F861 L880	E710-F714 PolarHBondContact O-N 3.05Å; E710-F714 VanDerWaalsContact O-N 3.15Å; M711-F714 PolarHBondContact O-N 3.4Å; F714-H716 VanDerWaalsContact C-N 3.33Å; F714-H716 PolarHBondContact O-N 3.13Å; F714-Q717 PolarHBondContact O-N 3.06Å; F714-M718 HydrophobicContact CD1-CG 4.09Å; F714-M718 HydrophobicContact CE1-CG 3.7Å; F714-M718 HydrophobicContact CZ-CG 3.94Å; F714-M718 HydrophobicContact CZ-SD 4.29Å; F714-M718 WeakPolarHBondContact O-CG 3.39Å; F714-M718 PolarHBondContact O-N 3.4Å; F714-V778 HydrophobicContact CD1-CG1 3.88Å; F714-V778 HydrophobicContact CE1-CB 4.27Å; F714-V778 HydrophobicContact CE1-CG1 3.7Å; F714-V778 HydrophobicContact CE1-CG2 4.25Å; F714-V778 HydrophobicContact CZ-CG1 4.45Å; F714-V778 HydrophobicContact CZ-CG2 4.22Å; F714-Y854 VanDerWaalsContact CB-OH 3.25Å; F714-Y854 WeakPolarHBondContact CB-OH 3.23Å; F714-V858 HydrophobicContact CD2-CG1 4.25Å; F714-V858 HydrophobicContact CD2-CG2 4.12Å; F714-V858 HydrophobicContact CE2-CG1 4.34Å; F714-V858 HydrophobicContact CE2-CG2 4.2Å; F714-F861 AromaticContact CE2-CD1 3.73Å; F714-F861 HydrophobicContact CE2-CD1 3.73Å; F714-F861 AromaticContact CE2-CE1 3.79Å; F714-F861 HydrophobicContact CE2-CE1 3.79Å; F714-F861 AromaticContact CZ-CD1 3.84Å; F714-F861 HydrophobicContact CZ-CD1 3.84Å; F714-F861 AromaticContact CZ-CE1 3.66Å; F714-F861 HydrophobicContact CZ-CE1 3.66Å; F714-F861 HydrophobicContact CZ-CG 4.46Å; F714-F861 HydrophobicContact CZ-CZ 4.17Å; F714-L880 HydrophobicContact CD2-CD2 3.73Å; F714-L880 HydrophobicContact CE2-CD1 4.33Å; F714-L880 HydrophobicContact CE2-CD2 4.08Å; F714-L880 HydrophobicContact CG-CD2 4.36Å
715	I	92.5	Very high	89.7	Confident	4 Å²	4	38 Å²	38	2%	0.021	19%	0.19	C	C	.	.	H	α-helix	trans	-62.4	-39.7	-179.2	-67.6	-63.4	0	0	0	111.3	M673 E674 L677 M711 M718 Q719 F779 I782	M673-I715 HydrophobicContact CB-CD1 4.12Å; M673-I715 HydrophobicContact CB-CG1 4.47Å; E674-I715 HydrophobicContact CB-CG2 4.11Å; L677-I715 HydrophobicContact CD1-CB 4Å; L677-I715 HydrophobicContact CD1-CG1 3.67Å; L677-I715 HydrophobicContact CD1-CG2 4.42Å; M711-I715 PolarHBondContact O-N 3.17Å; I715-M718 PolarHBondContact O-N 2.99Å; I715-Q719 HydrophobicContact CG2-CG 4.2Å; I715-Q719 WeakPolarHBondContact O-CB 3.42Å; I715-Q719 WeakPolarHBondContact O-CG 3.42Å; I715-Q719 PolarHBondContact O-N 3.42Å; I715-F779 HydrophobicContact CD1-CD1 4.09Å; I715-F779 HydrophobicContact CD1-CE1 3.67Å; I715-I782 HydrophobicContact CD1-CD1 3.76Å; I715-I782 HydrophobicContact CG1-CD1 3.68Å
716	H	90.3	Very high	89.9	Confident	69 Å²	69	36 Å²	36	32%	0.319	18%	0.182	S	C	.	.	H	α-helix	trans	-62.1	-45.9	174.5	-72.9	172.5	0	0	0	112.7	V712 H713 F714 M718 Q719 Y720	V712-H716 VanDerWaalsContact CG1-CE1 3.42Å; V712-H716 WeakPolarHBondContact CG1-CE1 3.45Å; V712-H716 VanDerWaalsContact O-CB 3.3Å; V712-H716 WeakPolarHBondContact O-CB 3.24Å; V712-H716 PolarHBondContact O-N 3.37Å; H713-H716 PolarHBondContact O-N 2.97Å; F714-H716 VanDerWaalsContact C-N 3.33Å; F714-H716 PolarHBondContact O-N 3.13Å; H716-M718 PolarHBondContact O-N 3.4Å; H716-Q719 PolarHBondContact O-N 3.48Å; H716-Y720 HydrophobicContact CB-CD2 4.45Å; H716-Y720 HydrophobicContact CB-CE2 4.21Å; H716-Y720 WeakPolarHBondContact O-CD2 3.21Å; H716-Y720 PolarHBondContact O-N 3.07Å
717	Q	90	Very high	90	Very high	32 Å²	32	33.2 Å²	33.2	15%	0.15	16%	0.164	C	C	.	.	H	α-helix	trans	-65.1	-38.6	178.2	-64.7	-52.6	-33.1	0	0	112.3	H713 F714 Y720 Y721 L880	H713-Q717 WeakPolarHBondContact O-CG 3.36Å; H713-Q717 PolarHBondContact O-N 3.29Å; F714-Q717 PolarHBondContact O-N 3.06Å; Q717-Y720 PolarHBondContact O-N 3.4Å; Q717-Y721 PolarHBondContact O-N 2.96Å; Q717-L880 HydrophobicContact CB-CD2 3.7Å; Q717-L880 HydrophobicContact CB-CG 4.43Å; Q717-L880 HydrophobicContact CG-CD2 4.43Å
718	M	89.9	Confident	90.1	Very high	7 Å²	7	36.2 Å²	36.2	3%	0.034	18%	0.178	C	C	.	.	H	α-helix	trans	-62.2	-43.2	173.2	-69.9	-56	-49.6	0	0	112.2	F714 I715 H716 Y721 I722 L775 F861 L876 L880	F714-M718 HydrophobicContact CD1-CG 4.09Å; F714-M718 HydrophobicContact CE1-CG 3.7Å; F714-M718 HydrophobicContact CZ-CG 3.94Å; F714-M718 HydrophobicContact CZ-SD 4.29Å; F714-M718 WeakPolarHBondContact O-CG 3.39Å; F714-M718 PolarHBondContact O-N 3.4Å; I715-M718 PolarHBondContact O-N 2.99Å; H716-M718 PolarHBondContact O-N 3.4Å; M718-Y721 PolarHBondContact O-N 3.04Å; M718-I722 WeakPolarHBondContact O-CD1 3.35Å; M718-I722 VanDerWaalsContact O-CG1 3.29Å; M718-I722 WeakPolarHBondContact O-CG1 3.37Å; M718-I722 PolarHBondContact O-N 3.16Å; M718-L775 HydrophobicContact CE-CD1 3.89Å; M718-F861 HydrophobicContact CE-CZ 4.09Å; M718-F861 HydrophobicContact SD-CE1 3.89Å; M718-F861 HydrophobicContact SD-CZ 3.85Å; M718-L876 HydrophobicContact CE-CD2 3.97Å; M718-L876 HydrophobicContact SD-CD1 3.97Å; M718-L876 HydrophobicContact SD-CD2 3.86Å; M718-L876 HydrophobicContact SD-CG 4.35Å; M718-L880 HydrophobicContact SD-CD1 4.11Å; M718-L880 HydrophobicContact SD-CD2 4.49Å
719	Q	90.2	Very high	90.2	Very high	15 Å²	15	39.6 Å²	39.6	7%	0.07	20%	0.201	C	C	.	.	H	α-helix	trans	-64.6	-40.3	175.9	-74.6	-79.7	-11	0	0	112.2	A670 E674 I715 H716 T723	A670-Q719 PolarHBondContact O-NE2 2.81Å; E674-Q719 WeakPolarHBondContact OE2-CG 3.4Å; E674-Q719 PolarHBondContact OE2-NE2 2.87Å; E674-Q719 PolarHBondContact OE2-OE1 2.79Å; I715-Q719 HydrophobicContact CG2-CG 4.2Å; I715-Q719 WeakPolarHBondContact O-CB 3.42Å; I715-Q719 WeakPolarHBondContact O-CG 3.42Å; I715-Q719 PolarHBondContact O-N 3.42Å; H716-Q719 PolarHBondContact O-N 3.48Å; Q719-T723 VanDerWaalsContact O-CB 3.31Å; Q719-T723 WeakPolarHBondContact O-CB 3.24Å; Q719-T723 PolarHBondContact O-N 3.38Å; Q719-T723 PolarHBondContact O-OG1 3.02Å
720	Y	89.6	Confident	90.3	Very high	112 Å²	112	36.4 Å²	36.4	44%	0.439	18%	0.179	S	C	.	.	H	α-helix	trans	-63	-41.3	174.2	-76.4	-57.4	0	0	0	112.1	H716 Q717 F724 R879	H716-Y720 HydrophobicContact CB-CD2 4.45Å; H716-Y720 HydrophobicContact CB-CE2 4.21Å; H716-Y720 WeakPolarHBondContact O-CD2 3.21Å; H716-Y720 PolarHBondContact O-N 3.07Å; Q717-Y720 PolarHBondContact O-N 3.4Å; Y720-F724 AromaticContact CD1-CD2 3.87Å; Y720-F724 HydrophobicContact CD1-CD2 3.87Å; Y720-F724 AromaticContact CD1-CE2 3.75Å; Y720-F724 HydrophobicContact CD1-CE2 3.75Å; Y720-F724 HydrophobicContact CE1-CE2 4.16Å; Y720-F724 WeakPolarHBondContact O-CB 3.37Å; Y720-F724 PolarHBondContact O-N 3.35Å; Y720-R879 VanDerWaalsContact CB-NH2 3.35Å
721	Y	90.9	Very high	90.6	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.008	17%	0.174	C	C	.	.	I	π-helix	trans	-60.2	-56.2	174.7	175.5	-107.4	0	0	0	111.5	Q717 M718 T723 E725 V726 S872 L873 L876	Q717-Y721 PolarHBondContact O-N 2.96Å; M718-Y721 PolarHBondContact O-N 3.04Å; Y721-T723 PolarHBondContact O-N 3.47Å; Y721-E725 HydrophobicContact CD2-CB 3.81Å; Y721-E725 HydrophobicContact CD2-CG 4.28Å; Y721-E725 WeakPolarHBondContact CD2-OE2 2.98Å; Y721-E725 HydrophobicContact CE2-CB 3.98Å; Y721-E725 WeakPolarHBondContact O-CA 3.28Å; Y721-E725 WeakPolarHBondContact O-CB 3.21Å; Y721-E725 PolarHBondContact O-N 3.49Å; Y721-V726 HydrophobicContact CD1-CG2 4.26Å; Y721-V726 HydrophobicContact CE1-CG2 3.69Å; Y721-V726 HydrophobicContact CE2-CG2 4.15Å; Y721-V726 PolarHBondContact O-N 3.35Å; Y721-V726 VanDerWaalsContact O-N 3.16Å; Y721-S872 PolarHBondContact OH-OG 3.44Å; Y721-S872 VanDerWaalsContact OH-OG 3.11Å; Y721-L873 HydrophobicContact CE1-CD2 3.81Å; Y721-L873 WeakPolarHBondContact OH-CD2 3.35Å; Y721-L876 HydrophobicContact CD1-CD2 3.84Å; Y721-L876 HydrophobicContact CD2-CB 4.24Å; Y721-L876 HydrophobicContact CD2-CD2 4.4Å; Y721-L876 HydrophobicContact CE1-CD2 4.23Å; Y721-L876 HydrophobicContact CG-CD1 4.21Å; Y721-L876 HydrophobicContact CG-CD2 3.95Å; Y721-L876 HydrophobicContact CG-CG 4.45Å
722	I	90.6	Very high	90.7	Very high	4 Å²	4	39.5 Å²	39.5	2%	0.021	20%	0.195	C	C	.	.	I	π-helix	trans	-62.1	-44	-175.9	-63.9	160.8	0	0	0	111.1	F666 L667 M718 V726 L727	F666-I722 HydrophobicContact CE1-CD1 3.76Å; F666-I722 HydrophobicContact CE1-CG1 4.4Å; F666-I722 HydrophobicContact CZ-CD1 3.96Å; L667-I722 HydrophobicContact CD2-CG2 3.4Å; M718-I722 WeakPolarHBondContact O-CD1 3.35Å; M718-I722 VanDerWaalsContact O-CG1 3.29Å; M718-I722 WeakPolarHBondContact O-CG1 3.37Å; M718-I722 PolarHBondContact O-N 3.16Å; I722-V726 WeakPolarHBondContact O-CB 3.48Å; I722-L727 HydrophobicContact CG2-CD1 4.2Å; I722-L727 VanDerWaalsContact O-CG 3.3Å; I722-L727 WeakPolarHBondContact O-CG 3.37Å; I722-L727 PolarHBondContact O-N 3.46Å
723	T	88.5	Confident	90.9	Very high	46 Å²	46	43.1 Å²	43.1	28%	0.282	21%	0.211	S	C	.	.	I	π-helix	trans	-74.3	-50	-176.7	-50.4	0	0	0	0	112.2	Q719 Y721 E728	Q719-T723 VanDerWaalsContact O-CB 3.31Å; Q719-T723 WeakPolarHBondContact O-CB 3.24Å; Q719-T723 PolarHBondContact O-N 3.38Å; Q719-T723 PolarHBondContact O-OG1 3.02Å; Y721-T723 PolarHBondContact O-N 3.47Å; T723-E728 PolarHBondContact O-N 2.99Å
724	F	86.7	Confident	91.1	Very high	120 Å²	120	39.8 Å²	39.8	53%	0.526	20%	0.195	S	C	.	.	I	π-helix	trans	-97.2	-37.5	-168.5	-65.8	-91.5	0	0	0	114.2	Y720 C729	Y720-F724 AromaticContact CD1-CD2 3.87Å; Y720-F724 HydrophobicContact CD1-CD2 3.87Å; Y720-F724 AromaticContact CD1-CE2 3.75Å; Y720-F724 HydrophobicContact CD1-CE2 3.75Å; Y720-F724 HydrophobicContact CE1-CE2 4.16Å; Y720-F724 WeakPolarHBondContact O-CB 3.37Å; Y720-F724 PolarHBondContact O-N 3.35Å; F724-C729 PolarHBondContact O-SG 3.31Å
725	E	87.8	Confident	91.3	Very high	53 Å²	53	42.6 Å²	42.6	25%	0.248	21%	0.206	C	C	.	.	I	π-helix	trans	-87.3	-23.3	-179	-62.9	-177.7	-149.1	0	0	112.4	Y721 R879	Y721-E725 HydrophobicContact CD2-CB 3.81Å; Y721-E725 HydrophobicContact CD2-CG 4.28Å; Y721-E725 WeakPolarHBondContact CD2-OE2 2.98Å; Y721-E725 HydrophobicContact CE2-CB 3.98Å; Y721-E725 WeakPolarHBondContact O-CA 3.28Å; Y721-E725 WeakPolarHBondContact O-CB 3.21Å; Y721-E725 PolarHBondContact O-N 3.49Å; E725-R879 WeakPolarHBondContact OE1-CD 3.17Å; E725-R879 IonicContact OE1-CZ 2.94Å; E725-R879 IonicContact OE1-NE 2.76Å; E725-R879 IonicContact OE1-NH1 2.81Å; E725-R879 PolarHBondContact OE1-NH1 2.91Å
726	V	91	Very high	91.3	Very high	4 Å²	4	46.3 Å²	46.3	2%	0.024	23%	0.226	C	C	.	.	I	π-helix	trans	-105.9	-67.3	178.8	-177.5	0	0	0	0	112.2	Y721 I722 S730 R761	Y721-V726 HydrophobicContact CD1-CG2 4.26Å; Y721-V726 HydrophobicContact CE1-CG2 3.69Å; Y721-V726 HydrophobicContact CE2-CG2 4.15Å; Y721-V726 PolarHBondContact O-N 3.35Å; Y721-V726 VanDerWaalsContact O-N 3.16Å; I722-V726 WeakPolarHBondContact O-CB 3.48Å; V726-S730 WeakPolarHBondContact O-CB 3.32Å; V726-S730 PolarHBondContact O-N 3.26Å; V726-S730 VanDerWaalsContact O-N 3.1Å; V726-S730 PolarHBondContact O-OG 2.82Å; V726-R761 HydrophobicContact CB-CB 4.18Å; V726-R761 HydrophobicContact CG1-CB 3.42Å; V726-R761 VanDerWaalsContact CG1-CB 3.42Å; V726-R761 HydrophobicContact CG1-CG 4.37Å; V726-R761 HydrophobicContact CG2-CB 3.71Å
727	L	91.1	Very high	91.5	Very high	18 Å²	18	46.9 Å²	46.9	9%	0.094	23%	0.227	C	C	.	.	I	π-helix	trans	-69	-43.1	-169.5	-67.6	173.1	0	0	0	113.2	L567 L667 I722 S730 W731 I758	L567-L727 HydrophobicContact CD1-CD2 4.3Å; L567-L727 HydrophobicContact CD2-CD2 4.18Å; L667-L727 HydrophobicContact CD1-CD1 4.06Å; L667-L727 HydrophobicContact CD2-CD1 4.16Å; I722-L727 HydrophobicContact CG2-CD1 4.2Å; I722-L727 VanDerWaalsContact O-CG 3.3Å; I722-L727 WeakPolarHBondContact O-CG 3.37Å; I722-L727 PolarHBondContact O-N 3.46Å; L727-S730 PolarHBondContact O-OG 3.27Å; L727-W731 VanDerWaalsContact O-CB 3.27Å; L727-W731 WeakPolarHBondContact O-CB 3.36Å; L727-W731 PolarHBondContact O-N 2.97Å; L727-I758 HydrophobicContact CD2-CD1 3.71Å; L727-I758 HydrophobicContact CD2-CG1 4.09Å; L727-I758 HydrophobicContact CD2-CG2 3.99Å
728	E	91.1	Very high	91.6	Very high	63 Å²	63	45.7 Å²	45.7	29%	0.294	22%	0.222	S	C	.	.	I	π-helix	trans	-67.8	-49.3	-179.6	-154.7	66.8	-156.3	0	0	111.9	R563 T723 S730 W731 D732	R563-E728 IonicContact CZ-OE1 3.32Å; R563-E728 IonicContact CZ-OE2 3.68Å; R563-E728 IonicContact NH1-OE1 3.22Å; R563-E728 IonicContact NH2-OE1 2.79Å; R563-E728 PolarHBondContact NH2-OE1 2.98Å; R563-E728 IonicContact NH2-OE2 3.69Å; R563-E728 PolarHBondContact NH2-OE2 3.08Å; T723-E728 PolarHBondContact O-N 2.99Å; E728-S730 PolarHBondContact O-N 3.43Å; E728-W731 PolarHBondContact O-N 3.45Å; E728-D732 PolarHBondContact O-N 3.38Å
729	C	91.1	Very high	91.5	Very high	77 Å²	77	51.4 Å²	51.4	52%	0.52	25%	0.249	S	C	.	.	H	α-helix	trans	-63.3	-42.4	-179.1	-64.4	0	0	0	0	113	F724 E733	F724-C729 PolarHBondContact O-SG 3.31Å; C729-E733 PolarHBondContact O-N 3.17Å; C729-E733 VanDerWaalsContact O-N 3.14Å
730	S	92.7	Very high	91.5	Very high	9 Å²	9	57.6 Å²	57.6	6%	0.063	28%	0.278	C	S	.	.	H	α-helix	trans	-68.4	-36.1	176.2	58	0	0	0	0	112.1	V726 L727 E728 E733 L734 F754 I758	V726-S730 WeakPolarHBondContact O-CB 3.32Å; V726-S730 PolarHBondContact O-N 3.26Å; V726-S730 VanDerWaalsContact O-N 3.1Å; V726-S730 PolarHBondContact O-OG 2.82Å; L727-S730 PolarHBondContact O-OG 3.27Å; E728-S730 PolarHBondContact O-N 3.43Å; S730-E733 PolarHBondContact O-N 2.88Å; S730-L734 PolarHBondContact O-N 2.91Å; S730-F754 WeakPolarHBondContact O-CD2 3.46Å; S730-I758 WeakPolarHBondContact OG-CG1 3.37Å
731	W	94.6	Very high	91.5	Very high	10 Å²	10	53.2 Å²	53.2	4%	0.038	27%	0.265	C	S	.	.	H	α-helix	trans	-64.8	-46.2	174.5	176.9	-86.1	0	0	0	112.2	M559 Q560 R563 L727 E728 E733 L734 W735 F754	M559-W731 HydrophobicContact CB-CH2 4.27Å; M559-W731 WeakPolarHBondContact O-CH2 3.47Å; Q560-W731 HydrophobicContact CG-CZ2 4.4Å; R563-W731 HydrophobicContact CB-CD2 4.45Å; R563-W731 HydrophobicContact CB-CE3 3.89Å; R563-W731 HydrophobicContact CB-CH2 4.06Å; R563-W731 HydrophobicContact CB-CZ3 3.68Å; R563-W731 HydrophobicContact CG-CD2 4.41Å; R563-W731 HydrophobicContact CG-CE3 4.22Å; R563-W731 HydrophobicContact CG-CZ3 4.48Å; R563-W731 VanDerWaalsContact NH1-NE1 3.18Å; L727-W731 VanDerWaalsContact O-CB 3.27Å; L727-W731 WeakPolarHBondContact O-CB 3.36Å; L727-W731 PolarHBondContact O-N 2.97Å; E728-W731 PolarHBondContact O-N 3.45Å; W731-E733 PolarHBondContact O-N 3.04Å; W731-L734 HydrophobicContact CE3-CD2 4.17Å; W731-L734 HydrophobicContact CZ3-CD2 4.13Å; W731-L734 PolarHBondContact O-N 3.36Å; W731-W735 AromaticContact CE2-CE3 3.99Å; W731-W735 HydrophobicContact CH2-CE3 4.01Å; W731-W735 HydrophobicContact CH2-CZ3 4.24Å; W731-W735 HydrophobicContact CZ2-CD2 4.07Å; W731-W735 AromaticContact CZ2-CE3 3.33Å; W731-W735 HydrophobicContact CZ2-CE3 3.33Å; W731-W735 AromaticContact CZ2-CZ3 3.75Å; W731-W735 HydrophobicContact CZ2-CZ3 3.75Å; W731-W735 AromaticContact NE1-CG 3.99Å; W731-W735 VanDerWaalsContact O-CB 3.31Å; W731-W735 WeakPolarHBondContact O-CB 3.36Å; W731-W735 PolarHBondContact O-N 3.22Å; W731-F754 HydrophobicContact CB-CE2 4.32Å; W731-F754 HydrophobicContact CE3-CE2 4.3Å; W731-F754 HydrophobicContact CE3-CZ 4.04Å
732	D	93.8	Very high	91.3	Very high	82 Å²	82	58.4 Å²	58.4	44%	0.439	29%	0.289	S	S	.	.	H	α-helix	trans	-62	-36.6	178.8	-82.4	-7.5	0	0	0	110.9	E728 N736	E728-D732 PolarHBondContact O-N 3.38Å; D732-N736 WeakPolarHBondContact O-CB 3.44Å; D732-N736 PolarHBondContact O-N 2.98Å; D732-N736 VanDerWaalsContact O-N 3.09Å; D732-N736 PolarHBondContact O-ND2 3.33Å
733	E	94.4	Very high	91.1	Very high	100 Å²	100	58.3 Å²	58.3	47%	0.467	29%	0.288	S	S	.	.	H	α-helix	trans	-64.1	-47.6	172.5	-167.4	-178.6	157.8	0	0	112.3	C729 S730 W731 K737	C729-E733 PolarHBondContact O-N 3.17Å; C729-E733 VanDerWaalsContact O-N 3.14Å; S730-E733 PolarHBondContact O-N 2.88Å; W731-E733 PolarHBondContact O-N 3.04Å; E733-K737 HydrophobicContact CG-CD 4.23Å; E733-K737 WeakPolarHBondContact O-CB 3.36Å; E733-K737 VanDerWaalsContact O-CG 3.31Å; E733-K737 WeakPolarHBondContact O-CG 3.45Å; E733-K737 PolarHBondContact O-N 3.09Å; E733-K737 VanDerWaalsContact O-N 3.08Å; E733-K737 WeakPolarHBondContact OE1-CE 3.45Å; E733-K737 IonicContact OE1-NZ 3.73Å; E733-K737 PolarHBondContact OE1-NZ 3.32Å
734	L	95	Very high	91.1	Very high	5 Å²	5	56.2 Å²	56.2	3%	0.026	28%	0.276	C	S	.	.	H	α-helix	trans	-58.3	-51.3	175.5	174.5	67.1	0	0	0	111.3	M559 S730 W731 N736 K737 V738 A750 H751 F754	M559-L734 HydrophobicContact CE-CD2 4.49Å; S730-L734 PolarHBondContact O-N 2.91Å; W731-L734 HydrophobicContact CE3-CD2 4.17Å; W731-L734 HydrophobicContact CZ3-CD2 4.13Å; W731-L734 PolarHBondContact O-N 3.36Å; L734-N736 PolarHBondContact O-N 2.98Å; L734-K737 WeakPolarHBondContact O-CB 3.41Å; L734-K737 PolarHBondContact O-N 2.98Å; L734-K737 VanDerWaalsContact O-N 3.12Å; L734-V738 HydrophobicContact CD1-CG2 3.76Å; L734-V738 HydrophobicContact CG-CG2 4.15Å; L734-V738 WeakPolarHBondContact O-CG2 3.34Å; L734-V738 PolarHBondContact O-N 3.48Å; L734-A750 HydrophobicContact CD1-CB 4.11Å; L734-A750 WeakPolarHBondContact CD1-O 3.47Å; L734-H751 HydrophobicContact CD1-CB 4.42Å; L734-F754 HydrophobicContact CB-CB 4.14Å; L734-F754 HydrophobicContact CB-CD2 3.7Å; L734-F754 HydrophobicContact CB-CE2 4.28Å; L734-F754 HydrophobicContact CB-CG 4.02Å; L734-F754 HydrophobicContact CD1-CB 4.04Å; L734-F754 HydrophobicContact CD1-CG 4.39Å; L734-F754 HydrophobicContact CD2-CB 4.26Å; L734-F754 HydrophobicContact CD2-CD1 3.75Å; L734-F754 HydrophobicContact CD2-CD2 3.89Å; L734-F754 HydrophobicContact CD2-CE1 3.94Å; L734-F754 HydrophobicContact CD2-CE2 4.06Å; L734-F754 HydrophobicContact CD2-CG 3.71Å; L734-F754 HydrophobicContact CD2-CZ 4.07Å; L734-F754 HydrophobicContact CG-CB 4.37Å; L734-F754 HydrophobicContact CG-CD2 4.34Å; L734-F754 HydrophobicContact CG-CG 4.24Å
735	W	94.6	Very high	91.2	Very high	62 Å²	62	53.5 Å²	53.5	24%	0.235	27%	0.266	C	S	.	.	H	α-helix	trans	-65	-40.7	-172.7	-170.4	-101.8	0	0	0	111.6	L556 W731 V738 Q739	L556-W735 HydrophobicContact CB-CH2 4.13Å; L556-W735 HydrophobicContact CB-CZ3 4.43Å; L556-W735 HydrophobicContact CD2-CZ3 4.39Å; W731-W735 AromaticContact CE2-CE3 3.99Å; W731-W735 HydrophobicContact CH2-CE3 4.01Å; W731-W735 HydrophobicContact CH2-CZ3 4.24Å; W731-W735 HydrophobicContact CZ2-CD2 4.07Å; W731-W735 AromaticContact CZ2-CE3 3.33Å; W731-W735 HydrophobicContact CZ2-CE3 3.33Å; W731-W735 AromaticContact CZ2-CZ3 3.75Å; W731-W735 HydrophobicContact CZ2-CZ3 3.75Å; W731-W735 AromaticContact NE1-CG 3.99Å; W731-W735 VanDerWaalsContact O-CB 3.31Å; W731-W735 WeakPolarHBondContact O-CB 3.36Å; W731-W735 PolarHBondContact O-N 3.22Å; W735-V738 PolarHBondContact O-N 3.32Å; W735-Q739 VanDerWaalsContact NE1-NE2 3.1Å; W735-Q739 WeakPolarHBondContact O-CB 3.46Å; W735-Q739 WeakPolarHBondContact O-CG 3.09Å; W735-Q739 PolarHBondContact O-N 2.78Å
736	N	94.2	Very high	91.3	Very high	82 Å²	82	56 Å²	56	44%	0.439	28%	0.278	S	S	.	.	H	α-helix	trans	-64.1	-40.2	172.4	-78.7	-68.7	0	0	0	112.3	D732 L734 Q740	D732-N736 WeakPolarHBondContact O-CB 3.44Å; D732-N736 PolarHBondContact O-N 2.98Å; D732-N736 VanDerWaalsContact O-N 3.09Å; D732-N736 PolarHBondContact O-ND2 3.33Å; L734-N736 PolarHBondContact O-N 2.98Å; N736-Q740 WeakPolarHBondContact O-CB 3.15Å; N736-Q740 VanDerWaalsContact O-CG 3.24Å; N736-Q740 WeakPolarHBondContact O-CG 3.28Å; N736-Q740 PolarHBondContact O-N 2.86Å; N736-Q740 PolarHBondContact O-NE2 2.67Å
737	K	93.3	Very high	91.4	Very high	81 Å²	81	56 Å²	56	35%	0.352	28%	0.278	S	S	.	.	H	α-helix	trans	-64.2	-46	175	-76.2	169.8	172.6	174.3	0	112	E733 L734 Q739 Q740 A741 A750	E733-K737 HydrophobicContact CG-CD 4.23Å; E733-K737 WeakPolarHBondContact O-CB 3.36Å; E733-K737 VanDerWaalsContact O-CG 3.31Å; E733-K737 WeakPolarHBondContact O-CG 3.45Å; E733-K737 PolarHBondContact O-N 3.09Å; E733-K737 VanDerWaalsContact O-N 3.08Å; E733-K737 WeakPolarHBondContact OE1-CE 3.45Å; E733-K737 IonicContact OE1-NZ 3.73Å; E733-K737 PolarHBondContact OE1-NZ 3.32Å; L734-K737 WeakPolarHBondContact O-CB 3.41Å; L734-K737 PolarHBondContact O-N 2.98Å; L734-K737 VanDerWaalsContact O-N 3.12Å; K737-Q739 PolarHBondContact O-N 3.27Å; K737-Q740 CarbonylContact O-C 3.51Å; K737-Q740 PolarHBondContact O-N 3.02Å; K737-Q740 VanDerWaalsContact O-N 3.09Å; K737-A741 PolarHBondContact O-N 3.35Å; K737-A750 HydrophobicContact CB-CB 4.05Å; K737-A750 HydrophobicContact CD-CB 4.26Å
738	V	92.1	Very high	91.4	Very high	8 Å²	8	55.6 Å²	55.6	5%	0.048	28%	0.276	C	S	.	.	H	α-helix	trans	-65	-38.1	179.7	171.7	0	0	0	0	111.7	L556 M559 L734 W735 Q740 A741 I747	L556-V738 HydrophobicContact CD2-CG1 3.56Å; M559-V738 HydrophobicContact CE-CG2 4.26Å; M559-V738 HydrophobicContact SD-CG1 4.25Å; M559-V738 HydrophobicContact SD-CG2 4.31Å; L734-V738 HydrophobicContact CD1-CG2 3.76Å; L734-V738 HydrophobicContact CG-CG2 4.15Å; L734-V738 WeakPolarHBondContact O-CG2 3.34Å; L734-V738 PolarHBondContact O-N 3.48Å; W735-V738 PolarHBondContact O-N 3.32Å; V738-Q740 PolarHBondContact O-N 3.3Å; V738-A741 PolarHBondContact O-N 2.81Å; V738-I747 HydrophobicContact CG1-CD1 4.22Å; V738-I747 HydrophobicContact CG1-CG1 4.33Å; V738-I747 HydrophobicContact CG2-CG2 4.22Å
739	Q	89	Confident	91.4	Very high	126 Å²	126	54.9 Å²	54.9	59%	0.589	28%	0.28	S	S	*	.	H	α-helix	trans	-68.8	-19.7	173.4	-73.6	-168.6	-13.9	0	0	114.1	W735 K737	W735-Q739 VanDerWaalsContact NE1-NE2 3.1Å; W735-Q739 WeakPolarHBondContact O-CB 3.46Å; W735-Q739 WeakPolarHBondContact O-CG 3.09Å; W735-Q739 PolarHBondContact O-N 2.78Å; K737-Q739 PolarHBondContact O-N 3.27Å
740	Q	90.3	Very high	91.5	Very high	146 Å²	146	51.7 Å²	51.7	68%	0.682	26%	0.26	S	S	*	.	H	α-helix	trans	-100.9	-9.7	178.2	-67.6	171.5	39.1	0	0	113.1	N736 K737 V738	N736-Q740 WeakPolarHBondContact O-CB 3.15Å; N736-Q740 VanDerWaalsContact O-CG 3.24Å; N736-Q740 WeakPolarHBondContact O-CG 3.28Å; N736-Q740 PolarHBondContact O-N 2.86Å; N736-Q740 PolarHBondContact O-NE2 2.67Å; K737-Q740 CarbonylContact O-C 3.51Å; K737-Q740 PolarHBondContact O-N 3.02Å; K737-Q740 VanDerWaalsContact O-N 3.09Å; V738-Q740 PolarHBondContact O-N 3.3Å
741	A	89.4	Confident	91.6	Very high	20 Å²	20	51.3 Å²	51.3	17%	0.165	26%	0.257	C	S	.	.			trans	-66.9	135.3	-179.1	0	0	0	0	0	111.3	K737 V738 H746 I747	K737-A741 PolarHBondContact O-N 3.35Å; V738-A741 PolarHBondContact O-N 2.81Å; A741-H746 HydrophobicContact CB-CB 3.96Å; A741-I747 HydrophobicContact CB-CD1 4.42Å; A741-I747 HydrophobicContact CB-CG1 3.63Å
742	Q	86	Confident	91.5	Very high	110 Å²	110	55 Å²	55	51%	0.514	28%	0.275	S	S	.	.			trans	-95.7	-19.2	178	-60.3	-177.5	17.4	0	0	112.3	S542 L546	S542-Q742 WeakPolarHBondContact CB-O 3.46Å; L546-Q742 WeakPolarHBondContact CD1-O 3.38Å
743	D	86.9	Confident	91.5	Very high	2 Å²	2	54.6 Å²	54.6	1%	0.011	28%	0.275	C	S	.	.	S	Bend	trans	-138.8	159.8	-170	-46.1	-72	0	0	0	111.8	L485 Y538 S542 H746 I747	L485-D743 HydrophobicContact CD2-CB 4.28Å; Y538-D743 WeakPolarHBondContact CE1-OD1 3.47Å; Y538-D743 PolarHBondContact OH-OD1 3.26Å; Y538-D743 PolarHBondContact OH-OD2 3.25Å; S542-D743 WeakPolarHBondContact CB-OD1 3.38Å; S542-D743 PolarHBondContact OG-OD1 3.43Å; D743-H746 PolarHBondContact O-N 3.41Å; D743-H746 IonicContact OD2-CE1 2.63Å; D743-H746 PolarHBondContact OD2-CE1 3.26Å; D743-H746 VanDerWaalsContact OD2-CE1 3.23Å; D743-H746 IonicContact OD2-ND1 3.04Å; D743-H746 PolarHBondContact OD2-ND1 2.89Å; D743-I747 PolarHBondContact O-N 2.92Å
744	L	87.9	Confident	91.5	Very high	3 Å²	3	50.2 Å²	50.2	2%	0.016	25%	0.254	C	S	.	.	H	α-helix	trans	-65.5	-39.4	177.7	-166.5	61.9	0	0	0	112.7	W460 L545 L546 L549 L555 T650 V651 H746 I747 I748	W460-L744 HydrophobicContact CD2-CD2 4.27Å; W460-L744 HydrophobicContact CE3-CD2 4.3Å; W460-L744 HydrophobicContact CH2-CB 4.16Å; W460-L744 HydrophobicContact CH2-CD2 4.01Å; W460-L744 HydrophobicContact CZ2-CB 3.83Å; W460-L744 HydrophobicContact CZ2-CD2 3.96Å; W460-L744 HydrophobicContact CZ2-CG 4.31Å; W460-L744 HydrophobicContact CZ3-CD2 4.17Å; L545-L744 HydrophobicContact CD2-CB 4.15Å; L545-L744 HydrophobicContact CD2-CD2 4.23Å; L546-L744 HydrophobicContact CD2-CD1 4.23Å; L549-L744 HydrophobicContact CD1-CD1 3.62Å; L549-L744 HydrophobicContact CD1-CD2 4.1Å; L549-L744 HydrophobicContact CD1-CG 4.46Å; L555-L744 HydrophobicContact CD2-CD1 4.48Å; T650-L744 HydrophobicContact CG2-CD2 4.44Å; V651-L744 HydrophobicContact CG2-CD1 3.64Å; V651-L744 HydrophobicContact CG2-CG 4.34Å; L744-H746 PolarHBondContact O-N 3.34Å; L744-I747 WeakPolarHBondContact O-CB 3.47Å; L744-I747 PolarHBondContact O-N 3.46Å; L744-I748 HydrophobicContact CG-CD1 4.2Å; L744-I748 WeakPolarHBondContact O-CG1 3.49Å; L744-I748 PolarHBondContact O-N 3.41Å
745	D	88.8	Confident	91.4	Very high	62 Å²	62	50 Å²	50	33%	0.332	25%	0.253	S	S	.	.	H	α-helix	trans	-58	-36.5	175.5	-76.1	-6.9	0	0	0	112	W460 I747 I748 A749	W460-D745 PolarHBondContact NE1-OD1 3.29Å; D745-I747 VanDerWaalsContact C-N 3.34Å; D745-I748 PolarHBondContact O-N 2.94Å; D745-A749 WeakPolarHBondContact O-CB 3.44Å; D745-A749 PolarHBondContact O-N 3.34Å
746	H	90.7	Very high	91.3	Very high	107 Å²	107	51.2 Å²	51.2	50%	0.495	26%	0.264	S	S	.	.	H	α-helix	trans	-69.5	-30	176.5	-74.5	115.6	0	0	0	112.5	A741 D743 L744 A750	A741-H746 HydrophobicContact CB-CB 3.96Å; D743-H746 PolarHBondContact O-N 3.41Å; D743-H746 IonicContact OD2-CE1 2.63Å; D743-H746 PolarHBondContact OD2-CE1 3.26Å; D743-H746 VanDerWaalsContact OD2-CE1 3.23Å; D743-H746 IonicContact OD2-ND1 3.04Å; D743-H746 PolarHBondContact OD2-ND1 2.89Å; L744-H746 PolarHBondContact O-N 3.34Å; H746-A750 VanDerWaalsContact O-CB 3.26Å; H746-A750 WeakPolarHBondContact O-CB 3.42Å; H746-A750 PolarHBondContact O-N 3.2Å
747	I	92	Very high	91.2	Very high	3 Å²	3	49.6 Å²	49.6	2%	0.015	26%	0.258	C	S	.	.	H	α-helix	trans	-73.6	-45	173.2	-65.3	-179.8	0	0	0	110.6	L546 M559 V651 V738 A741 D743 L744 D745 A750 H751	L546-I747 HydrophobicContact CD1-CD1 4.41Å; L546-I747 HydrophobicContact CD2-CD1 3.51Å; M559-I747 HydrophobicContact CE-CG2 4.03Å; V651-I747 HydrophobicContact CG1-CG2 4.32Å; V738-I747 HydrophobicContact CG1-CD1 4.22Å; V738-I747 HydrophobicContact CG1-CG1 4.33Å; V738-I747 HydrophobicContact CG2-CG2 4.22Å; A741-I747 HydrophobicContact CB-CD1 4.42Å; A741-I747 HydrophobicContact CB-CG1 3.63Å; D743-I747 PolarHBondContact O-N 2.92Å; L744-I747 WeakPolarHBondContact O-CB 3.47Å; L744-I747 PolarHBondContact O-N 3.46Å; D745-I747 VanDerWaalsContact C-N 3.34Å; I747-A750 PolarHBondContact O-N 3.42Å; I747-H751 WeakPolarHBondContact O-CB 3.22Å; I747-H751 PolarHBondContact O-N 2.77Å
748	I	91.6	Very high	91.1	Very high	10 Å²	10	45.8 Å²	45.8	5%	0.051	24%	0.241	C	C	.	.	H	α-helix	trans	-60.8	-52.5	179.1	-65.3	168.4	0	0	0	110.1	V651 L744 D745 A750 H751 E752	V651-I748 HydrophobicContact CG1-CG1 4.22Å; V651-I748 HydrophobicContact CG2-CG1 4.47Å; L744-I748 HydrophobicContact CG-CD1 4.2Å; L744-I748 WeakPolarHBondContact O-CG1 3.49Å; L744-I748 PolarHBondContact O-N 3.41Å; D745-I748 PolarHBondContact O-N 2.94Å; I748-A750 VanDerWaalsContact C-N 3.29Å; I748-A750 PolarHBondContact O-N 2.56Å; I748-H751 WeakPolarHBondContact O-CA 3.35Å; I748-H751 WeakPolarHBondContact O-CB 3.36Å; I748-H751 PolarHBondContact O-N 3.37Å; I748-E752 HydrophobicContact CG2-CG 4.46Å; I748-E752 WeakPolarHBondContact O-CG 3.25Å; I748-E752 PolarHBondContact O-N 3.2Å
749	A	91.3	Very high	91.1	Very high	47 Å²	47	45.7 Å²	45.7	39%	0.388	24%	0.24	S	C	.	.	H	α-helix	trans	-62.7	-32.9	179.1	0	0	0	0	0	113.2	D745 V753	D745-A749 WeakPolarHBondContact O-CB 3.44Å; D745-A749 PolarHBondContact O-N 3.34Å; A749-V753 VanDerWaalsContact O-CG2 3.29Å; A749-V753 WeakPolarHBondContact O-CG2 3.48Å; A749-V753 PolarHBondContact O-N 3.46Å
750	A	93.6	Very high	91.1	Very high	11 Å²	11	41.5 Å²	41.5	9%	0.091	23%	0.225	C	C	.	.	H	α-helix	trans	-69.2	-35	173	0	0	0	0	0	112.4	L734 K737 H746 I747 I748 F754	L734-A750 HydrophobicContact CD1-CB 4.11Å; L734-A750 WeakPolarHBondContact CD1-O 3.47Å; K737-A750 HydrophobicContact CB-CB 4.05Å; K737-A750 HydrophobicContact CD-CB 4.26Å; H746-A750 VanDerWaalsContact O-CB 3.26Å; H746-A750 WeakPolarHBondContact O-CB 3.42Å; H746-A750 PolarHBondContact O-N 3.2Å; I747-A750 PolarHBondContact O-N 3.42Å; I748-A750 VanDerWaalsContact C-N 3.29Å; I748-A750 PolarHBondContact O-N 2.56Å; A750-F754 WeakPolarHBondContact O-CB 3.04Å; A750-F754 PolarHBondContact O-N 3.22Å; A750-F754 VanDerWaalsContact O-N 3.09Å
751	H	93.6	Very high	91	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-73	-40.1	178.8	-175.5	-121.9	0	0	0	112.9	M559 F652 Y660 L734 I747 I748 F754 L755	M559-H751 HydrophobicContact CE-CB 4.19Å; F652-H751 AromaticContact CD1-CE1 3.87Å; Y660-H751 AromaticContact CE2-CE1 3.74Å; Y660-H751 AromaticContact CE2-NE2 3.53Å; Y660-H751 AromaticContact CZ-NE2 3.59Å; Y660-H751 PolarHBondContact OH-NE2 3.03Å; L734-H751 HydrophobicContact CD1-CB 4.42Å; I747-H751 WeakPolarHBondContact O-CB 3.22Å; I747-H751 PolarHBondContact O-N 2.77Å; I748-H751 WeakPolarHBondContact O-CA 3.35Å; I748-H751 WeakPolarHBondContact O-CB 3.36Å; I748-H751 PolarHBondContact O-N 3.37Å; H751-F754 WeakPolarHBondContact O-CB 3.16Å; H751-F754 PolarHBondContact O-N 3.44Å; H751-L755 PolarHBondContact O-N 3.29Å
752	E	92.2	Very high	90.9	Very high	87 Å²	87	37.5 Å²	37.5	41%	0.407	20%	0.199	S	C	.	.	H	α-helix	trans	-59.8	-52.7	172.4	-70.3	174.5	162.2	0	0	111.1	I748 F754 L755 D756	I748-E752 HydrophobicContact CG2-CG 4.46Å; I748-E752 WeakPolarHBondContact O-CG 3.25Å; I748-E752 PolarHBondContact O-N 3.2Å; E752-F754 PolarHBondContact O-N 2.87Å; E752-L755 PolarHBondContact O-N 3.45Å; E752-D756 PolarHBondContact O-N 3.03Å
753	V	94.2	Very high	90.9	Very high	73 Å²	73	32.5 Å²	32.5	44%	0.442	18%	0.176	S	C	.	.	H	α-helix	trans	-58.9	-36.3	177.5	170	0	0	0	0	112	A749 T757	A749-V753 VanDerWaalsContact O-CG2 3.29Å; A749-V753 WeakPolarHBondContact O-CG2 3.48Å; A749-V753 PolarHBondContact O-N 3.46Å; V753-T757 VanDerWaalsContact O-CB 3.25Å; V753-T757 WeakPolarHBondContact O-CB 3.36Å; V753-T757 PolarHBondContact O-N 3.19Å; V753-T757 PolarHBondContact O-OG1 2.85Å
754	F	94.8	Very high	91	Very high	8 Å²	8	33.8 Å²	33.8	4%	0.035	18%	0.183	C	C	.	.	H	α-helix	trans	-64.6	-46.2	173.8	161.1	-96.4	0	0	0	112.3	L567 S730 W731 L734 A750 H751 E752 T757 I758	L567-F754 HydrophobicContact CD1-CE1 4.43Å; L567-F754 HydrophobicContact CD1-CZ 3.9Å; S730-F754 WeakPolarHBondContact O-CD2 3.46Å; W731-F754 HydrophobicContact CB-CE2 4.32Å; W731-F754 HydrophobicContact CE3-CE2 4.3Å; W731-F754 HydrophobicContact CE3-CZ 4.04Å; L734-F754 HydrophobicContact CB-CB 4.14Å; L734-F754 HydrophobicContact CB-CD2 3.7Å; L734-F754 HydrophobicContact CB-CE2 4.28Å; L734-F754 HydrophobicContact CB-CG 4.02Å; L734-F754 HydrophobicContact CD1-CB 4.04Å; L734-F754 HydrophobicContact CD1-CG 4.39Å; L734-F754 HydrophobicContact CD2-CB 4.26Å; L734-F754 HydrophobicContact CD2-CD1 3.75Å; L734-F754 HydrophobicContact CD2-CD2 3.89Å; L734-F754 HydrophobicContact CD2-CE1 3.94Å; L734-F754 HydrophobicContact CD2-CE2 4.06Å; L734-F754 HydrophobicContact CD2-CG 3.71Å; L734-F754 HydrophobicContact CD2-CZ 4.07Å; L734-F754 HydrophobicContact CG-CB 4.37Å; L734-F754 HydrophobicContact CG-CD2 4.34Å; L734-F754 HydrophobicContact CG-CG 4.24Å; A750-F754 WeakPolarHBondContact O-CB 3.04Å; A750-F754 PolarHBondContact O-N 3.22Å; A750-F754 VanDerWaalsContact O-N 3.09Å; H751-F754 WeakPolarHBondContact O-CB 3.16Å; H751-F754 PolarHBondContact O-N 3.44Å; E752-F754 PolarHBondContact O-N 2.87Å; F754-T757 PolarHBondContact O-N 3.24Å; F754-I758 HydrophobicContact CD1-CD1 4.27Å; F754-I758 HydrophobicContact CD2-CD1 4Å; F754-I758 HydrophobicContact CE1-CD1 3.71Å; F754-I758 HydrophobicContact CE2-CD1 3.4Å; F754-I758 VanDerWaalsContact CE2-CD1 3.4Å; F754-I758 HydrophobicContact CE2-CG1 4.36Å; F754-I758 HydrophobicContact CG-CD1 4.42Å; F754-I758 HydrophobicContact CZ-CD1 3.24Å; F754-I758 WeakPolarHBondContact O-CG1 3.11Å; F754-I758 PolarHBondContact O-N 3.18Å
755	L	93.6	Very high	90.9	Very high	2 Å²	2	36.5 Å²	36.5	1%	0.01	20%	0.197	C	C	.	.	H	α-helix	trans	-64.5	-45.5	178.8	-78.6	176.7	0	0	0	112.1	C656 H659 Y660 H751 E752 T757 I758 I759	C656-L755 HydrophobicContact CB-CD1 3.62Å; H659-L755 HydrophobicContact CB-CD1 4.25Å; Y660-L755 HydrophobicContact CD1-CD2 4.01Å; Y660-L755 HydrophobicContact CD2-CD1 4.43Å; Y660-L755 HydrophobicContact CD2-CD2 4.15Å; Y660-L755 HydrophobicContact CE1-CD2 3.79Å; Y660-L755 HydrophobicContact CE2-CD1 4.19Å; Y660-L755 HydrophobicContact CE2-CD2 3.94Å; Y660-L755 HydrophobicContact CG-CD2 4.18Å; H751-L755 PolarHBondContact O-N 3.29Å; E752-L755 PolarHBondContact O-N 3.45Å; L755-T757 VanDerWaalsContact C-N 3.3Å; L755-T757 PolarHBondContact O-N 2.88Å; L755-I758 PolarHBondContact O-N 2.83Å; L755-I758 VanDerWaalsContact O-N 3.13Å; L755-I759 VanDerWaalsContact O-CG1 3.29Å; L755-I759 WeakPolarHBondContact O-CG1 3.34Å; L755-I759 PolarHBondContact O-N 2.98Å
756	D	91.8	Very high	90.5	Very high	87 Å²	87	35.5 Å²	35.5	47%	0.465	20%	0.202	S	C	.	.	H	α-helix	trans	-65.2	-36	177.9	-71.2	-12.6	0	0	0	111.7	H659 E752 I759 S760	H659-D756 IonicContact CE1-OD1 3.37Å; H659-D756 IonicContact ND1-OD1 3.65Å; E752-D756 PolarHBondContact O-N 3.03Å; D756-I759 PolarHBondContact O-N 2.88Å; D756-S760 WeakPolarHBondContact O-CB 3.24Å; D756-S760 PolarHBondContact O-N 3.01Å; D756-S760 PolarHBondContact O-OG 2.98Å
757	T	91.6	Very high	90.1	Very high	48 Å²	48	38.2 Å²	38.2	29%	0.294	22%	0.22	S	C	.	.	H	α-helix	trans	-63.9	-38.9	172.2	-59.7	0	0	0	0	111.7	V753 F754 L755 S760 R761	V753-T757 VanDerWaalsContact O-CB 3.25Å; V753-T757 WeakPolarHBondContact O-CB 3.36Å; V753-T757 PolarHBondContact O-N 3.19Å; V753-T757 PolarHBondContact O-OG1 2.85Å; F754-T757 PolarHBondContact O-N 3.24Å; L755-T757 VanDerWaalsContact C-N 3.3Å; L755-T757 PolarHBondContact O-N 2.88Å; T757-S760 PolarHBondContact O-OG 2.97Å; T757-S760 VanDerWaalsContact O-OG 3.08Å; T757-R761 HydrophobicContact CG2-CG 4.25Å; T757-R761 WeakPolarHBondContact O-CB 3.45Å; T757-R761 WeakPolarHBondContact O-CG 3.14Å; T757-R761 PolarHBondContact O-N 2.84Å; T757-R761 VanDerWaalsContact O-N 3.16Å
758	I	92.9	Very high	89.8	Confident	1 Å²	1	39 Å²	39	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-69.9	-46.6	175.6	-73.9	175.2	0	0	0	111.5	L567 V663 L727 S730 F754 L755 S760 R761 C762	L567-I758 HydrophobicContact CD1-CD1 4.16Å; V663-I758 HydrophobicContact CG1-CG2 3.85Å; V663-I758 HydrophobicContact CG2-CG2 3.79Å; L727-I758 HydrophobicContact CD2-CD1 3.71Å; L727-I758 HydrophobicContact CD2-CG1 4.09Å; L727-I758 HydrophobicContact CD2-CG2 3.99Å; S730-I758 WeakPolarHBondContact OG-CG1 3.37Å; F754-I758 HydrophobicContact CD1-CD1 4.27Å; F754-I758 HydrophobicContact CD2-CD1 4Å; F754-I758 HydrophobicContact CE1-CD1 3.71Å; F754-I758 HydrophobicContact CE2-CD1 3.4Å; F754-I758 VanDerWaalsContact CE2-CD1 3.4Å; F754-I758 HydrophobicContact CE2-CG1 4.36Å; F754-I758 HydrophobicContact CG-CD1 4.42Å; F754-I758 HydrophobicContact CZ-CD1 3.24Å; F754-I758 WeakPolarHBondContact O-CG1 3.11Å; F754-I758 PolarHBondContact O-N 3.18Å; L755-I758 PolarHBondContact O-N 2.83Å; L755-I758 VanDerWaalsContact O-N 3.13Å; I758-S760 VanDerWaalsContact C-N 3.34Å; I758-S760 PolarHBondContact O-N 3.23Å; I758-R761 PolarHBondContact O-N 3.3Å; I758-C762 WeakPolarHBondContact O-CB 3.41Å; I758-C762 PolarHBondContact O-N 3.33Å; I758-C762 PolarHBondContact O-SG 2.93Å; I758-C762 VanDerWaalsContact O-SG 3.38Å
759	I	92.1	Very high	89.6	Confident	5 Å²	5	46.5 Å²	46.5	3%	0.026	25%	0.253	C	S	.	.	H	α-helix	trans	-59	-47.6	-178.2	-67.4	164.9	0	0	0	110.4	H659 V663 L755 D756 L763 L764 D765	H659-I759 HydrophobicContact CB-CD1 3.76Å; H659-I759 VanDerWaalsContact CG-CD1 3.45Å; H659-I759 VanDerWaalsContact ND1-CD1 3.29Å; H659-I759 WeakPolarHBondContact ND1-CD1 3.41Å; V663-I759 HydrophobicContact CG2-CG1 4.01Å; L755-I759 VanDerWaalsContact O-CG1 3.29Å; L755-I759 WeakPolarHBondContact O-CG1 3.34Å; L755-I759 PolarHBondContact O-N 2.98Å; D756-I759 PolarHBondContact O-N 2.88Å; I759-L763 PolarHBondContact O-N 2.69Å; I759-L764 HydrophobicContact CG2-CB 3.75Å; I759-L764 WeakPolarHBondContact O-CB 3.41Å; I759-L764 PolarHBondContact O-N 3.4Å; I759-D765 WeakPolarHBondContact CG2-OD1 3.46Å
760	S	88.8	Confident	89.4	Confident	38 Å²	38	46.9 Å²	46.9	27%	0.266	26%	0.256	S	S	.	.	H	α-helix	trans	-63.3	-51.8	179.5	54.9	0	0	0	0	112.7	D756 T757 I758 C762 L763 D765	D756-S760 WeakPolarHBondContact O-CB 3.24Å; D756-S760 PolarHBondContact O-N 3.01Å; D756-S760 PolarHBondContact O-OG 2.98Å; T757-S760 PolarHBondContact O-OG 2.97Å; T757-S760 VanDerWaalsContact O-OG 3.08Å; I758-S760 VanDerWaalsContact C-N 3.34Å; I758-S760 PolarHBondContact O-N 3.23Å; S760-C762 VanDerWaalsContact C-N 3.34Å; S760-C762 PolarHBondContact O-N 3.39Å; S760-L763 PolarHBondContact O-N 2.74Å; S760-D765 VanDerWaalsContact CA-CG 3.49Å; S760-D765 WeakPolarHBondContact CA-OD2 3.27Å; S760-D765 WeakPolarHBondContact CB-OD2 3.23Å
761	R	87.4	Confident	89.1	Confident	82 Å²	82	46.8 Å²	46.8	31%	0.309	25%	0.254	S	S	.	.	H	α-helix	trans	-68.7	-28.5	-179.3	-62.4	-78.5	165.7	-150	-24.3	113.1	V726 T757 I758 L763 D870 S872	V726-R761 HydrophobicContact CB-CB 4.18Å; V726-R761 HydrophobicContact CG1-CB 3.42Å; V726-R761 VanDerWaalsContact CG1-CB 3.42Å; V726-R761 HydrophobicContact CG1-CG 4.37Å; V726-R761 HydrophobicContact CG2-CB 3.71Å; T757-R761 HydrophobicContact CG2-CG 4.25Å; T757-R761 WeakPolarHBondContact O-CB 3.45Å; T757-R761 WeakPolarHBondContact O-CG 3.14Å; T757-R761 PolarHBondContact O-N 2.84Å; T757-R761 VanDerWaalsContact O-N 3.16Å; I758-R761 PolarHBondContact O-N 3.3Å; R761-L763 PolarHBondContact O-N 2.63Å; R761-D870 IonicContact CZ-OD1 3.73Å; R761-D870 VanDerWaalsContact NH1-CG 3.31Å; R761-D870 IonicContact NH1-OD1 2.66Å; R761-D870 PolarHBondContact NH1-OD1 2.94Å; R761-D870 IonicContact NH2-OD1 2.77Å; R761-D870 PolarHBondContact NH2-OD1 3.36Å; R761-S872 PolarHBondContact NH1-OG 3.16Å
762	C	87.8	Confident	88.9	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.007	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	9.5	170.8	-70.2	0	0	0	0	114.1	F666 I758 S760 L764	F666-C762 HydrophobicContact CD1-CB 4.18Å; F666-C762 HydrophobicContact CE1-CB 4Å; F666-C762 WeakPolarHBondContact CE1-O 3.16Å; F666-C762 WeakPolarHBondContact CZ-O 3.4Å; I758-C762 WeakPolarHBondContact O-CB 3.41Å; I758-C762 PolarHBondContact O-N 3.33Å; I758-C762 PolarHBondContact O-SG 2.93Å; I758-C762 VanDerWaalsContact O-SG 3.38Å; S760-C762 VanDerWaalsContact C-N 3.34Å; S760-C762 PolarHBondContact O-N 3.39Å; C762-L764 HydrophobicContact CB-CD1 4.03Å; C762-L764 HydrophobicContact CB-CG 4.41Å; C762-L764 PolarHBondContact O-N 3.25Å
763	L	86.8	Confident	88.9	Confident	4 Å²	4	47.5 Å²	47.5	2%	0.021	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.5	26.4	174.4	-44.8	179	0	0	0	114.6	I759 S760 R761 S768 L771 L772 L873	I759-L763 PolarHBondContact O-N 2.69Å; S760-L763 PolarHBondContact O-N 2.74Å; R761-L763 PolarHBondContact O-N 2.63Å; L763-S768 WeakPolarHBondContact CA-OG 3.41Å; L763-S768 PolarHBondContact O-OG 3.02Å; L763-L771 HydrophobicContact CD1-CD2 3.61Å; L763-L771 HydrophobicContact CD1-CG 3.97Å; L763-L771 HydrophobicContact CD2-CD2 3.74Å; L763-L771 HydrophobicContact CG-CD2 4.25Å; L763-L772 WeakPolarHBondContact O-CB 3.47Å; L763-L772 WeakPolarHBondContact O-CD1 3.39Å; L763-L873 HydrophobicContact CD2-CD1 3.74Å; L763-L873 HydrophobicContact CD2-CD2 3.81Å; L763-L873 HydrophobicContact CD2-CG 4.45Å
764	L	88	Confident	88.7	Confident	29 Å²	29	45.6 Å²	45.6	15%	0.152	25%	0.247	C	C	.	.			trans	-98.4	8.1	-175.1	-67	164.2	0	0	0	114	R662 V663 F666 I759 C762 L772	R662-L764 PolarHBondContact NH2-O 3.18Å; V663-L764 HydrophobicContact CG2-CD1 3.99Å; F666-L764 HydrophobicContact CB-CD1 4.11Å; F666-L764 HydrophobicContact CB-CD2 3.95Å; F666-L764 HydrophobicContact CB-CG 4.5Å; F666-L764 HydrophobicContact CD1-CD1 4.41Å; F666-L764 HydrophobicContact CD2-CD2 4.29Å; F666-L764 HydrophobicContact CG-CD1 4.35Å; F666-L764 HydrophobicContact CG-CD2 4.15Å; F666-L764 HydrophobicContact CG-CG 4.47Å; I759-L764 HydrophobicContact CG2-CB 3.75Å; I759-L764 WeakPolarHBondContact O-CB 3.41Å; I759-L764 PolarHBondContact O-N 3.4Å; C762-L764 HydrophobicContact CB-CD1 4.03Å; C762-L764 HydrophobicContact CB-CG 4.41Å; C762-L764 PolarHBondContact O-N 3.25Å; L764-L772 HydrophobicContact CD2-CD1 3.62Å; L764-L772 HydrophobicContact CG-CD1 4.41Å
765	D	85.3	Confident	88.6	Confident	60 Å²	60	45.4 Å²	45.4	32%	0.321	25%	0.246	S	C	.	.	S	Bend	trans	-79.3	175.8	-179.7	-77.7	-11.6	0	0	0	113.8	I759 S760 S768 R769	I759-D765 WeakPolarHBondContact CG2-OD1 3.46Å; S760-D765 VanDerWaalsContact CA-CG 3.49Å; S760-D765 WeakPolarHBondContact CA-OD2 3.27Å; S760-D765 WeakPolarHBondContact CB-OD2 3.23Å; D765-S768 WeakPolarHBondContact CB-OG 3.44Å; D765-S768 PolarHBondContact N-OG 3.48Å; D765-R769 WeakPolarHBondContact O-CG 3.41Å
766	G	81.7	Confident	88.5	Confident	42 Å²	42	52 Å²	52	43%	0.433	27%	0.271	S	S	.	.	S	Bend	trans	-61.6	-43.8	167.8	0	0	0	0	0	113.3	R769	G766-R769 WeakPolarHBondContact O-CB 3.37Å; G766-R769 VanDerWaalsContact O-CD 3.27Å; G766-R769 WeakPolarHBondContact O-CD 3.36Å; G766-R769 WeakPolarHBondContact O-CG 3.27Å
767	D	81.2	Confident	88.5	Confident	163 Å²	163	49.3 Å²	49.3	87%	0.872	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-32.7	-170.8	-60.7	-22.4	0	0	0	112.5	R769	D767-R769 VanDerWaalsContact C-N 3.29Å; D767-R769 PolarHBondContact O-N 3.05Å
768	S	85.6	Confident	88.6	Confident	19 Å²	19	47 Å²	47	13%	0.133	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	0.9	178	48.2	0	0	0	0	114.2	L763 D765 A770 L771 L772	L763-S768 WeakPolarHBondContact CA-OG 3.41Å; L763-S768 PolarHBondContact O-OG 3.02Å; D765-S768 WeakPolarHBondContact CB-OG 3.44Å; D765-S768 PolarHBondContact N-OG 3.48Å; S768-A770 VanDerWaalsContact C-N 3.26Å; S768-A770 PolarHBondContact O-N 3.26Å; S768-A770 VanDerWaalsContact O-N 3.14Å; S768-L771 WeakPolarHBondContact O-CA 3.46Å; S768-L771 WeakPolarHBondContact O-CB 3.18Å; S768-L771 PolarHBondContact O-N 3.25Å; S768-L772 PolarHBondContact O-N 2.92Å
769	R	86.8	Confident	88.6	Confident	169 Å²	169	47.8 Å²	47.8	64%	0.638	25%	0.25	S	S	*	.	H	α-helix	trans	-49.2	-41.1	177	-76.3	176.3	-176.5	179.2	2.5	114.2	D765 G766 D767 L771 L772 N773	D765-R769 WeakPolarHBondContact O-CG 3.41Å; G766-R769 WeakPolarHBondContact O-CB 3.37Å; G766-R769 VanDerWaalsContact O-CD 3.27Å; G766-R769 WeakPolarHBondContact O-CD 3.36Å; G766-R769 WeakPolarHBondContact O-CG 3.27Å; D767-R769 VanDerWaalsContact C-N 3.29Å; D767-R769 PolarHBondContact O-N 3.05Å; R769-L771 VanDerWaalsContact C-N 3.28Å; R769-L771 PolarHBondContact O-N 2.97Å; R769-L772 PolarHBondContact O-N 3.29Å; R769-N773 WeakPolarHBondContact O-CB 3.49Å; R769-N773 VanDerWaalsContact O-CG 3.24Å; R769-N773 PolarHBondContact O-N 2.99Å; R769-N773 PolarHBondContact O-ND2 3.39Å
770	A	87.4	Confident	88.6	Confident	54 Å²	54	52.4 Å²	52.4	45%	0.446	28%	0.275	S	S	.	.	H	α-helix	trans	-63.6	-36.9	179.5	0	0	0	0	0	112	S768 Q774 L864	S768-A770 VanDerWaalsContact C-N 3.26Å; S768-A770 PolarHBondContact O-N 3.26Å; S768-A770 VanDerWaalsContact O-N 3.14Å; A770-Q774 WeakPolarHBondContact O-CG 3.46Å; A770-Q774 PolarHBondContact O-N 3.06Å; A770-L864 HydrophobicContact CB-CD2 3.79Å
771	L	88.6	Confident	88.8	Confident	9 Å²	9	51.1 Å²	51.1	5%	0.047	27%	0.265	C	S	.	.	H	α-helix	trans	-77.2	-39.8	-179.9	-171.5	67.4	0	0	0	111.3	L763 S768 R769 N773 Q774 L775 F861 L864 L865 L873	L763-L771 HydrophobicContact CD1-CD2 3.61Å; L763-L771 HydrophobicContact CD1-CG 3.97Å; L763-L771 HydrophobicContact CD2-CD2 3.74Å; L763-L771 HydrophobicContact CG-CD2 4.25Å; S768-L771 WeakPolarHBondContact O-CA 3.46Å; S768-L771 WeakPolarHBondContact O-CB 3.18Å; S768-L771 PolarHBondContact O-N 3.25Å; R769-L771 VanDerWaalsContact C-N 3.28Å; R769-L771 PolarHBondContact O-N 2.97Å; L771-N773 VanDerWaalsContact C-N 3.34Å; L771-N773 PolarHBondContact O-N 2.88Å; L771-Q774 PolarHBondContact O-N 3.06Å; L771-L775 WeakPolarHBondContact O-CB 3.29Å; L771-L775 PolarHBondContact O-N 3.32Å; L771-F861 HydrophobicContact CD1-CD2 3.41Å; L771-F861 VanDerWaalsContact CD1-CD2 3.41Å; L771-F861 HydrophobicContact CD1-CE2 3.37Å; L771-F861 HydrophobicContact CD1-CG 4.13Å; L771-F861 HydrophobicContact CD1-CZ 4.08Å; L771-F861 HydrophobicContact CG-CD2 4.17Å; L771-F861 HydrophobicContact CG-CE2 3.7Å; L771-F861 HydrophobicContact CG-CZ 4.42Å; L771-L864 HydrophobicContact CB-CD2 3.82Å; L771-L864 HydrophobicContact CB-CG 4.36Å; L771-L864 HydrophobicContact CD1-CB 4.09Å; L771-L864 HydrophobicContact CD1-CD2 3.96Å; L771-L864 HydrophobicContact CD1-CG 4.01Å; L771-L865 HydrophobicContact CD1-CD2 3.99Å; L771-L865 HydrophobicContact CD1-CG 3.99Å; L771-L865 HydrophobicContact CD2-CD2 3.63Å; L771-L865 HydrophobicContact CG-CD2 4.41Å; L771-L873 HydrophobicContact CD2-CD1 4.43Å
772	L	89.7	Confident	89.1	Confident	17 Å²	17	47.2 Å²	47.2	9%	0.089	25%	0.25	C	S	.	.	H	α-helix	trans	-65.1	-34.7	173.1	-179	144.9	0	0	0	112.5	F666 L763 L764 S768 R769 L775 R776	F666-L772 HydrophobicContact CD2-CD1 4.42Å; F666-L772 HydrophobicContact CE2-CD1 4.49Å; L763-L772 WeakPolarHBondContact O-CB 3.47Å; L763-L772 WeakPolarHBondContact O-CD1 3.39Å; L764-L772 HydrophobicContact CD2-CD1 3.62Å; L764-L772 HydrophobicContact CG-CD1 4.41Å; S768-L772 PolarHBondContact O-N 2.92Å; R769-L772 PolarHBondContact O-N 3.29Å; L772-L775 PolarHBondContact O-N 3.26Å; L772-R776 HydrophobicContact CD2-CG 4.37Å; L772-R776 WeakPolarHBondContact O-CG 3.16Å; L772-R776 PolarHBondContact O-N 3.38Å
773	N	90.9	Very high	89.2	Confident	87 Å²	87	49.3 Å²	49.3	47%	0.465	26%	0.261	S	S	.	.	H	α-helix	trans	-67.7	-37.7	174	-75.6	-14.3	0	0	0	112.5	R769 L771 R776 A777	R769-N773 WeakPolarHBondContact O-CB 3.49Å; R769-N773 VanDerWaalsContact O-CG 3.24Å; R769-N773 PolarHBondContact O-N 2.99Å; R769-N773 PolarHBondContact O-ND2 3.39Å; L771-N773 VanDerWaalsContact C-N 3.34Å; L771-N773 PolarHBondContact O-N 2.88Å; N773-R776 PolarHBondContact O-N 3.45Å; N773-R776 PolarHBondContact OD1-NH1 2.92Å; N773-A777 PolarHBondContact O-N 3.33Å
774	Q	90.8	Very high	89.5	Confident	33 Å²	33	53.7 Å²	53.7	15%	0.154	28%	0.281	C	S	.	.	H	α-helix	trans	-66.5	-40.8	172.5	-70.1	-66.9	-29	0	0	111.6	A770 L771 R776 A777 V778 Q860 F861	A770-Q774 WeakPolarHBondContact O-CG 3.46Å; A770-Q774 PolarHBondContact O-N 3.06Å; L771-Q774 PolarHBondContact O-N 3.06Å; Q774-R776 VanDerWaalsContact C-N 3.34Å; Q774-R776 PolarHBondContact O-N 3Å; Q774-A777 WeakPolarHBondContact O-CB 3.44Å; Q774-A777 PolarHBondContact O-N 3.5Å; Q774-V778 PolarHBondContact O-N 3.33Å; Q774-Q860 HydrophobicContact CG-CG 4.5Å; Q774-F861 HydrophobicContact CB-CB 4.28Å; Q774-F861 HydrophobicContact CB-CD2 3.9Å
775	L	91.8	Very high	89.7	Confident	4 Å²	4	52.3 Å²	52.3	2%	0.021	27%	0.274	C	S	.	.	H	α-helix	trans	-63.2	-37.1	174.3	177.8	152.9	0	0	0	112.5	F666 M718 L771 L772 V778 F779 F861	F666-L775 HydrophobicContact CE2-CD1 4.29Å; F666-L775 HydrophobicContact CE2-CD2 3.84Å; F666-L775 HydrophobicContact CZ-CD1 4.31Å; M718-L775 HydrophobicContact CE-CD1 3.89Å; L771-L775 WeakPolarHBondContact O-CB 3.29Å; L771-L775 PolarHBondContact O-N 3.32Å; L772-L775 PolarHBondContact O-N 3.26Å; L775-V778 PolarHBondContact O-N 2.92Å; L775-F779 HydrophobicContact CD2-CD1 4.33Å; L775-F779 HydrophobicContact CD2-CD2 4.15Å; L775-F779 HydrophobicContact CD2-CE1 3.77Å; L775-F779 HydrophobicContact CD2-CE2 3.57Å; L775-F779 HydrophobicContact CD2-CZ 3.37Å; L775-F779 HydrophobicContact CG-CE1 4.02Å; L775-F779 HydrophobicContact CG-CZ 4.05Å; L775-F779 VanDerWaalsContact O-CD1 3.3Å; L775-F779 WeakPolarHBondContact O-CD1 3.3Å; L775-F779 WeakPolarHBondContact O-CG 3.46Å; L775-F779 PolarHBondContact O-N 3.48Å; L775-F779 VanDerWaalsContact O-N 3.12Å; L775-F861 HydrophobicContact CB-CE2 3.93Å; L775-F861 HydrophobicContact CD1-CE2 4.46Å
776	R	91.5	Very high	90	Very high	140 Å²	140	51.7 Å²	51.7	53%	0.528	27%	0.269	S	S	.	.	H	α-helix	trans	-60.6	-47.7	169.6	-77.5	172.6	170.8	161.7	-6.8	111.7	L772 N773 Q774 V778 F779 D780	L772-R776 HydrophobicContact CD2-CG 4.37Å; L772-R776 WeakPolarHBondContact O-CG 3.16Å; L772-R776 PolarHBondContact O-N 3.38Å; N773-R776 PolarHBondContact O-N 3.45Å; N773-R776 PolarHBondContact OD1-NH1 2.92Å; Q774-R776 VanDerWaalsContact C-N 3.34Å; Q774-R776 PolarHBondContact O-N 3Å; R776-V778 PolarHBondContact O-N 3.49Å; R776-F779 CarbonylContact O-C 3.6Å; R776-F779 WeakPolarHBondContact O-CA 3.32Å; R776-F779 WeakPolarHBondContact O-CB 3.43Å; R776-F779 PolarHBondContact O-N 3.31Å; R776-D780 VanDerWaalsContact O-CG 3.31Å; R776-D780 PolarHBondContact O-N 2.92Å
777	A	92.8	Very high	90.5	Very high	31 Å²	31	54.5 Å²	54.5	26%	0.256	27%	0.274	S	S	.	.	H	α-helix	trans	-58.9	-33.9	176.7	0	0	0	0	0	112.7	N773 Q774 Q781 I857	N773-A777 PolarHBondContact O-N 3.33Å; Q774-A777 WeakPolarHBondContact O-CB 3.44Å; Q774-A777 PolarHBondContact O-N 3.5Å; A777-Q781 VanDerWaalsContact O-CB 3.26Å; A777-Q781 WeakPolarHBondContact O-CB 3.48Å; A777-Q781 PolarHBondContact O-N 3.36Å; A777-I857 HydrophobicContact CB-CD1 4.13Å; A777-I857 HydrophobicContact CB-CG1 4.46Å; A777-I857 HydrophobicContact CB-CG2 3.98Å
778	V	92.9	Very high	90.9	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-64.7	-40.9	170.1	177.4	0	0	0	0	112	F714 Q774 L775 R776 Q781 I782 Y854 I857 V858	F714-V778 HydrophobicContact CD1-CG1 3.88Å; F714-V778 HydrophobicContact CE1-CB 4.27Å; F714-V778 HydrophobicContact CE1-CG1 3.7Å; F714-V778 HydrophobicContact CE1-CG2 4.25Å; F714-V778 HydrophobicContact CZ-CG1 4.45Å; F714-V778 HydrophobicContact CZ-CG2 4.22Å; Q774-V778 PolarHBondContact O-N 3.33Å; L775-V778 PolarHBondContact O-N 2.92Å; R776-V778 PolarHBondContact O-N 3.49Å; V778-Q781 PolarHBondContact O-N 3.37Å; V778-I782 HydrophobicContact CG1-CD1 4.12Å; V778-I782 WeakPolarHBondContact O-CG1 3.4Å; V778-I782 PolarHBondContact O-N 3.48Å; V778-I782 VanDerWaalsContact O-N 3.09Å; V778-Y854 HydrophobicContact CG1-CD2 4.5Å; V778-Y854 HydrophobicContact CG1-CE2 3.96Å; V778-I857 HydrophobicContact CG2-CB 4.46Å; V778-I857 HydrophobicContact CG2-CG2 3.48Å; V778-I857 VanDerWaalsContact CG2-CG2 3.48Å; V778-V858 HydrophobicContact CG2-CG2 4.34Å
779	F	92.3	Very high	91.1	Very high	17 Å²	17	46.1 Å²	46.1	8%	0.075	23%	0.229	C	C	.	.	H	α-helix	trans	-66.1	-43.5	178.1	-67.3	2.8	0	0	0	111.4	R669 A670 M673 I715 L775 R776 Q781 I782 I783	R669-F779 HydrophobicContact CB-CD2 4.41Å; R669-F779 HydrophobicContact CB-CE2 4.18Å; A670-F779 HydrophobicContact CB-CE2 4.4Å; A670-F779 HydrophobicContact CB-CZ 3.98Å; M673-F779 HydrophobicContact CE-CB 4.43Å; M673-F779 HydrophobicContact CG-CB 3.93Å; M673-F779 HydrophobicContact CG-CD1 3.62Å; M673-F779 HydrophobicContact CG-CD2 3.98Å; M673-F779 HydrophobicContact CG-CE1 4.05Å; M673-F779 HydrophobicContact CG-CE2 4.37Å; M673-F779 HydrophobicContact CG-CG 3.57Å; M673-F779 HydrophobicContact CG-CZ 4.39Å; M673-F779 HydrophobicContact SD-CB 3.83Å; M673-F779 HydrophobicContact SD-CG 4.18Å; I715-F779 HydrophobicContact CD1-CD1 4.09Å; I715-F779 HydrophobicContact CD1-CE1 3.67Å; L775-F779 HydrophobicContact CD2-CD1 4.33Å; L775-F779 HydrophobicContact CD2-CD2 4.15Å; L775-F779 HydrophobicContact CD2-CE1 3.77Å; L775-F779 HydrophobicContact CD2-CE2 3.57Å; L775-F779 HydrophobicContact CD2-CZ 3.37Å; L775-F779 HydrophobicContact CG-CE1 4.02Å; L775-F779 HydrophobicContact CG-CZ 4.05Å; L775-F779 VanDerWaalsContact O-CD1 3.3Å; L775-F779 WeakPolarHBondContact O-CD1 3.3Å; L775-F779 WeakPolarHBondContact O-CG 3.46Å; L775-F779 PolarHBondContact O-N 3.48Å; L775-F779 VanDerWaalsContact O-N 3.12Å; R776-F779 CarbonylContact O-C 3.6Å; R776-F779 WeakPolarHBondContact O-CA 3.32Å; R776-F779 WeakPolarHBondContact O-CB 3.43Å; R776-F779 PolarHBondContact O-N 3.31Å; F779-Q781 VanDerWaalsContact C-N 3.29Å; F779-Q781 PolarHBondContact O-N 2.9Å; F779-I782 WeakPolarHBondContact O-CB 3.46Å; F779-I782 PolarHBondContact O-N 3.35Å; F779-I783 PolarHBondContact O-N 3.16Å
780	D	92.1	Very high	91.2	Very high	102 Å²	102	41.5 Å²	41.5	55%	0.545	22%	0.217	S	C	.	.	H	α-helix	trans	-61.6	-40	175.6	-58.4	-35.8	0	0	0	110.8	R776 I782 I783 E784	R776-D780 VanDerWaalsContact O-CG 3.31Å; R776-D780 PolarHBondContact O-N 2.92Å; D780-I782 VanDerWaalsContact C-N 3.32Å; D780-I782 PolarHBondContact O-N 2.96Å; D780-I783 PolarHBondContact O-N 3.21Å; D780-I783 VanDerWaalsContact O-N 3.16Å; D780-E784 PolarHBondContact O-N 3.27Å
781	Q	93	Very high	91.4	Very high	11 Å²	11	41.2 Å²	41.2	5%	0.051	21%	0.214	C	C	.	.	H	α-helix	trans	-65.8	-30.4	176.8	-168.5	65.2	91.7	0	0	113.6	M711 A777 V778 F779 E784 L785 Y854 I857	M711-Q781 HydrophobicContact CE-CG 3.94Å; A777-Q781 VanDerWaalsContact O-CB 3.26Å; A777-Q781 WeakPolarHBondContact O-CB 3.48Å; A777-Q781 PolarHBondContact O-N 3.36Å; V778-Q781 PolarHBondContact O-N 3.37Å; F779-Q781 VanDerWaalsContact C-N 3.29Å; F779-Q781 PolarHBondContact O-N 2.9Å; Q781-E784 PolarHBondContact NE2-OE2 3.09Å; Q781-L785 WeakPolarHBondContact O-CB 3.42Å; Q781-L785 PolarHBondContact O-N 3.37Å; Q781-Y854 HydrophobicContact CG-CD2 4.29Å; Q781-I857 HydrophobicContact CB-CD1 4.43Å
782	I	93.9	Very high	91.4	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-69.4	-39.4	172.4	-71.1	159.9	0	0	0	110.8	M673 I676 L677 M711 I715 V778 F779 D780 L785 Q786	M673-I782 HydrophobicContact CB-CD1 4.29Å; M673-I782 HydrophobicContact CG-CD1 4.34Å; M673-I782 HydrophobicContact SD-CB 3.98Å; M673-I782 HydrophobicContact SD-CD1 4.32Å; M673-I782 HydrophobicContact SD-CG2 3.85Å; I676-I782 HydrophobicContact CG2-CG2 4.17Å; L677-I782 HydrophobicContact CD1-CD1 4.11Å; L677-I782 HydrophobicContact CD1-CG2 4.44Å; L677-I782 HydrophobicContact CD2-CG2 3.94Å; L677-I782 HydrophobicContact CG-CG2 3.94Å; M711-I782 HydrophobicContact CB-CG1 4.38Å; M711-I782 HydrophobicContact CE-CG1 4.46Å; M711-I782 HydrophobicContact CG-CG1 4.24Å; M711-I782 HydrophobicContact SD-CB 4.41Å; M711-I782 HydrophobicContact SD-CG1 3.62Å; I715-I782 HydrophobicContact CD1-CD1 3.76Å; I715-I782 HydrophobicContact CG1-CD1 3.68Å; V778-I782 HydrophobicContact CG1-CD1 4.12Å; V778-I782 WeakPolarHBondContact O-CG1 3.4Å; V778-I782 PolarHBondContact O-N 3.48Å; V778-I782 VanDerWaalsContact O-N 3.09Å; F779-I782 WeakPolarHBondContact O-CB 3.46Å; F779-I782 PolarHBondContact O-N 3.35Å; D780-I782 VanDerWaalsContact C-N 3.32Å; D780-I782 PolarHBondContact O-N 2.96Å; I782-L785 PolarHBondContact O-N 3.31Å; I782-Q786 PolarHBondContact O-N 3.41Å
783	I	91.3	Very high	91.3	Very high	44 Å²	44	40.7 Å²	40.7	23%	0.226	21%	0.21	C	C	.	.	H	α-helix	trans	-68.1	-41.3	175.8	-62.1	168.8	0	0	0	110.5	M673 F779 D780 L785 Q786 N787	M673-I783 HydrophobicContact CE-CD1 3.96Å; M673-I783 HydrophobicContact CE-CG1 4.04Å; M673-I783 HydrophobicContact SD-CG1 4.33Å; F779-I783 PolarHBondContact O-N 3.16Å; D780-I783 PolarHBondContact O-N 3.21Å; D780-I783 VanDerWaalsContact O-N 3.16Å; I783-L785 VanDerWaalsContact C-N 3.33Å; I783-L785 PolarHBondContact O-N 3.1Å; I783-Q786 WeakPolarHBondContact O-CB 3.39Å; I783-Q786 PolarHBondContact O-N 3.15Å; I783-N787 PolarHBondContact O-N 3.04Å; I783-N787 PolarHBondContact O-ND2 3.14Å
784	E	92.3	Very high	91.3	Very high	96 Å²	96	43.4 Å²	43.4	45%	0.449	21%	0.214	S	C	.	.	H	α-helix	trans	-61.3	-41.9	173.7	-166.7	-175.4	-168.1	0	0	111.5	D780 Q781 Q786 N787 A788 L850	D780-E784 PolarHBondContact O-N 3.27Å; Q781-E784 PolarHBondContact NE2-OE2 3.09Å; E784-Q786 PolarHBondContact O-N 2.8Å; E784-N787 PolarHBondContact O-N 2.33Å; E784-A788 WeakPolarHBondContact O-CB 3.32Å; E784-A788 PolarHBondContact O-N 2.38Å; E784-L850 HydrophobicContact CB-CD2 4.34Å; E784-L850 HydrophobicContact CG-CD2 3.68Å; E784-L850 VanDerWaalsContact OE2-CD2 3.23Å; E784-L850 WeakPolarHBondContact OE2-CD2 3.09Å
785	L	91.4	Very high	91.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-60.7	-44.1	174.2	-179.2	62	0	0	0	111.7	L707 M711 Q781 I782 I783 N787 A788 Q789 L847 L850	L707-L785 HydrophobicContact CD2-CD1 3.7Å; L707-L785 HydrophobicContact CD2-CD2 4.11Å; L707-L785 HydrophobicContact CG-CD1 4.46Å; L707-L785 HydrophobicContact CG-CD2 4.01Å; M711-L785 HydrophobicContact CE-CB 4.2Å; M711-L785 HydrophobicContact CE-CD2 3.9Å; M711-L785 HydrophobicContact SD-CB 4.27Å; M711-L785 HydrophobicContact SD-CD2 3.35Å; M711-L785 WeakPolarHBondContact SD-CD2 3.46Å; M711-L785 HydrophobicContact SD-CG 4.43Å; Q781-L785 WeakPolarHBondContact O-CB 3.42Å; Q781-L785 PolarHBondContact O-N 3.37Å; I782-L785 PolarHBondContact O-N 3.31Å; I783-L785 VanDerWaalsContact C-N 3.33Å; I783-L785 PolarHBondContact O-N 3.1Å; L785-N787 PolarHBondContact O-N 3.01Å; L785-A788 PolarHBondContact O-N 3.47Å; L785-Q789 HydrophobicContact CD1-CG 3.91Å; L785-Q789 HydrophobicContact CG-CG 4.15Å; L785-Q789 VanDerWaalsContact O-CB 3.28Å; L785-Q789 WeakPolarHBondContact O-CB 3.49Å; L785-Q789 WeakPolarHBondContact O-CG 3.45Å; L785-Q789 PolarHBondContact O-N 3.39Å; L785-L847 HydrophobicContact CD1-CD2 4.14Å; L785-L850 HydrophobicContact CD1-CD1 4.08Å
786	Q	92.4	Very high	91.1	Very high	48 Å²	48	43.6 Å²	43.6	22%	0.224	22%	0.222	C	C	.	.	H	α-helix	trans	-56.4	-50.1	176.3	-169.4	-172.6	-12.4	0	0	111.1	I676 I680 I782 I783 E784 A788 Q789 D790	I676-Q786 HydrophobicContact CG2-CB 4.29Å; I676-Q786 HydrophobicContact CG2-CG 4.29Å; I676-Q786 VanDerWaalsContact CG2-OE1 3.24Å; I680-Q786 HydrophobicContact CD1-CB 3.97Å; I680-Q786 HydrophobicContact CD1-CG 4.13Å; I680-Q786 HydrophobicContact CG1-CG 4.25Å; I782-Q786 PolarHBondContact O-N 3.41Å; I783-Q786 WeakPolarHBondContact O-CB 3.39Å; I783-Q786 PolarHBondContact O-N 3.15Å; E784-Q786 PolarHBondContact O-N 2.8Å; Q786-A788 PolarHBondContact O-N 2.98Å; Q786-Q789 PolarHBondContact O-N 3.39Å; Q786-D790 PolarHBondContact O-N 3.47Å
787	N	91.2	Very high	90.9	Very high	100 Å²	100	39.5 Å²	39.5	54%	0.535	21%	0.21	S	C	.	.	H	α-helix	trans	-63.3	-41.6	-178.5	-69.2	-36.8	0	0	0	112.2	I783 E784 L785 A791	I783-N787 PolarHBondContact O-N 3.04Å; I783-N787 PolarHBondContact O-ND2 3.14Å; E784-N787 PolarHBondContact O-N 2.33Å; L785-N787 PolarHBondContact O-N 3.01Å; N787-A791 PolarHBondContact O-N 3.03Å; N787-A791 VanDerWaalsContact O-N 3.14Å
788	A	90.9	Very high	90.7	Very high	5 Å²	5	42.2 Å²	42.2	4%	0.041	22%	0.218	C	C	.	.	H	α-helix	trans	-65.3	-42.1	175.4	0	0	0	0	0	111.9	E784 L785 Q786 A791 I792 L850	E784-A788 WeakPolarHBondContact O-CB 3.32Å; E784-A788 PolarHBondContact O-N 2.38Å; L785-A788 PolarHBondContact O-N 3.47Å; Q786-A788 PolarHBondContact O-N 2.98Å; A788-A791 PolarHBondContact O-N 3.35Å; A788-I792 VanDerWaalsContact O-CB 3.27Å; A788-I792 WeakPolarHBondContact O-CB 3.45Å; A788-I792 VanDerWaalsContact O-CG1 3.25Å; A788-I792 WeakPolarHBondContact O-CG1 3.26Å; A788-I792 PolarHBondContact O-N 3.09Å; A788-L850 HydrophobicContact CB-CD1 3.66Å
789	Q	89.3	Confident	90.5	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.009	22%	0.218	C	C	.	.	H	α-helix	trans	-62.3	-47.7	176	-77.5	173.4	-16.1	0	0	112.1	H684 C704 L785 Q786 A791 I792 Y793	H684-Q789 PolarHBondContact NE2-NE2 3.43Å; C704-Q789 VanDerWaalsContact SG-CG 3.56Å; C704-Q789 PolarHBondContact SG-NE2 3.17Å; L785-Q789 HydrophobicContact CD1-CG 3.91Å; L785-Q789 HydrophobicContact CG-CG 4.15Å; L785-Q789 VanDerWaalsContact O-CB 3.28Å; L785-Q789 WeakPolarHBondContact O-CB 3.49Å; L785-Q789 WeakPolarHBondContact O-CG 3.45Å; L785-Q789 PolarHBondContact O-N 3.39Å; Q786-Q789 PolarHBondContact O-N 3.39Å; Q789-A791 VanDerWaalsContact C-N 3.31Å; Q789-A791 PolarHBondContact O-N 2.93Å; Q789-I792 PolarHBondContact O-N 2.89Å; Q789-Y793 HydrophobicContact CB-CD2 4.2Å; Q789-Y793 HydrophobicContact CB-CE2 4.15Å; Q789-Y793 WeakPolarHBondContact O-CB 3.36Å; Q789-Y793 WeakPolarHBondContact O-CD2 3.47Å; Q789-Y793 PolarHBondContact O-N 3.22Å
790	D	89.1	Confident	90.3	Very high	72 Å²	72	42.3 Å²	42.3	39%	0.385	22%	0.219	S	C	.	.	H	α-helix	trans	-65.6	-33.9	-179.6	-77.5	-21.1	0	0	0	112	Q786 R794	Q786-D790 PolarHBondContact O-N 3.47Å; D790-R794 VanDerWaalsContact O-CB 3.24Å; D790-R794 WeakPolarHBondContact O-CB 3.43Å; D790-R794 PolarHBondContact O-N 3.22Å
791	A	90.5	Very high	90.2	Very high	47 Å²	47	43 Å²	43	39%	0.388	22%	0.219	S	C	.	.	H	α-helix	trans	-66.5	-46.8	170.5	0	0	0	0	0	112.3	N787 A788 Q789 Y793 R794 A795	N787-A791 PolarHBondContact O-N 3.03Å; N787-A791 VanDerWaalsContact O-N 3.14Å; A788-A791 PolarHBondContact O-N 3.35Å; Q789-A791 VanDerWaalsContact C-N 3.31Å; Q789-A791 PolarHBondContact O-N 2.93Å; A791-Y793 PolarHBondContact O-N 2.9Å; A791-R794 PolarHBondContact O-N 3.39Å; A791-A795 PolarHBondContact O-N 3.16Å; A791-A795 VanDerWaalsContact O-N 3.16Å
792	I	89.3	Confident	90	Very high	5 Å²	5	47.3 Å²	47.3	3%	0.026	24%	0.235	C	C	.	.	H	α-helix	trans	-59.6	-44.2	177.2	-81.1	171.1	0	0	0	111.5	F697 V700 A788 Q789 A796 M843 L847	F697-I792 HydrophobicContact CE2-CG2 4.33Å; F697-I792 HydrophobicContact CZ-CG2 3.74Å; V700-I792 HydrophobicContact CG1-CG2 4.2Å; A788-I792 VanDerWaalsContact O-CB 3.27Å; A788-I792 WeakPolarHBondContact O-CB 3.45Å; A788-I792 VanDerWaalsContact O-CG1 3.25Å; A788-I792 WeakPolarHBondContact O-CG1 3.26Å; A788-I792 PolarHBondContact O-N 3.09Å; Q789-I792 PolarHBondContact O-N 2.89Å; I792-A796 WeakPolarHBondContact O-CB 3.35Å; I792-A796 PolarHBondContact O-N 3.42Å; I792-A796 VanDerWaalsContact O-N 3.16Å; I792-M843 HydrophobicContact CB-CE 4.07Å; I792-M843 HydrophobicContact CD1-CB 4.3Å; I792-M843 HydrophobicContact CG1-CB 4.26Å; I792-M843 HydrophobicContact CG1-CE 3.97Å; I792-M843 HydrophobicContact CG1-CG 4.31Å; I792-M843 HydrophobicContact CG2-CE 3.99Å; I792-M843 WeakPolarHBondContact O-CE 3.45Å; I792-L847 HydrophobicContact CD1-CD1 4.1Å; I792-L847 HydrophobicContact CD1-CD2 4.02Å; I792-L847 HydrophobicContact CD1-CG 3.85Å
793	Y	88.8	Confident	89.8	Confident	10 Å²	10	49.3 Å²	49.3	4%	0.039	24%	0.242	C	C	.	.	H	α-helix	trans	-73.1	-37.1	179.6	-75.3	-54.5	0	0	0	112.8	H684 N687 L691 F697 L701 Q789 A791 A796 L797	H684-Y793 AromaticContact CD2-CE2 3.69Å; H684-Y793 AromaticContact CD2-CZ 3.73Å; H684-Y793 PolarHBondContact CD2-OH 3.05Å; H684-Y793 AromaticContact NE2-CE2 3.93Å; H684-Y793 PolarHBondContact NE2-OH 3.41Å; N687-Y793 HydrophobicContact CB-CD1 3.87Å; N687-Y793 HydrophobicContact CB-CE1 3.79Å; N687-Y793 VanDerWaalsContact ND2-CD1 3.28Å; N687-Y793 WeakPolarHBondContact ND2-CD1 3.08Å; L691-Y793 HydrophobicContact CD1-CD1 4.11Å; L691-Y793 HydrophobicContact CD1-CE1 4.28Å; F697-Y793 HydrophobicContact CE1-CE1 4.32Å; L701-Y793 HydrophobicContact CD2-CE1 3.63Å; Q789-Y793 HydrophobicContact CB-CD2 4.2Å; Q789-Y793 HydrophobicContact CB-CE2 4.15Å; Q789-Y793 WeakPolarHBondContact O-CB 3.36Å; Q789-Y793 WeakPolarHBondContact O-CD2 3.47Å; Q789-Y793 PolarHBondContact O-N 3.22Å; A791-Y793 PolarHBondContact O-N 2.9Å; Y793-A796 PolarHBondContact O-N 3.33Å; Y793-L797 VanDerWaalsContact O-CB 3.28Å; Y793-L797 WeakPolarHBondContact O-CB 3.45Å; Y793-L797 VanDerWaalsContact O-CG 3.24Å; Y793-L797 WeakPolarHBondContact O-CG 3.4Å; Y793-L797 PolarHBondContact O-N 3.25Å
794	R	89.9	Confident	89.6	Confident	145 Å²	145	50.5 Å²	50.5	55%	0.547	25%	0.249	S	C	.	.	H	α-helix	trans	-59.7	-50.5	175	-170.4	179.1	-57	104.1	8.3	111.1	D790 A791 A796 L797 E798	D790-R794 VanDerWaalsContact O-CB 3.24Å; D790-R794 WeakPolarHBondContact O-CB 3.43Å; D790-R794 PolarHBondContact O-N 3.22Å; A791-R794 PolarHBondContact O-N 3.39Å; R794-A796 PolarHBondContact O-N 3.45Å; R794-L797 PolarHBondContact O-N 3.11Å; R794-E798 WeakPolarHBondContact O-CG 3.49Å; R794-E798 PolarHBondContact O-N 3.2Å
795	A	88.6	Confident	89.5	Confident	41 Å²	41	50.1 Å²	50.1	34%	0.339	25%	0.247	S	C	.	.	H	α-helix	trans	-59.7	-42.6	177.3	0	0	0	0	0	112.8	A791 E799 M843	A791-A795 PolarHBondContact O-N 3.16Å; A791-A795 VanDerWaalsContact O-N 3.16Å; A795-E799 WeakPolarHBondContact O-CB 3.49Å; A795-E799 PolarHBondContact O-N 2.95Å; A795-M843 HydrophobicContact CB-CE 4.35Å
796	A	89	Confident	89.3	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-71.2	-33.7	179.5	0	0	0	0	0	113.6	L691 M694 F697 I792 Y793 R794 L800 F836	L691-A796 HydrophobicContact CD1-CB 4.28Å; L691-A796 HydrophobicContact CD2-CB 3.95Å; L691-A796 WeakPolarHBondContact CD2-O 3.47Å; M694-A796 WeakPolarHBondContact CE-O 3.33Å; F697-A796 HydrophobicContact CD1-CB 4.33Å; F697-A796 HydrophobicContact CD2-CB 4.32Å; F697-A796 HydrophobicContact CE1-CB 3.86Å; F697-A796 HydrophobicContact CE2-CB 3.85Å; F697-A796 HydrophobicContact CZ-CB 3.6Å; I792-A796 WeakPolarHBondContact O-CB 3.35Å; I792-A796 PolarHBondContact O-N 3.42Å; I792-A796 VanDerWaalsContact O-N 3.16Å; Y793-A796 PolarHBondContact O-N 3.33Å; R794-A796 PolarHBondContact O-N 3.45Å; A796-L800 WeakPolarHBondContact O-CB 3.43Å; A796-L800 PolarHBondContact O-N 3.03Å; A796-F836 HydrophobicContact CB-CZ 4.35Å
797	L	88.6	Confident	89	Confident	53 Å²	53	54.2 Å²	54.2	28%	0.277	27%	0.265	S	S	.	.	H	α-helix	trans	-77.5	-38.2	178.2	-72.4	170.7	0	0	0	112.3	L690 L691 Y793 R794 E799 L800 Q801	L690-L797 HydrophobicContact CB-CD2 4.44Å; L690-L797 HydrophobicContact CD1-CD2 4.22Å; L691-L797 HydrophobicContact CD2-CD2 4.22Å; L691-L797 HydrophobicContact CG-CD2 4.29Å; Y793-L797 VanDerWaalsContact O-CB 3.28Å; Y793-L797 WeakPolarHBondContact O-CB 3.45Å; Y793-L797 VanDerWaalsContact O-CG 3.24Å; Y793-L797 WeakPolarHBondContact O-CG 3.4Å; Y793-L797 PolarHBondContact O-N 3.25Å; R794-L797 PolarHBondContact O-N 3.11Å; L797-E799 VanDerWaalsContact C-N 3.33Å; L797-L800 HydrophobicContact CD2-CD2 4.34Å; L797-L800 PolarHBondContact O-N 3.43Å; L797-Q801 WeakPolarHBondContact O-CB 3.42Å; L797-Q801 PolarHBondContact O-N 2.82Å
798	E	88.9	Confident	88.9	Confident	89 Å²	89	55.4 Å²	55.4	42%	0.416	27%	0.267	S	S	.	.	H	α-helix	trans	-59.1	-46.1	170.6	-75.5	178.8	-145.9	0	0	111.2	R794 Q801 R802	R794-E798 WeakPolarHBondContact O-CG 3.49Å; R794-E798 PolarHBondContact O-N 3.2Å; E798-Q801 PolarHBondContact O-N 3.46Å; E798-R802 VanDerWaalsContact O-CG 3.32Å; E798-R802 WeakPolarHBondContact O-CG 3.19Å; E798-R802 PolarHBondContact O-N 3.19Å; E798-R802 IonicContact OE2-NH2 2.82Å; E798-R802 PolarHBondContact OE2-NH2 2.85Å
799	E	87.6	Confident	88.7	Confident	3 Å²	3	61.5 Å²	61.5	1%	0.014	29%	0.293	C	S	.	.	H	α-helix	trans	-64.3	-42.3	178.2	178.7	63	-174.6	0	0	112.2	M694 A795 L797 Q801 R802 R803 F836	M694-E799 HydrophobicContact CE-CG 4.37Å; M694-E799 HydrophobicContact SD-CG 4.18Å; A795-E799 WeakPolarHBondContact O-CB 3.49Å; A795-E799 PolarHBondContact O-N 2.95Å; L797-E799 VanDerWaalsContact C-N 3.33Å; E799-Q801 VanDerWaalsContact C-N 3.3Å; E799-Q801 PolarHBondContact O-N 3.18Å; E799-R802 PolarHBondContact O-N 2.87Å; E799-R802 IonicContact OE2-CZ 2.6Å; E799-R802 IonicContact OE2-NH1 3.43Å; E799-R802 PolarHBondContact OE2-NH1 3.48Å; E799-R803 WeakPolarHBondContact O-CG 3.33Å; E799-R803 PolarHBondContact O-N 2.74Å; E799-R803 VanDerWaalsContact O-N 3.08Å; E799-R803 IonicContact OE1-CZ 3.19Å; E799-R803 VanDerWaalsContact OE1-CZ 3.23Å; E799-R803 IonicContact OE1-NE 3.15Å; E799-R803 PolarHBondContact OE1-NE 3.15Å; E799-R803 IonicContact OE1-NH2 2.62Å; E799-R803 PolarHBondContact OE1-NH2 2.79Å; E799-F836 HydrophobicContact CB-CD2 4.04Å; E799-F836 HydrophobicContact CB-CE2 4.01Å; E799-F836 HydrophobicContact CG-CB 4.32Å; E799-F836 HydrophobicContact CG-CD1 4.15Å; E799-F836 HydrophobicContact CG-CD2 3.77Å; E799-F836 HydrophobicContact CG-CE1 4.4Å; E799-F836 HydrophobicContact CG-CE2 4.06Å; E799-F836 HydrophobicContact CG-CG 3.82Å; E799-F836 HydrophobicContact CG-CZ 4.37Å
800	L	88.6	Confident	88.6	Confident	15 Å²	15	64.6 Å²	64.6	8%	0.079	31%	0.306	C	S	.	.	H	α-helix	trans	-57.4	-43.9	172.1	-179.4	69.8	0	0	0	111.5	L690 L691 N693 M694 A796 L797 R803 L804	L690-L800 HydrophobicContact CB-CD2 4.09Å; L690-L800 WeakPolarHBondContact O-CD2 3.49Å; L691-L800 HydrophobicContact CD2-CB 4.15Å; L691-L800 HydrophobicContact CD2-CD2 4.08Å; N693-L800 HydrophobicContact CB-CD1 4.3Å; M694-L800 HydrophobicContact CE-CB 4.25Å; M694-L800 HydrophobicContact CG-CD1 4.3Å; A796-L800 WeakPolarHBondContact O-CB 3.43Å; A796-L800 PolarHBondContact O-N 3.03Å; L797-L800 HydrophobicContact CD2-CD2 4.34Å; L797-L800 PolarHBondContact O-N 3.43Å; L800-R803 PolarHBondContact O-N 3.23Å; L800-L804 HydrophobicContact CD1-CD1 4.48Å; L800-L804 HydrophobicContact CG-CD1 4.09Å; L800-L804 WeakPolarHBondContact O-CG 3.47Å; L800-L804 PolarHBondContact O-N 2.85Å
801	Q	90.3	Very high	88.4	Confident	117 Å²	117	65.8 Å²	65.8	55%	0.547	31%	0.308	S	S	.	.	H	α-helix	trans	-64.9	-39.9	-180	-175.3	174.2	-8.5	0	0	112	L797 E798 E799 L804 Q805	L797-Q801 WeakPolarHBondContact O-CB 3.42Å; L797-Q801 PolarHBondContact O-N 2.82Å; E798-Q801 PolarHBondContact O-N 3.46Å; E799-Q801 VanDerWaalsContact C-N 3.3Å; E799-Q801 PolarHBondContact O-N 3.18Å; Q801-L804 PolarHBondContact O-N 3.08Å; Q801-Q805 VanDerWaalsContact O-CG 3.29Å; Q801-Q805 WeakPolarHBondContact O-CG 3.14Å; Q801-Q805 PolarHBondContact O-N 3.31Å
802	R	88.3	Confident	88.2	Confident	102 Å²	102	68.2 Å²	68.2	39%	0.385	31%	0.312	S	S	.	.	H	α-helix	trans	-61.3	-47.1	174.2	-65.4	166.5	-149	153.7	-3.5	111.6	E798 E799 L804 Q805 F806	E798-R802 VanDerWaalsContact O-CG 3.32Å; E798-R802 WeakPolarHBondContact O-CG 3.19Å; E798-R802 PolarHBondContact O-N 3.19Å; E798-R802 IonicContact OE2-NH2 2.82Å; E798-R802 PolarHBondContact OE2-NH2 2.85Å; E799-R802 PolarHBondContact O-N 2.87Å; E799-R802 IonicContact OE2-CZ 2.6Å; E799-R802 IonicContact OE2-NH1 3.43Å; E799-R802 PolarHBondContact OE2-NH1 3.48Å; R802-L804 PolarHBondContact O-N 3.49Å; R802-Q805 PolarHBondContact O-N 3.26Å; R802-F806 PolarHBondContact O-N 2.93Å
803	R	88.9	Confident	87.9	Confident	42 Å²	42	70.9 Å²	70.9	16%	0.158	32%	0.321	C	S	.	.	H	α-helix	trans	-62.9	-41.1	179.5	-68.2	-179.9	-166.9	-165	6.4	112.1	M694 E696 E799 L800 F806 E807	M694-R803 VanDerWaalsContact SD-CZ 3.52Å; M694-R803 PolarHBondContact SD-NH1 3.37Å; E696-R803 IonicContact OE2-NH1 2.8Å; E799-R803 WeakPolarHBondContact O-CG 3.33Å; E799-R803 PolarHBondContact O-N 2.74Å; E799-R803 VanDerWaalsContact O-N 3.08Å; E799-R803 IonicContact OE1-CZ 3.19Å; E799-R803 VanDerWaalsContact OE1-CZ 3.23Å; E799-R803 IonicContact OE1-NE 3.15Å; E799-R803 PolarHBondContact OE1-NE 3.15Å; E799-R803 IonicContact OE1-NH2 2.62Å; E799-R803 PolarHBondContact OE1-NH2 2.79Å; L800-R803 PolarHBondContact O-N 3.23Å; R803-F806 PolarHBondContact O-N 3.14Å; R803-E807 PolarHBondContact O-N 3Å
804	L	88.8	Confident	87.6	Confident	69 Å²	69	75.3 Å²	75.3	36%	0.361	34%	0.343	S	S	.	.	H	α-helix	trans	-63.4	-44.6	174.6	-71	170.3	0	0	0	111.9	L800 Q801 R802 F806 E807 E808	L800-L804 HydrophobicContact CD1-CD1 4.48Å; L800-L804 HydrophobicContact CG-CD1 4.09Å; L800-L804 WeakPolarHBondContact O-CG 3.47Å; L800-L804 PolarHBondContact O-N 2.85Å; Q801-L804 PolarHBondContact O-N 3.08Å; R802-L804 PolarHBondContact O-N 3.49Å; L804-F806 VanDerWaalsContact C-N 3.27Å; L804-F806 PolarHBondContact O-N 3.4Å; L804-E807 PolarHBondContact O-N 3.48Å; L804-E808 WeakPolarHBondContact O-CG 3.29Å; L804-E808 PolarHBondContact O-N 2.83Å
805	Q	89.4	Confident	87.3	Confident	87 Å²	87	74.7 Å²	74.7	41%	0.407	35%	0.349	S	S	.	.	H	α-helix	trans	-62.5	-32.1	175.6	-73.6	173.7	-8.3	0	0	113	Q801 R802 K809	Q801-Q805 VanDerWaalsContact O-CG 3.29Å; Q801-Q805 WeakPolarHBondContact O-CG 3.14Å; Q801-Q805 PolarHBondContact O-N 3.31Å; R802-Q805 PolarHBondContact O-N 3.26Å; Q805-K809 WeakPolarHBondContact O-CB 3.45Å; Q805-K809 VanDerWaalsContact O-CG 3.26Å; Q805-K809 WeakPolarHBondContact O-CG 3.25Å; Q805-K809 PolarHBondContact O-N 3.25Å
806	F	87.5	Confident	87.2	Confident	45 Å²	45	77.7 Å²	77.7	20%	0.197	36%	0.356	C	S	.	.	H	α-helix	trans	-70.4	-43	173.3	-174.7	-100.8	0	0	0	111.7	R802 R803 L804 E808 K809 K810 V821 E825 E829	R802-F806 PolarHBondContact O-N 2.93Å; R803-F806 PolarHBondContact O-N 3.14Å; L804-F806 VanDerWaalsContact C-N 3.27Å; L804-F806 PolarHBondContact O-N 3.4Å; F806-E808 VanDerWaalsContact C-N 3.34Å; F806-E808 PolarHBondContact O-N 3.03Å; F806-K809 PolarHBondContact O-N 2.63Å; F806-K810 PolarHBondContact O-N 2.65Å; F806-V821 HydrophobicContact CE2-CG1 4.32Å; F806-V821 HydrophobicContact CZ-CG1 3.79Å; F806-E825 HydrophobicContact CE2-CB 4.38Å; F806-E829 HydrophobicContact CD1-CG 3.93Å; F806-E829 WeakPolarHBondContact CD2-OE2 3.48Å; F806-E829 HydrophobicContact CE1-CB 4.09Å; F806-E829 HydrophobicContact CE1-CG 3.78Å; F806-E829 HydrophobicContact CE2-CB 4.19Å; F806-E829 HydrophobicContact CE2-CG 4.46Å; F806-E829 HydrophobicContact CG-CG 4.33Å; F806-E829 VanDerWaalsContact CG-OE2 3.3Å; F806-E829 WeakPolarHBondContact CG-OE2 3.41Å; F806-E829 HydrophobicContact CZ-CB 3.84Å; F806-E829 HydrophobicContact CZ-CG 4.04Å
807	E	86.6	Confident	86.7	Confident	90 Å²	90	81 Å²	81	42%	0.421	39%	0.389	S	S	.	.	H	α-helix	trans	-64	-37.3	175.6	-158.1	-168.3	140.2	0	0	112.2	R803 L804 K811	R803-E807 PolarHBondContact O-N 3Å; L804-E807 PolarHBondContact O-N 3.48Å; E807-K811 WeakPolarHBondContact O-CG 3.48Å; E807-K811 PolarHBondContact O-N 2.85Å; E807-K811 VanDerWaalsContact O-N 3.17Å; E807-K811 VanDerWaalsContact OE1-CE 3.31Å; E807-K811 WeakPolarHBondContact OE1-CE 3.5Å; E807-K811 IonicContact OE1-NZ 3.06Å; E807-K811 PolarHBondContact OE1-NZ 3.2Å
808	E	88.3	Confident	86	Confident	124 Å²	124	83.7 Å²	83.7	58%	0.579	40%	0.401	S	S	*	.	H	α-helix	trans	-64.4	-46.7	172.2	-73.8	173.6	166.9	0	0	111.9	L804 F806 K810 K811 Q812	L804-E808 WeakPolarHBondContact O-CG 3.29Å; L804-E808 PolarHBondContact O-N 2.83Å; F806-E808 VanDerWaalsContact C-N 3.34Å; F806-E808 PolarHBondContact O-N 3.03Å; E808-K810 VanDerWaalsContact C-N 3.32Å; E808-K810 PolarHBondContact O-N 3.23Å; E808-K811 PolarHBondContact O-N 3.38Å; E808-Q812 WeakPolarHBondContact O-CB 3.47Å; E808-Q812 PolarHBondContact O-N 3.25Å
809	K	87.3	Confident	84.7	Confident	134 Å²	134	91.8 Å²	91.8	58%	0.583	43%	0.427	S	S	*	.	H	α-helix	trans	-59.8	-40	175.1	-76.6	170.5	-179	179.5	0	112.7	Q805 F806 Q812 R813	Q805-K809 WeakPolarHBondContact O-CB 3.45Å; Q805-K809 VanDerWaalsContact O-CG 3.26Å; Q805-K809 WeakPolarHBondContact O-CG 3.25Å; Q805-K809 PolarHBondContact O-N 3.25Å; F806-K809 PolarHBondContact O-N 2.63Å; K809-Q812 PolarHBondContact O-N 2.82Å; K809-R813 PolarHBondContact O-N 2.88Å
810	K	85.8	Confident	83.6	Confident	66 Å²	66	92 Å²	92	29%	0.287	43%	0.43	S	S	.	.	H	α-helix	trans	-60.3	-51.1	176.4	-177.2	167.3	-170.2	150.3	0	111	F806 E808 Q812 R813 E814 V821 E826	F806-K810 PolarHBondContact O-N 2.65Å; E808-K810 VanDerWaalsContact C-N 3.32Å; E808-K810 PolarHBondContact O-N 3.23Å; K810-Q812 VanDerWaalsContact C-N 3.32Å; K810-Q812 PolarHBondContact O-N 3.45Å; K810-R813 PolarHBondContact O-N 3.24Å; K810-E814 WeakPolarHBondContact CE-OE1 3.42Å; K810-E814 WeakPolarHBondContact CG-OE1 3.39Å; K810-E814 WeakPolarHBondContact O-CG 3.38Å; K810-E814 PolarHBondContact O-N 3.49Å; K810-V821 HydrophobicContact CB-CG2 4.21Å; K810-V821 HydrophobicContact CD-CG2 3.47Å; K810-V821 VanDerWaalsContact CD-CG2 3.47Å; K810-V821 HydrophobicContact CG-CG2 3.71Å; K810-E826 IonicContact NZ-OE1 2.67Å; K810-E826 PolarHBondContact NZ-OE1 3.02Å
811	K	85.8	Confident	82.9	Confident	98 Å²	98	92.5 Å²	92.5	43%	0.426	43%	0.434	S	S	.	.	H	α-helix	trans	-60.1	-40.1	176.2	-68.9	164.3	-172.5	164.7	0	112.4	E807 E808 E814 I815	E807-K811 WeakPolarHBondContact O-CG 3.48Å; E807-K811 PolarHBondContact O-N 2.85Å; E807-K811 VanDerWaalsContact O-N 3.17Å; E807-K811 VanDerWaalsContact OE1-CE 3.31Å; E807-K811 WeakPolarHBondContact OE1-CE 3.5Å; E807-K811 IonicContact OE1-NZ 3.06Å; E807-K811 PolarHBondContact OE1-NZ 3.2Å; E808-K811 PolarHBondContact O-N 3.38Å; K811-E814 PolarHBondContact O-N 3.06Å; K811-I815 WeakPolarHBondContact O-CD1 3.36Å; K811-I815 VanDerWaalsContact O-CG1 3.27Å; K811-I815 WeakPolarHBondContact O-CG1 3.27Å; K811-I815 PolarHBondContact O-N 3.31Å
812	Q	86	Confident	82.4	Confident	98 Å²	98	90.7 Å²	90.7	46%	0.458	43%	0.431	S	S	.	.	H	α-helix	trans	-62.7	-44.4	178.1	-175.8	60.3	30.2	0	0	111.7	E808 K809 K810 I815 E816	E808-Q812 WeakPolarHBondContact O-CB 3.47Å; E808-Q812 PolarHBondContact O-N 3.25Å; K809-Q812 PolarHBondContact O-N 2.82Å; K810-Q812 VanDerWaalsContact C-N 3.32Å; K810-Q812 PolarHBondContact O-N 3.45Å; Q812-I815 WeakPolarHBondContact O-CB 3.41Å; Q812-I815 PolarHBondContact O-N 3.41Å; Q812-E816 WeakPolarHBondContact CG-OE1 3.39Å; Q812-E816 PolarHBondContact NE2-OE1 2.93Å; Q812-E816 WeakPolarHBondContact O-CG 3.49Å; Q812-E816 PolarHBondContact O-N 3.36Å
813	R	82.7	Confident	82	Confident	60 Å²	60	89.4 Å²	89.4	23%	0.226	44%	0.442	C	S	.	.	H	α-helix	trans	-69.2	-33.7	176.3	-70.6	-163.1	-62.8	-147.9	1.7	113.3	K809 K810 I815 E816 G817 Q818 G820 E825	K809-R813 PolarHBondContact O-N 2.88Å; K810-R813 PolarHBondContact O-N 3.24Å; R813-I815 VanDerWaalsContact C-N 3.35Å; R813-E816 CarbonylContact O-C 3.54Å; R813-E816 PolarHBondContact O-N 3.04Å; R813-G817 PolarHBondContact O-N 2.9Å; R813-Q818 CarbonylContact C-O 3.59Å; R813-Q818 HydrophobicContact CB-CB 4.38Å; R813-Q818 PolarHBondContact O-N 3.06Å; R813-Q818 VanDerWaalsContact O-O 3.12Å; R813-G820 PolarHBondContact NE-O 3.26Å; R813-G820 PolarHBondContact NH2-O 3.41Å; R813-E825 IonicContact CZ-OE1 3.66Å; R813-E825 IonicContact CZ-OE2 2.67Å; R813-E825 IonicContact NH1-OE1 3.59Å; R813-E825 PolarHBondContact NH1-OE1 3.07Å; R813-E825 IonicContact NH1-OE2 2.67Å; R813-E825 PolarHBondContact NH1-OE2 3.3Å; R813-E825 VanDerWaalsContact NH2-CD 3.28Å; R813-E825 IonicContact NH2-OE1 3.94Å; R813-E825 PolarHBondContact NH2-OE1 3.18Å; R813-E825 VanDerWaalsContact NH2-OE1 3.09Å; R813-E825 IonicContact NH2-OE2 3.48Å; R813-E825 PolarHBondContact NH2-OE2 3.3Å
814	E	82.3	Confident	81.6	Confident	104 Å²	104	90.2 Å²	90.2	49%	0.486	46%	0.458	S	S	.	.	H	α-helix	trans	-62.8	-39.5	171	-71.9	166.6	-175.9	0	0	111.7	K810 K811 G817	K810-E814 WeakPolarHBondContact CE-OE1 3.42Å; K810-E814 WeakPolarHBondContact CG-OE1 3.39Å; K810-E814 WeakPolarHBondContact O-CG 3.38Å; K810-E814 PolarHBondContact O-N 3.49Å; K811-E814 PolarHBondContact O-N 3.06Å; E814-G817 PolarHBondContact O-N 3.01Å
815	I	84.8	Confident	81.3	Confident	132 Å²	132	89.4 Å²	89.4	68%	0.677	45%	0.452	S	S	*	.	H	α-helix	trans	-66.8	-36.6	173	-69.4	162.6	0	0	0	111.7	K811 Q812 R813 G817	K811-I815 WeakPolarHBondContact O-CD1 3.36Å; K811-I815 VanDerWaalsContact O-CG1 3.27Å; K811-I815 WeakPolarHBondContact O-CG1 3.27Å; K811-I815 PolarHBondContact O-N 3.31Å; Q812-I815 WeakPolarHBondContact O-CB 3.41Å; Q812-I815 PolarHBondContact O-N 3.41Å; R813-I815 VanDerWaalsContact C-N 3.35Å; I815-G817 PolarHBondContact O-N 3.26Å
816	E	86	Confident	80.9	Confident	104 Å²	104	89.1 Å²	89.1	49%	0.486	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	5.2	175.3	-70	167.1	-167.1	0	0	113.5	Q812 R813 Q818	Q812-E816 WeakPolarHBondContact CG-OE1 3.39Å; Q812-E816 PolarHBondContact NE2-OE1 2.93Å; Q812-E816 WeakPolarHBondContact O-CG 3.49Å; Q812-E816 PolarHBondContact O-N 3.36Å; R813-E816 CarbonylContact O-C 3.54Å; R813-E816 PolarHBondContact O-N 3.04Å; E816-Q818 VanDerWaalsContact C-N 3.27Å; E816-Q818 PolarHBondContact O-N 2.99Å
817	G	77.5	Confident	80.7	Confident	68 Å²	68	93.8 Å²	93.8	70%	0.701	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	11.1	176.7	0	0	0	0	0	114.6	R813 E814 I815	R813-G817 PolarHBondContact O-N 2.9Å; E814-G817 PolarHBondContact O-N 3.01Å; I815-G817 PolarHBondContact O-N 3.26Å
818	Q	75.1	Confident	80.6	Confident	111 Å²	111	95.3 Å²	95.3	52%	0.519	48%	0.481	S	S	.	.	S	Bend	trans	-93	150.2	175.8	-58.7	179.3	29.6	0	0	109.9	R813 E816 G820	R813-Q818 CarbonylContact C-O 3.59Å; R813-Q818 HydrophobicContact CB-CB 4.38Å; R813-Q818 PolarHBondContact O-N 3.06Å; R813-Q818 VanDerWaalsContact O-O 3.12Å; E816-Q818 VanDerWaalsContact C-N 3.27Å; E816-Q818 PolarHBondContact O-N 2.99Å; Q818-G820 VanDerWaalsContact C-N 3.27Å; Q818-G820 PolarHBondContact O-N 3.01Å
819	W	60.3	Low	80.4	Confident	258 Å²	258	90 Å²	90	98%	0.977	46%	0.455	S	S	*	.			trans	-74.3	76.6	178.8	-91.2	78.2	0	0	0	112	V821	W819-V821 PolarHBondContact O-N 3.28Å
820	G	66.1	Low	80.3	Confident	7 Å²	7	88.7 Å²	88.7	7%	0.072	46%	0.455	C	S	.	.	S	Bend	trans	53.3	-79.7	160.4	0	0	0	0	0	117.6	R813 Q818	R813-G820 PolarHBondContact NE-O 3.26Å; R813-G820 PolarHBondContact NH2-O 3.41Å; Q818-G820 VanDerWaalsContact C-N 3.27Å; Q818-G820 PolarHBondContact O-N 3.01Å
821	V	72.4	Confident	80.3	Confident	26 Å²	26	92 Å²	92	16%	0.158	47%	0.47	C	S	.	.			trans	-145.7	142.4	-168	-157.7	0	0	0	0	111	F806 K810 W819 E825 E826	F806-V821 HydrophobicContact CE2-CG1 4.32Å; F806-V821 HydrophobicContact CZ-CG1 3.79Å; K810-V821 HydrophobicContact CB-CG2 4.21Å; K810-V821 HydrophobicContact CD-CG2 3.47Å; K810-V821 VanDerWaalsContact CD-CG2 3.47Å; K810-V821 HydrophobicContact CG-CG2 3.71Å; W819-V821 PolarHBondContact O-N 3.28Å; V821-E825 HydrophobicContact CG1-CB 3.59Å; V821-E826 HydrophobicContact CB-CG 3.77Å; V821-E826 HydrophobicContact CG1-CG 3.44Å; V821-E826 VanDerWaalsContact CG1-CG 3.44Å; V821-E826 HydrophobicContact CG2-CG 4.44Å
822	T	80.8	Confident	80.4	Confident	79 Å²	79	91.1 Å²	91.1	49%	0.485	46%	0.463	S	S	.	.			trans	-82.8	152	170	63.8	0	0	0	0	111.2	A824 E825 E826	T822-A824 PolarHBondContact O-N 3.47Å; T822-E825 WeakPolarHBondContact CB-OE2 3.49Å; T822-E825 PolarHBondContact N-OE2 3.42Å; T822-E825 PolarHBondContact O-N 2.71Å; T822-E825 VanDerWaalsContact OG1-CD 3.25Å; T822-E825 VanDerWaalsContact OG1-CG 3.26Å; T822-E825 WeakPolarHBondContact OG1-CG 3.41Å; T822-E825 PolarHBondContact OG1-OE2 3.32Å; T822-E826 PolarHBondContact O-N 2.91Å; T822-E826 VanDerWaalsContact O-N 3.09Å
823	A	79.4	Confident	80.3	Confident	76 Å²	76	87.9 Å²	87.9	63%	0.628	45%	0.449	S	S	*	.	H	α-helix	trans	-56.5	-36.3	-179.7	0	0	0	0	0	113.1	E826 E827	A823-E826 PolarHBondContact O-N 3.27Å; A823-E827 WeakPolarHBondContact O-CG 3.47Å; A823-E827 PolarHBondContact O-N 3.34Å
824	A	80.9	Confident	80.5	Confident	58 Å²	58	86.6 Å²	86.6	48%	0.479	46%	0.455	S	S	.	.	H	α-helix	trans	-64.6	-40.7	176.4	0	0	0	0	0	112.8	T822 E827 E828	T822-A824 PolarHBondContact O-N 3.47Å; A824-E827 PolarHBondContact O-N 2.85Å; A824-E828 WeakPolarHBondContact O-CB 3.21Å; A824-E828 WeakPolarHBondContact O-CG 3.22Å; A824-E828 PolarHBondContact O-N 2.9Å
825	E	81.6	Confident	80.6	Confident	53 Å²	53	86.4 Å²	86.4	25%	0.248	45%	0.454	C	S	.	.	H	α-helix	trans	-68.2	-35.1	175.7	-69.7	166.2	128.7	0	0	112	F806 R813 V821 T822 E829	F806-E825 HydrophobicContact CE2-CB 4.38Å; R813-E825 IonicContact CZ-OE1 3.66Å; R813-E825 IonicContact CZ-OE2 2.67Å; R813-E825 IonicContact NH1-OE1 3.59Å; R813-E825 PolarHBondContact NH1-OE1 3.07Å; R813-E825 IonicContact NH1-OE2 2.67Å; R813-E825 PolarHBondContact NH1-OE2 3.3Å; R813-E825 VanDerWaalsContact NH2-CD 3.28Å; R813-E825 IonicContact NH2-OE1 3.94Å; R813-E825 PolarHBondContact NH2-OE1 3.18Å; R813-E825 VanDerWaalsContact NH2-OE1 3.09Å; R813-E825 IonicContact NH2-OE2 3.48Å; R813-E825 PolarHBondContact NH2-OE2 3.3Å; V821-E825 HydrophobicContact CG1-CB 3.59Å; T822-E825 WeakPolarHBondContact CB-OE2 3.49Å; T822-E825 PolarHBondContact N-OE2 3.42Å; T822-E825 PolarHBondContact O-N 2.71Å; T822-E825 VanDerWaalsContact OG1-CD 3.25Å; T822-E825 VanDerWaalsContact OG1-CG 3.26Å; T822-E825 WeakPolarHBondContact OG1-CG 3.41Å; T822-E825 PolarHBondContact OG1-OE2 3.32Å; E825-E829 WeakPolarHBondContact O-CB 3.28Å; E825-E829 PolarHBondContact O-N 3.24Å
826	E	81.4	Confident	80.8	Confident	80 Å²	80	80.8 Å²	80.8	37%	0.374	43%	0.425	S	S	.	.	H	α-helix	trans	-70.5	-36	172.8	-63.9	-161.2	152.5	0	0	111.8	K810 V821 T822 A823 N830	K810-E826 IonicContact NZ-OE1 2.67Å; K810-E826 PolarHBondContact NZ-OE1 3.02Å; V821-E826 HydrophobicContact CB-CG 3.77Å; V821-E826 HydrophobicContact CG1-CG 3.44Å; V821-E826 VanDerWaalsContact CG1-CG 3.44Å; V821-E826 HydrophobicContact CG2-CG 4.44Å; T822-E826 PolarHBondContact O-N 2.91Å; T822-E826 VanDerWaalsContact O-N 3.09Å; A823-E826 PolarHBondContact O-N 3.27Å; E826-N830 VanDerWaalsContact O-CB 3.31Å; E826-N830 WeakPolarHBondContact O-CB 3.42Å; E826-N830 PolarHBondContact O-N 3.06Å; E826-N830 PolarHBondContact O-ND2 3.33Å
827	E	83.6	Confident	80.8	Confident	144 Å²	144	80.2 Å²	80.2	67%	0.673	42%	0.42	S	S	*	.	H	α-helix	trans	-65.2	-42.9	171.3	-76	-177.2	164.9	0	0	112.1	A823 A824 N830 K831	A823-E827 WeakPolarHBondContact O-CG 3.47Å; A823-E827 PolarHBondContact O-N 3.34Å; A824-E827 PolarHBondContact O-N 2.85Å; E827-N830 PolarHBondContact O-N 3.31Å; E827-K831 VanDerWaalsContact O-CB 3.29Å; E827-K831 WeakPolarHBondContact O-CB 3.14Å; E827-K831 PolarHBondContact O-N 2.72Å
828	E	84.5	Confident	81.3	Confident	122 Å²	122	82.8 Å²	82.8	57%	0.57	41%	0.414	S	S	*	.	H	α-helix	trans	-64.2	-38.9	175.4	-77.5	-175.6	-175.3	0	0	113	A824 R832	A824-E828 WeakPolarHBondContact O-CB 3.21Å; A824-E828 WeakPolarHBondContact O-CG 3.22Å; A824-E828 PolarHBondContact O-N 2.9Å; E828-R832 WeakPolarHBondContact O-CG 3.32Å; E828-R832 PolarHBondContact O-N 3.43Å; E828-R832 VanDerWaalsContact O-N 3.08Å; E828-R832 PolarHBondContact O-NE 3.49Å; E828-R832 VanDerWaalsContact O-NE 3.12Å
829	E	83.9	Confident	81.8	Confident	11 Å²	11	79.1 Å²	79.1	5%	0.051	40%	0.401	C	S	.	.	H	α-helix	trans	-67.1	-48.6	174.3	-169.9	67.1	-136.2	0	0	110.9	F806 E825 K831 R832 I833	F806-E829 HydrophobicContact CD1-CG 3.93Å; F806-E829 WeakPolarHBondContact CD2-OE2 3.48Å; F806-E829 HydrophobicContact CE1-CB 4.09Å; F806-E829 HydrophobicContact CE1-CG 3.78Å; F806-E829 HydrophobicContact CE2-CB 4.19Å; F806-E829 HydrophobicContact CE2-CG 4.46Å; F806-E829 HydrophobicContact CG-CG 4.33Å; F806-E829 VanDerWaalsContact CG-OE2 3.3Å; F806-E829 WeakPolarHBondContact CG-OE2 3.41Å; F806-E829 HydrophobicContact CZ-CB 3.84Å; F806-E829 HydrophobicContact CZ-CG 4.04Å; E825-E829 WeakPolarHBondContact O-CB 3.28Å; E825-E829 PolarHBondContact O-N 3.24Å; E829-K831 VanDerWaalsContact C-N 3.26Å; E829-K831 PolarHBondContact O-N 3.34Å; E829-R832 VanDerWaalsContact CA-NH2 3.33Å; E829-R832 PolarHBondContact O-N 3.48Å; E829-R832 IonicContact OE1-NH1 3.09Å; E829-R832 PolarHBondContact OE1-NH1 3Å; E829-R832 IonicContact OE2-CZ 3.37Å; E829-R832 IonicContact OE2-NH1 2.72Å; E829-R832 PolarHBondContact OE2-NH1 3.44Å; E829-R832 IonicContact OE2-NH2 3.52Å; E829-R832 PolarHBondContact OE2-NH2 3.03Å; E829-I833 HydrophobicContact CG-CD1 3.97Å; E829-I833 WeakPolarHBondContact O-CB 3.08Å; E829-I833 VanDerWaalsContact O-CG1 3.26Å; E829-I833 WeakPolarHBondContact O-CG1 3.34Å; E829-I833 PolarHBondContact O-N 2.93Å
830	N	84.5	Confident	83.1	Confident	108 Å²	108	67.9 Å²	67.9	58%	0.578	36%	0.36	S	S	*	.	H	α-helix	trans	-59.5	-37.4	176.7	-80.2	-59.3	0	0	0	112.3	E826 E827 G834	E826-N830 VanDerWaalsContact O-CB 3.31Å; E826-N830 WeakPolarHBondContact O-CB 3.42Å; E826-N830 PolarHBondContact O-N 3.06Å; E826-N830 PolarHBondContact O-ND2 3.33Å; E827-N830 PolarHBondContact O-N 3.31Å; N830-G834 PolarHBondContact O-N 3.4Å
831	K	87.7	Confident	84.2	Confident	136 Å²	136	71.4 Å²	71.4	59%	0.591	38%	0.381	S	S	*	.	H	α-helix	trans	-63.8	-49	174.4	-170.9	-172.7	179.5	-134.5	0	111.8	E827 E829 I833 G834 E835	E827-K831 VanDerWaalsContact O-CB 3.29Å; E827-K831 WeakPolarHBondContact O-CB 3.14Å; E827-K831 PolarHBondContact O-N 2.72Å; E829-K831 VanDerWaalsContact C-N 3.26Å; E829-K831 PolarHBondContact O-N 3.34Å; K831-I833 VanDerWaalsContact C-N 3.34Å; K831-I833 PolarHBondContact O-N 2.94Å; K831-G834 CarbonylContact O-C 3.45Å; K831-G834 WeakPolarHBondContact O-CA 3.21Å; K831-G834 PolarHBondContact O-N 3Å; K831-E835 WeakPolarHBondContact CE-OE1 3.33Å; K831-E835 IonicContact NZ-OE1 3.53Å; K831-E835 PolarHBondContact NZ-OE1 3.26Å; K831-E835 WeakPolarHBondContact O-CG 3.5Å; K831-E835 PolarHBondContact O-N 3.16Å
832	R	86	Confident	84.9	Confident	78 Å²	78	75.9 Å²	75.9	29%	0.294	40%	0.399	S	S	.	.	H	α-helix	trans	-61.7	-40.1	177.5	-74.7	177.8	-76.2	111.2	-5	112.2	E828 E829 G834 E835 F836	E828-R832 WeakPolarHBondContact O-CG 3.32Å; E828-R832 PolarHBondContact O-N 3.43Å; E828-R832 VanDerWaalsContact O-N 3.08Å; E828-R832 PolarHBondContact O-NE 3.49Å; E828-R832 VanDerWaalsContact O-NE 3.12Å; E829-R832 VanDerWaalsContact CA-NH2 3.33Å; E829-R832 PolarHBondContact O-N 3.48Å; E829-R832 IonicContact OE1-NH1 3.09Å; E829-R832 PolarHBondContact OE1-NH1 3Å; E829-R832 IonicContact OE2-CZ 3.37Å; E829-R832 IonicContact OE2-NH1 2.72Å; E829-R832 PolarHBondContact OE2-NH1 3.44Å; E829-R832 IonicContact OE2-NH2 3.52Å; E829-R832 PolarHBondContact OE2-NH2 3.03Å; R832-G834 VanDerWaalsContact C-N 3.3Å; R832-G834 PolarHBondContact O-N 3.49Å; R832-E835 PolarHBondContact O-N 3.48Å; R832-F836 PolarHBondContact O-N 2.74Å
833	I	85.2	Confident	85.2	Confident	30 Å²	30	72.9 Å²	72.9	15%	0.154	38%	0.379	C	S	.	.	H	α-helix	trans	-61.3	-38.9	171.8	-66.8	171.2	0	0	0	111	E829 K831 K837	E829-I833 HydrophobicContact CG-CD1 3.97Å; E829-I833 WeakPolarHBondContact O-CB 3.08Å; E829-I833 VanDerWaalsContact O-CG1 3.26Å; E829-I833 WeakPolarHBondContact O-CG1 3.34Å; E829-I833 PolarHBondContact O-N 2.93Å; K831-I833 VanDerWaalsContact C-N 3.34Å; K831-I833 PolarHBondContact O-N 2.94Å; I833-K837 HydrophobicContact CG2-CD 4.13Å; I833-K837 WeakPolarHBondContact O-CD 3.18Å; I833-K837 VanDerWaalsContact O-CG 3.27Å; I833-K837 WeakPolarHBondContact O-CG 3.43Å; I833-K837 PolarHBondContact O-N 3.4Å
834	G	85.6	Confident	85.6	Confident	34 Å²	34	70.1 Å²	70.1	35%	0.351	36%	0.355	S	S	.	.	H	α-helix	trans	-64.9	-45.7	173.7	0	0	0	0	0	113.6	N830 K831 R832 F836 K837 E838	N830-G834 PolarHBondContact O-N 3.4Å; K831-G834 CarbonylContact O-C 3.45Å; K831-G834 WeakPolarHBondContact O-CA 3.21Å; K831-G834 PolarHBondContact O-N 3Å; R832-G834 VanDerWaalsContact C-N 3.3Å; R832-G834 PolarHBondContact O-N 3.49Å; G834-F836 VanDerWaalsContact C-N 3.33Å; G834-F836 PolarHBondContact O-N 3.14Å; G834-K837 WeakPolarHBondContact O-CB 3.49Å; G834-K837 PolarHBondContact O-N 2.84Å; G834-K837 VanDerWaalsContact O-N 3.15Å; G834-E838 PolarHBondContact O-N 2.96Å
835	E	86.3	Confident	85.9	Confident	99 Å²	99	70.2 Å²	70.2	46%	0.463	35%	0.352	S	S	.	.	H	α-helix	trans	-61	-41	176	-69.7	168.1	-176.7	0	0	111	K831 R832 E838 S839	K831-E835 WeakPolarHBondContact CE-OE1 3.33Å; K831-E835 IonicContact NZ-OE1 3.53Å; K831-E835 PolarHBondContact NZ-OE1 3.26Å; K831-E835 WeakPolarHBondContact O-CG 3.5Å; K831-E835 PolarHBondContact O-N 3.16Å; R832-E835 PolarHBondContact O-N 3.48Å; E835-E838 PolarHBondContact O-N 2.98Å; E835-S839 PolarHBondContact O-N 3.19Å
836	F	86.9	Confident	86.2	Confident	15 Å²	15	71.7 Å²	71.7	7%	0.066	36%	0.359	C	S	.	.	H	α-helix	trans	-64.1	-41.9	172.4	-175.3	-106.4	0	0	0	112.5	M694 F697 A796 E799 R832 G834 E838 S839 I840	M694-F836 HydrophobicContact CE-CE1 3.99Å; M694-F836 HydrophobicContact CE-CZ 3.98Å; M694-F836 HydrophobicContact SD-CE1 4.29Å; F697-F836 HydrophobicContact CD2-CZ 4.15Å; A796-F836 HydrophobicContact CB-CZ 4.35Å; E799-F836 HydrophobicContact CB-CD2 4.04Å; E799-F836 HydrophobicContact CB-CE2 4.01Å; E799-F836 HydrophobicContact CG-CB 4.32Å; E799-F836 HydrophobicContact CG-CD1 4.15Å; E799-F836 HydrophobicContact CG-CD2 3.77Å; E799-F836 HydrophobicContact CG-CE1 4.4Å; E799-F836 HydrophobicContact CG-CE2 4.06Å; E799-F836 HydrophobicContact CG-CG 3.82Å; E799-F836 HydrophobicContact CG-CZ 4.37Å; R832-F836 PolarHBondContact O-N 2.74Å; G834-F836 VanDerWaalsContact C-N 3.33Å; G834-F836 PolarHBondContact O-N 3.14Å; F836-E838 VanDerWaalsContact C-N 3.26Å; F836-E838 PolarHBondContact O-N 3.5Å; F836-S839 WeakPolarHBondContact O-CB 3.34Å; F836-S839 PolarHBondContact O-N 2.97Å; F836-S839 PolarHBondContact O-OG 2.68Å; F836-I840 HydrophobicContact CD1-CD1 4.06Å; F836-I840 HydrophobicContact CD1-CG1 4.49Å; F836-I840 HydrophobicContact CE1-CD1 3.81Å; F836-I840 HydrophobicContact CE1-CG1 4.2Å; F836-I840 PolarHBondContact O-N 3.24Å
837	K	86.3	Confident	86.6	Confident	91 Å²	91	68 Å²	68	40%	0.396	34%	0.342	S	S	.	.	H	α-helix	trans	-58.5	-37.3	174.5	-78	163.3	178.2	173.1	0	112.5	E696 I833 G834 S839 I840 P841	E696-K837 WeakPolarHBondContact OE1-CE 3.36Å; E696-K837 IonicContact OE1-NZ 2.67Å; E696-K837 PolarHBondContact OE1-NZ 3.33Å; E696-K837 WeakPolarHBondContact OE2-CE 3.38Å; E696-K837 IonicContact OE2-NZ 2.7Å; I833-K837 HydrophobicContact CG2-CD 4.13Å; I833-K837 WeakPolarHBondContact O-CD 3.18Å; I833-K837 VanDerWaalsContact O-CG 3.27Å; I833-K837 WeakPolarHBondContact O-CG 3.43Å; I833-K837 PolarHBondContact O-N 3.4Å; G834-K837 WeakPolarHBondContact O-CB 3.49Å; G834-K837 PolarHBondContact O-N 2.84Å; G834-K837 VanDerWaalsContact O-N 3.15Å; K837-S839 VanDerWaalsContact C-N 3.28Å; K837-S839 PolarHBondContact O-N 2.74Å; K837-I840 PolarHBondContact O-N 3Å; K837-P841 WeakPolarHBondContact O-CD 3.49Å
838	E	87.9	Confident	86.9	Confident	122 Å²	122	68 Å²	68	57%	0.57	34%	0.336	S	S	*	.	H	α-helix	trans	-70.5	-23.1	176	-151.9	-149.5	108.6	0	0	113.2	G834 E835 F836 K842	G834-E838 PolarHBondContact O-N 2.96Å; E835-E838 PolarHBondContact O-N 2.98Å; F836-E838 VanDerWaalsContact C-N 3.26Å; F836-E838 PolarHBondContact O-N 3.5Å; E838-K842 WeakPolarHBondContact O-CE 3.36Å; E838-K842 WeakPolarHBondContact OE1-CE 3.47Å; E838-K842 IonicContact OE1-NZ 3.12Å; E838-K842 PolarHBondContact OE1-NZ 2.86Å
839	S	87.1	Confident	87.2	Confident	34 Å²	34	66.5 Å²	66.5	24%	0.238	33%	0.331	C	S	.	.	H	α-helix	trans	-77.2	-32.1	174.6	81.6	0	0	0	0	113.4	E835 F836 K837 K842 M843	E835-S839 PolarHBondContact O-N 3.19Å; F836-S839 WeakPolarHBondContact O-CB 3.34Å; F836-S839 PolarHBondContact O-N 2.97Å; F836-S839 PolarHBondContact O-OG 2.68Å; K837-S839 VanDerWaalsContact C-N 3.28Å; K837-S839 PolarHBondContact O-N 2.74Å; S839-K842 WeakPolarHBondContact O-CA 3.17Å; S839-K842 VanDerWaalsContact O-CB 3.31Å; S839-K842 WeakPolarHBondContact O-CB 3.16Å; S839-K842 PolarHBondContact O-N 3.24Å; S839-M843 WeakPolarHBondContact O-CG 3.42Å; S839-M843 PolarHBondContact O-N 3.13Å
840	I	87.8	Confident	87.5	Confident	22 Å²	22	66.2 Å²	66.2	11%	0.113	33%	0.329	C	S	.	.	H	α-helix	trans	-56.5	-43.6	-176.5	-73.6	170.9	0	0	0	113.2	E696 V700 F836 K837 K842 M843 C844	E696-I840 HydrophobicContact CB-CD1 4.07Å; V700-I840 HydrophobicContact CG2-CG2 3.79Å; F836-I840 HydrophobicContact CD1-CD1 4.06Å; F836-I840 HydrophobicContact CD1-CG1 4.49Å; F836-I840 HydrophobicContact CE1-CD1 3.81Å; F836-I840 HydrophobicContact CE1-CG1 4.2Å; F836-I840 PolarHBondContact O-N 3.24Å; K837-I840 PolarHBondContact O-N 3Å; I840-K842 VanDerWaalsContact C-N 3.3Å; I840-K842 PolarHBondContact O-N 3.15Å; I840-M843 PolarHBondContact O-N 2.89Å; I840-C844 PolarHBondContact O-N 3.43Å; I840-C844 PolarHBondContact O-SG 2.9Å; I840-C844 VanDerWaalsContact O-SG 3.4Å
841	P	88.3	Confident	87.8	Confident	82 Å²	82	63 Å²	63	53%	0.532	31%	0.314	S	S	.	.	H	α-helix	trans	-59.6	-36.4	172.8	-28.2	35.7	0	0	0	113.8	K837 C844 S845	K837-P841 WeakPolarHBondContact O-CD 3.49Å; P841-C844 PolarHBondContact O-N 3.36Å; P841-S845 WeakPolarHBondContact O-CB 3.47Å; P841-S845 PolarHBondContact O-N 3.48Å
842	K	88	Confident	87.9	Confident	119 Å²	119	63.1 Å²	63.1	52%	0.517	32%	0.316	S	S	.	.	H	α-helix	trans	-66.7	-46	179.4	-54	172.7	-171	167.1	0	109.4	E838 S839 I840 S845 Q846	E838-K842 WeakPolarHBondContact O-CE 3.36Å; E838-K842 WeakPolarHBondContact OE1-CE 3.47Å; E838-K842 IonicContact OE1-NZ 3.12Å; E838-K842 PolarHBondContact OE1-NZ 2.86Å; S839-K842 WeakPolarHBondContact O-CA 3.17Å; S839-K842 VanDerWaalsContact O-CB 3.31Å; S839-K842 WeakPolarHBondContact O-CB 3.16Å; S839-K842 PolarHBondContact O-N 3.24Å; I840-K842 VanDerWaalsContact C-N 3.3Å; I840-K842 PolarHBondContact O-N 3.15Å; K842-S845 PolarHBondContact O-N 3.19Å; K842-S845 VanDerWaalsContact O-N 3.14Å; K842-S845 PolarHBondContact O-OG 3.37Å; K842-Q846 PolarHBondContact O-N 2.66Å
843	M	86.7	Confident	88.1	Confident	17 Å²	17	65.4 Å²	65.4	8%	0.084	33%	0.329	C	S	.	.	H	α-helix	trans	-61	-44	173.9	-57.6	161.1	99.2	0	0	112.3	F697 I792 A795 S839 I840 S845 Q846 L847	F697-M843 HydrophobicContact CE2-CE 3.87Å; F697-M843 HydrophobicContact CE2-SD 4.42Å; F697-M843 HydrophobicContact CZ-CE 4.5Å; I792-M843 HydrophobicContact CB-CE 4.07Å; I792-M843 HydrophobicContact CD1-CB 4.3Å; I792-M843 HydrophobicContact CG1-CB 4.26Å; I792-M843 HydrophobicContact CG1-CE 3.97Å; I792-M843 HydrophobicContact CG1-CG 4.31Å; I792-M843 HydrophobicContact CG2-CE 3.99Å; I792-M843 WeakPolarHBondContact O-CE 3.45Å; A795-M843 HydrophobicContact CB-CE 4.35Å; S839-M843 WeakPolarHBondContact O-CG 3.42Å; S839-M843 PolarHBondContact O-N 3.13Å; I840-M843 PolarHBondContact O-N 2.89Å; M843-S845 VanDerWaalsContact C-N 3.32Å; M843-S845 PolarHBondContact O-N 3.35Å; M843-Q846 PolarHBondContact O-N 2.64Å; M843-L847 PolarHBondContact O-N 2.88Å; M843-L847 VanDerWaalsContact O-N 3.1Å
844	C	86.4	Confident	88.5	Confident	17 Å²	17	64 Å²	64	12%	0.115	32%	0.321	C	S	.	.	H	α-helix	trans	-60.2	-39.8	172.7	-74.6	0	0	0	0	112.4	I840 P841 L847 R848	I840-C844 PolarHBondContact O-N 3.43Å; I840-C844 PolarHBondContact O-SG 2.9Å; I840-C844 VanDerWaalsContact O-SG 3.4Å; P841-C844 PolarHBondContact O-N 3.36Å; C844-L847 PolarHBondContact O-N 3.12Å; C844-R848 VanDerWaalsContact O-CG 3.29Å; C844-R848 WeakPolarHBondContact O-CG 3.31Å; C844-R848 PolarHBondContact O-N 3.34Å
845	S	88.4	Confident	88.7	Confident	60 Å²	60	63 Å²	63	42%	0.42	31%	0.308	S	S	.	.	H	α-helix	trans	-66.4	-41.4	-179.6	76.5	0	0	0	0	111.8	P841 K842 M843 R848 I849	P841-S845 WeakPolarHBondContact O-CB 3.47Å; P841-S845 PolarHBondContact O-N 3.48Å; K842-S845 PolarHBondContact O-N 3.19Å; K842-S845 VanDerWaalsContact O-N 3.14Å; K842-S845 PolarHBondContact O-OG 3.37Å; M843-S845 VanDerWaalsContact C-N 3.32Å; M843-S845 PolarHBondContact O-N 3.35Å; S845-R848 PolarHBondContact O-N 3.49Å; S845-I849 WeakPolarHBondContact O-CD1 3.39Å; S845-I849 VanDerWaalsContact O-CG1 3.3Å; S845-I849 WeakPolarHBondContact O-CG1 3.41Å; S845-I849 PolarHBondContact O-N 2.78Å
846	Q	88.8	Confident	88.8	Confident	85 Å²	85	59.9 Å²	59.9	40%	0.397	30%	0.302	S	S	.	.	H	α-helix	trans	-60.9	-49.3	174.5	-173.2	178.5	4	0	0	111.3	K842 M843 R848 I849 L850	K842-Q846 PolarHBondContact O-N 2.66Å; M843-Q846 PolarHBondContact O-N 2.64Å; Q846-R848 VanDerWaalsContact C-N 3.32Å; Q846-R848 PolarHBondContact O-N 2.96Å; Q846-I849 WeakPolarHBondContact O-CB 3.29Å; Q846-I849 PolarHBondContact O-N 3.18Å; Q846-L850 WeakPolarHBondContact O-CG 3.41Å; Q846-L850 PolarHBondContact O-N 3.41Å; Q846-L850 VanDerWaalsContact O-N 3.09Å
847	L	89.3	Confident	89	Confident	2 Å²	2	60.6 Å²	60.6	1%	0.01	31%	0.306	C	S	.	.	H	α-helix	trans	-59.2	-40.1	177.5	-72.7	174	0	0	0	112.7	V700 C704 L785 I792 M843 C844 L850 T851	V700-L847 HydrophobicContact CG1-CD1 3.74Å; C704-L847 HydrophobicContact CB-CD1 4.27Å; L785-L847 HydrophobicContact CD1-CD2 4.14Å; I792-L847 HydrophobicContact CD1-CD1 4.1Å; I792-L847 HydrophobicContact CD1-CD2 4.02Å; I792-L847 HydrophobicContact CD1-CG 3.85Å; M843-L847 PolarHBondContact O-N 2.88Å; M843-L847 VanDerWaalsContact O-N 3.1Å; C844-L847 PolarHBondContact O-N 3.12Å; L847-L850 HydrophobicContact CD2-CD1 4.49Å; L847-L850 PolarHBondContact O-N 2.92Å; L847-T851 PolarHBondContact O-N 3.48Å; L847-T851 PolarHBondContact O-OG1 3Å; L847-T851 VanDerWaalsContact O-OG1 3.13Å
848	R	89.4	Confident	89.2	Confident	145 Å²	145	56.3 Å²	56.3	55%	0.547	29%	0.287	S	S	.	.	H	α-helix	trans	-65.2	-38.3	176.6	-72.1	170.5	-174.7	-169.5	-0.4	112.7	C844 S845 Q846 L850 T851 H852	C844-R848 VanDerWaalsContact O-CG 3.29Å; C844-R848 WeakPolarHBondContact O-CG 3.31Å; C844-R848 PolarHBondContact O-N 3.34Å; S845-R848 PolarHBondContact O-N 3.49Å; Q846-R848 VanDerWaalsContact C-N 3.32Å; Q846-R848 PolarHBondContact O-N 2.96Å; R848-L850 VanDerWaalsContact C-N 3.35Å; R848-T851 PolarHBondContact O-N 3.32Å; R848-H852 PolarHBondContact O-CD2 3.15Å; R848-H852 PolarHBondContact O-N 2.91Å
849	I	91.4	Very high	89.2	Confident	90 Å²	90	52.3 Å²	52.3	46%	0.462	27%	0.269	S	S	.	.	H	α-helix	trans	-61.6	-46	175.6	-70.5	163.4	0	0	0	109.8	S845 Q846 T851 H852 F853	S845-I849 WeakPolarHBondContact O-CD1 3.39Å; S845-I849 VanDerWaalsContact O-CG1 3.3Å; S845-I849 WeakPolarHBondContact O-CG1 3.41Å; S845-I849 PolarHBondContact O-N 2.78Å; Q846-I849 WeakPolarHBondContact O-CB 3.29Å; Q846-I849 PolarHBondContact O-N 3.18Å; I849-T851 PolarHBondContact O-N 3.01Å; I849-H852 PolarHBondContact O-N 2.97Å; I849-F853 HydrophobicContact CG2-CD2 3.65Å; I849-F853 HydrophobicContact CG2-CE2 3.4Å; I849-F853 HydrophobicContact CG2-CZ 4.49Å; I849-F853 WeakPolarHBondContact O-CD2 3.48Å; I849-F853 PolarHBondContact O-N 2.85Å
850	L	90.2	Very high	89.2	Confident	4 Å²	4	56.2 Å²	56.2	2%	0.021	28%	0.283	C	S	.	.	H	α-helix	trans	-60.7	-42.1	174.7	-60.3	170.7	0	0	0	112.3	L707 E784 L785 A788 Q846 L847 R848 H852 Y854	L707-L850 HydrophobicContact CD2-CB 4.1Å; E784-L850 HydrophobicContact CB-CD2 4.34Å; E784-L850 HydrophobicContact CG-CD2 3.68Å; E784-L850 VanDerWaalsContact OE2-CD2 3.23Å; E784-L850 WeakPolarHBondContact OE2-CD2 3.09Å; L785-L850 HydrophobicContact CD1-CD1 4.08Å; A788-L850 HydrophobicContact CB-CD1 3.66Å; Q846-L850 WeakPolarHBondContact O-CG 3.41Å; Q846-L850 PolarHBondContact O-N 3.41Å; Q846-L850 VanDerWaalsContact O-N 3.09Å; L847-L850 HydrophobicContact CD2-CD1 4.49Å; L847-L850 PolarHBondContact O-N 2.92Å; R848-L850 VanDerWaalsContact C-N 3.35Å; L850-H852 PolarHBondContact O-N 2.74Å; L850-Y854 VanDerWaalsContact O-CB 3.25Å; L850-Y854 WeakPolarHBondContact O-CB 3.49Å; L850-Y854 PolarHBondContact O-N 3.21Å
851	T	90.1	Very high	89.3	Confident	42 Å²	42	55.2 Å²	55.2	26%	0.258	28%	0.278	S	S	.	.	H	α-helix	trans	-59.3	-44	173.3	-57.1	0	0	0	0	111.9	L707 L847 R848 I849 Q855	L707-T851 HydrophobicContact CD1-CG2 4.33Å; L847-T851 PolarHBondContact O-N 3.48Å; L847-T851 PolarHBondContact O-OG1 3Å; L847-T851 VanDerWaalsContact O-OG1 3.13Å; R848-T851 PolarHBondContact O-N 3.32Å; I849-T851 PolarHBondContact O-N 3.01Å; T851-Q855 VanDerWaalsContact O-CB 3.29Å; T851-Q855 WeakPolarHBondContact O-CB 3.41Å; T851-Q855 PolarHBondContact O-N 2.87Å
852	H	90	Very high	89.2	Confident	137 Å²	137	51.3 Å²	51.3	63%	0.634	25%	0.253	S	S	*	.	H	α-helix	trans	-68.8	-41.9	-178.4	-79	-60.9	0	0	0	112.7	R848 I849 L850 G856	R848-H852 PolarHBondContact O-CD2 3.15Å; R848-H852 PolarHBondContact O-N 2.91Å; I849-H852 PolarHBondContact O-N 2.97Å; L850-H852 PolarHBondContact O-N 2.74Å; H852-G856 PolarHBondContact O-N 3.18Å; H852-G856 VanDerWaalsContact O-N 3.07Å
853	F	91.1	Very high	89.2	Confident	126 Å²	126	47.4 Å²	47.4	55%	0.553	24%	0.239	S	C	*	.	H	α-helix	trans	-65	-49.8	174.5	-74.8	-55.4	0	0	0	111.7	I849 Q855 G856 I857	I849-F853 HydrophobicContact CG2-CD2 3.65Å; I849-F853 HydrophobicContact CG2-CE2 3.4Å; I849-F853 HydrophobicContact CG2-CZ 4.49Å; I849-F853 WeakPolarHBondContact O-CD2 3.48Å; I849-F853 PolarHBondContact O-N 2.85Å; F853-Q855 VanDerWaalsContact C-N 3.34Å; F853-Q855 PolarHBondContact O-N 3.34Å; F853-G856 PolarHBondContact O-N 3.46Å; F853-G856 VanDerWaalsContact O-N 3.16Å; F853-I857 VanDerWaalsContact O-CG1 3.32Å; F853-I857 WeakPolarHBondContact O-CG1 3.29Å; F853-I857 PolarHBondContact O-N 3.43Å
854	Y	91.9	Very high	89.1	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-53.1	-49.5	176	173.1	-102.9	0	0	0	112.3	L707 E710 M711 F714 V778 Q781 L850 G856 I857 V858	L707-Y854 HydrophobicContact CD1-CD1 4.08Å; L707-Y854 HydrophobicContact CD1-CG 4.42Å; E710-Y854 HydrophobicContact CB-CE1 4.14Å; E710-Y854 HydrophobicContact CG-CE1 3.82Å; E710-Y854 PolarHBondContact O-OH 3.27Å; M711-Y854 WeakPolarHBondContact CA-OH 3.49Å; M711-Y854 HydrophobicContact CE-CD2 3.58Å; M711-Y854 HydrophobicContact CE-CE2 4.21Å; M711-Y854 HydrophobicContact CE-CG 3.79Å; M711-Y854 HydrophobicContact CG-CD2 3.94Å; M711-Y854 HydrophobicContact CG-CE1 4.26Å; M711-Y854 HydrophobicContact CG-CE2 3.57Å; M711-Y854 HydrophobicContact CG-CG 4.41Å; F714-Y854 VanDerWaalsContact CB-OH 3.25Å; F714-Y854 WeakPolarHBondContact CB-OH 3.23Å; V778-Y854 HydrophobicContact CG1-CD2 4.5Å; V778-Y854 HydrophobicContact CG1-CE2 3.96Å; Q781-Y854 HydrophobicContact CG-CD2 4.29Å; L850-Y854 VanDerWaalsContact O-CB 3.25Å; L850-Y854 WeakPolarHBondContact O-CB 3.49Å; L850-Y854 PolarHBondContact O-N 3.21Å; Y854-G856 VanDerWaalsContact C-N 3.34Å; Y854-G856 PolarHBondContact O-N 3.18Å; Y854-I857 PolarHBondContact O-N 3.38Å; Y854-V858 HydrophobicContact CD2-CG2 4.19Å; Y854-V858 HydrophobicContact CE1-CG2 4.02Å; Y854-V858 HydrophobicContact CE2-CG2 3.67Å; Y854-V858 WeakPolarHBondContact O-CG2 3.47Å; Y854-V858 PolarHBondContact O-N 3.18Å
855	Q	89.9	Confident	89	Confident	15 Å²	15	48.4 Å²	48.4	7%	0.07	24%	0.243	C	C	.	.	H	α-helix	trans	-66.3	-34.8	-178.6	-175.5	158.3	96.7	0	0	112.6	E710 T851 F853 Q859 Y886 R889	E710-Q855 PolarHBondContact OE1-NE2 3.09Å; T851-Q855 VanDerWaalsContact O-CB 3.29Å; T851-Q855 WeakPolarHBondContact O-CB 3.41Å; T851-Q855 PolarHBondContact O-N 2.87Å; F853-Q855 VanDerWaalsContact C-N 3.34Å; F853-Q855 PolarHBondContact O-N 3.34Å; Q855-Q859 WeakPolarHBondContact O-CB 3.42Å; Q855-Q859 VanDerWaalsContact O-CG 3.28Å; Q855-Q859 WeakPolarHBondContact O-CG 3.3Å; Q855-Q859 PolarHBondContact O-N 3.23Å; Q855-Y886 HydrophobicContact CG-CD1 4.22Å; Q855-Y886 HydrophobicContact CG-CE1 4.22Å; Q855-R889 VanDerWaalsContact OE1-CD 3.26Å
856	G	89.1	Confident	88.7	Confident	33 Å²	33	47.5 Å²	47.5	34%	0.34	24%	0.235	S	C	.	.	H	α-helix	trans	-65.8	-41.4	173.8	0	0	0	0	0	113.1	H852 F853 Y854 Q859 Q860	H852-G856 PolarHBondContact O-N 3.18Å; H852-G856 VanDerWaalsContact O-N 3.07Å; F853-G856 PolarHBondContact O-N 3.46Å; F853-G856 VanDerWaalsContact O-N 3.16Å; Y854-G856 VanDerWaalsContact C-N 3.34Å; Y854-G856 PolarHBondContact O-N 3.18Å; G856-Q859 PolarHBondContact O-N 3.39Å; G856-Q860 PolarHBondContact O-N 2.91Å
857	I	90.6	Very high	88.5	Confident	30 Å²	30	48.2 Å²	48.2	15%	0.154	25%	0.246	C	C	.	.	H	α-helix	trans	-64.3	-46.7	175.6	-62.3	161.6	0	0	0	110.1	A777 V778 Q781 F853 Y854 Q859 Q860 F861	A777-I857 HydrophobicContact CB-CD1 4.13Å; A777-I857 HydrophobicContact CB-CG1 4.46Å; A777-I857 HydrophobicContact CB-CG2 3.98Å; V778-I857 HydrophobicContact CG2-CB 4.46Å; V778-I857 HydrophobicContact CG2-CG2 3.48Å; V778-I857 VanDerWaalsContact CG2-CG2 3.48Å; Q781-I857 HydrophobicContact CB-CD1 4.43Å; F853-I857 VanDerWaalsContact O-CG1 3.32Å; F853-I857 WeakPolarHBondContact O-CG1 3.29Å; F853-I857 PolarHBondContact O-N 3.43Å; Y854-I857 PolarHBondContact O-N 3.38Å; I857-Q859 VanDerWaalsContact C-N 3.35Å; I857-Q859 PolarHBondContact O-N 3.45Å; I857-Q860 PolarHBondContact O-N 2.98Å; I857-F861 WeakPolarHBondContact O-CB 3.45Å; I857-F861 PolarHBondContact O-N 3.43Å
858	V	90	Very high	88	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-64.1	-38	178	174.1	0	0	0	0	111.8	F714 V778 Y854 F861 L862 Y886	F714-V858 HydrophobicContact CD2-CG1 4.25Å; F714-V858 HydrophobicContact CD2-CG2 4.12Å; F714-V858 HydrophobicContact CE2-CG1 4.34Å; F714-V858 HydrophobicContact CE2-CG2 4.2Å; V778-V858 HydrophobicContact CG2-CG2 4.34Å; Y854-V858 HydrophobicContact CD2-CG2 4.19Å; Y854-V858 HydrophobicContact CE1-CG2 4.02Å; Y854-V858 HydrophobicContact CE2-CG2 3.67Å; Y854-V858 WeakPolarHBondContact O-CG2 3.47Å; Y854-V858 PolarHBondContact O-N 3.18Å; V858-F861 PolarHBondContact O-N 2.9Å; V858-L862 HydrophobicContact CG1-CD1 4Å; V858-L862 HydrophobicContact CG1-CG 4.33Å; V858-L862 WeakPolarHBondContact O-CB 3.35Å; V858-L862 VanDerWaalsContact O-CG 3.28Å; V858-L862 WeakPolarHBondContact O-CG 3.49Å; V858-L862 PolarHBondContact O-N 2.94Å; V858-Y886 HydrophobicContact CB-CE1 4.29Å; V858-Y886 HydrophobicContact CG1-CD1 4.2Å; V858-Y886 HydrophobicContact CG1-CE1 3.74Å; V858-Y886 HydrophobicContact CG1-CE2 4.1Å
859	Q	87.8	Confident	87.3	Confident	39 Å²	39	46.9 Å²	46.9	18%	0.182	26%	0.258	C	S	.	.	H	α-helix	trans	-59.5	-49.7	171.9	-81.7	174.5	-25.1	0	0	111.8	Q855 G856 I857 F861 L862 V863	Q855-Q859 WeakPolarHBondContact O-CB 3.42Å; Q855-Q859 VanDerWaalsContact O-CG 3.28Å; Q855-Q859 WeakPolarHBondContact O-CG 3.3Å; Q855-Q859 PolarHBondContact O-N 3.23Å; G856-Q859 PolarHBondContact O-N 3.39Å; I857-Q859 VanDerWaalsContact C-N 3.35Å; I857-Q859 PolarHBondContact O-N 3.45Å; Q859-F861 VanDerWaalsContact C-N 3.32Å; Q859-F861 PolarHBondContact O-N 3.13Å; Q859-L862 PolarHBondContact O-N 3.41Å; Q859-V863 WeakPolarHBondContact O-CG2 3.11Å; Q859-V863 PolarHBondContact O-N 3Å
860	Q	88.6	Confident	86.7	Confident	116 Å²	116	44.8 Å²	44.8	54%	0.542	25%	0.248	S	C	.	.	H	α-helix	trans	-62.7	-37.8	178.2	-170.4	169.5	13.1	0	0	112.5	Q774 G856 I857 L864	Q774-Q860 HydrophobicContact CG-CG 4.5Å; G856-Q860 PolarHBondContact O-N 2.91Å; I857-Q860 PolarHBondContact O-N 2.98Å; Q860-L864 WeakPolarHBondContact O-CB 3.36Å; Q860-L864 PolarHBondContact O-N 3.22Å; Q860-L864 VanDerWaalsContact O-N 3.11Å
861	F	89.1	Confident	86.2	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-63.2	-46.7	174	-176.6	-100	0	0	0	112.2	F714 M718 L771 Q774 L775 I857 V858 Q859 L864 L865 L880	F714-F861 AromaticContact CE2-CD1 3.73Å; F714-F861 HydrophobicContact CE2-CD1 3.73Å; F714-F861 AromaticContact CE2-CE1 3.79Å; F714-F861 HydrophobicContact CE2-CE1 3.79Å; F714-F861 AromaticContact CZ-CD1 3.84Å; F714-F861 HydrophobicContact CZ-CD1 3.84Å; F714-F861 AromaticContact CZ-CE1 3.66Å; F714-F861 HydrophobicContact CZ-CE1 3.66Å; F714-F861 HydrophobicContact CZ-CG 4.46Å; F714-F861 HydrophobicContact CZ-CZ 4.17Å; M718-F861 HydrophobicContact CE-CZ 4.09Å; M718-F861 HydrophobicContact SD-CE1 3.89Å; M718-F861 HydrophobicContact SD-CZ 3.85Å; L771-F861 HydrophobicContact CD1-CD2 3.41Å; L771-F861 VanDerWaalsContact CD1-CD2 3.41Å; L771-F861 HydrophobicContact CD1-CE2 3.37Å; L771-F861 HydrophobicContact CD1-CG 4.13Å; L771-F861 HydrophobicContact CD1-CZ 4.08Å; L771-F861 HydrophobicContact CG-CD2 4.17Å; L771-F861 HydrophobicContact CG-CE2 3.7Å; L771-F861 HydrophobicContact CG-CZ 4.42Å; Q774-F861 HydrophobicContact CB-CB 4.28Å; Q774-F861 HydrophobicContact CB-CD2 3.9Å; L775-F861 HydrophobicContact CB-CE2 3.93Å; L775-F861 HydrophobicContact CD1-CE2 4.46Å; I857-F861 WeakPolarHBondContact O-CB 3.45Å; I857-F861 PolarHBondContact O-N 3.43Å; V858-F861 PolarHBondContact O-N 2.9Å; Q859-F861 VanDerWaalsContact C-N 3.32Å; Q859-F861 PolarHBondContact O-N 3.13Å; F861-L864 PolarHBondContact O-N 3.26Å; F861-L865 HydrophobicContact CD1-CD1 3.89Å; F861-L865 HydrophobicContact CD1-CG 4.39Å; F861-L865 HydrophobicContact CE1-CD1 3.56Å; F861-L865 HydrophobicContact CE1-CG 4.18Å; F861-L865 HydrophobicContact CZ-CD1 4.24Å; F861-L865 HydrophobicContact CZ-CG 4.5Å; F861-L865 WeakPolarHBondContact O-CG 3.42Å; F861-L865 PolarHBondContact O-N 2.84Å; F861-L880 HydrophobicContact CD1-CD1 4.37Å; F861-L880 HydrophobicContact CE1-CD1 3.85Å
862	L	87.1	Confident	85.7	Confident	1 Å²	1	51.3 Å²	51.3	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-62.3	-45.2	176.6	-73.2	169.4	0	0	0	112.1	V858 Q859 L864 L865 T866 L880 D881 Y886 L893	V858-L862 HydrophobicContact CG1-CD1 4Å; V858-L862 HydrophobicContact CG1-CG 4.33Å; V858-L862 WeakPolarHBondContact O-CB 3.35Å; V858-L862 VanDerWaalsContact O-CG 3.28Å; V858-L862 WeakPolarHBondContact O-CG 3.49Å; V858-L862 PolarHBondContact O-N 2.94Å; Q859-L862 PolarHBondContact O-N 3.41Å; L862-L864 VanDerWaalsContact C-N 3.28Å; L862-L864 PolarHBondContact O-N 3.07Å; L862-L865 HydrophobicContact CD2-CD1 4.49Å; L862-L865 PolarHBondContact O-N 3.35Å; L862-T866 WeakPolarHBondContact O-CG2 3.35Å; L862-T866 PolarHBondContact O-N 2.88Å; L862-L880 HydrophobicContact CD2-CB 3.75Å; L862-L880 HydrophobicContact CD2-CD1 4.16Å; L862-D881 HydrophobicContact CD1-CB 4.35Å; L862-Y886 HydrophobicContact CD1-CD2 3.67Å; L862-Y886 HydrophobicContact CD1-CE2 4.42Å; L862-Y886 HydrophobicContact CD1-CG 3.71Å; L862-L893 HydrophobicContact CB-CD1 4.34Å; L862-L893 HydrophobicContact CB-CD2 3.76Å; L862-L893 HydrophobicContact CD1-CD1 4.3Å
863	V	86.4	Confident	85.3	Confident	36 Å²	36	45.4 Å²	45.4	22%	0.218	25%	0.252	C	S	.	.	H	α-helix	trans	-56.7	-46.4	175.7	171	0	0	0	0	110.2	Q859 L865 T866 T867 E890 R892 L893	Q859-V863 WeakPolarHBondContact O-CG2 3.11Å; Q859-V863 PolarHBondContact O-N 3Å; V863-L865 PolarHBondContact O-N 3.48Å; V863-T866 PolarHBondContact O-N 3.26Å; V863-T866 PolarHBondContact O-OG1 2.88Å; V863-T867 PolarHBondContact O-N 3.36Å; V863-T867 PolarHBondContact O-OG1 2.95Å; V863-E890 WeakPolarHBondContact CG2-OE2 3.42Å; V863-R892 HydrophobicContact CG2-CB 4.25Å; V863-L893 HydrophobicContact CB-CD2 4.45Å; V863-L893 HydrophobicContact CG2-CD2 3.68Å; V863-L893 HydrophobicContact CG2-CG 4.19Å
864	L	85.9	Confident	84.9	Confident	55 Å²	55	42.3 Å²	42.3	29%	0.288	24%	0.237	S	C	.	.	H	α-helix	trans	-65.3	-38.6	179.9	-171.7	57.7	0	0	0	112.8	A770 L771 Q860 F861 L862 T867 S868	A770-L864 HydrophobicContact CB-CD2 3.79Å; L771-L864 HydrophobicContact CB-CD2 3.82Å; L771-L864 HydrophobicContact CB-CG 4.36Å; L771-L864 HydrophobicContact CD1-CB 4.09Å; L771-L864 HydrophobicContact CD1-CD2 3.96Å; L771-L864 HydrophobicContact CD1-CG 4.01Å; Q860-L864 WeakPolarHBondContact O-CB 3.36Å; Q860-L864 PolarHBondContact O-N 3.22Å; Q860-L864 VanDerWaalsContact O-N 3.11Å; F861-L864 PolarHBondContact O-N 3.26Å; L862-L864 VanDerWaalsContact C-N 3.28Å; L862-L864 PolarHBondContact O-N 3.07Å; L864-T867 WeakPolarHBondContact CA-OG1 3.43Å; L864-T867 PolarHBondContact O-N 2.82Å; L864-T867 PolarHBondContact O-OG1 3.3Å; L864-S868 PolarHBondContact O-N 2.91Å
865	L	84.9	Confident	84.4	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-59	-45.2	170.9	-74.3	175.3	0	0	0	112	L771 F861 L862 V863 T867 S868 L873 L876 L880	L771-L865 HydrophobicContact CD1-CD2 3.99Å; L771-L865 HydrophobicContact CD1-CG 3.99Å; L771-L865 HydrophobicContact CD2-CD2 3.63Å; L771-L865 HydrophobicContact CG-CD2 4.41Å; F861-L865 HydrophobicContact CD1-CD1 3.89Å; F861-L865 HydrophobicContact CD1-CG 4.39Å; F861-L865 HydrophobicContact CE1-CD1 3.56Å; F861-L865 HydrophobicContact CE1-CG 4.18Å; F861-L865 HydrophobicContact CZ-CD1 4.24Å; F861-L865 HydrophobicContact CZ-CG 4.5Å; F861-L865 WeakPolarHBondContact O-CG 3.42Å; F861-L865 PolarHBondContact O-N 2.84Å; L862-L865 HydrophobicContact CD2-CD1 4.49Å; L862-L865 PolarHBondContact O-N 3.35Å; V863-L865 PolarHBondContact O-N 3.48Å; L865-T867 PolarHBondContact O-N 3.19Å; L865-S868 WeakPolarHBondContact O-CB 3.43Å; L865-S868 PolarHBondContact O-N 3.13Å; L865-S868 VanDerWaalsContact O-N 3.11Å; L865-S868 PolarHBondContact O-OG 3.26Å; L865-L873 HydrophobicContact CD2-CB 3.99Å; L865-L873 HydrophobicContact CD2-CD2 4.27Å; L865-L876 HydrophobicContact CD1-CD2 4.28Å; L865-L876 HydrophobicContact CD1-CG 4.13Å; L865-L876 HydrophobicContact CD2-CD2 4.16Å; L865-L880 HydrophobicContact CD1-CD1 3.71Å
866	T	82.1	Confident	84.1	Confident	42 Å²	42	46.6 Å²	46.6	26%	0.258	26%	0.255	S	S	.	.	H	α-helix	trans	-63.4	-29.4	179.5	64.3	0	0	0	0	113.1	L862 V863 S868 L893	L862-T866 WeakPolarHBondContact O-CG2 3.35Å; L862-T866 PolarHBondContact O-N 2.88Å; V863-T866 PolarHBondContact O-N 3.26Å; V863-T866 PolarHBondContact O-OG1 2.88Å; T866-S868 VanDerWaalsContact C-N 3.34Å; T866-L893 HydrophobicContact CG2-CD2 4.4Å
867	T	82.6	Confident	83.9	Confident	100 Å²	100	45.7 Å²	45.7	61%	0.613	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-7.6	176.4	53.6	0	0	0	0	114.8	V863 L864 L865	V863-T867 PolarHBondContact O-N 3.36Å; V863-T867 PolarHBondContact O-OG1 2.95Å; L864-T867 WeakPolarHBondContact CA-OG1 3.43Å; L864-T867 PolarHBondContact O-N 2.82Å; L864-T867 PolarHBondContact O-OG1 3.3Å; L865-T867 PolarHBondContact O-N 3.19Å
868	S	80	Confident	83.4	Confident	21 Å²	21	49.8 Å²	49.8	15%	0.147	26%	0.26	C	S	.	.			trans	-67.2	154.5	-177.1	67.6	0	0	0	0	113.7	L864 L865 T866 D870 L873 R874	L864-S868 PolarHBondContact O-N 2.91Å; L865-S868 WeakPolarHBondContact O-CB 3.43Å; L865-S868 PolarHBondContact O-N 3.13Å; L865-S868 VanDerWaalsContact O-N 3.11Å; L865-S868 PolarHBondContact O-OG 3.26Å; T866-S868 VanDerWaalsContact C-N 3.34Å; S868-D870 VanDerWaalsContact C-N 3.3Å; S868-L873 WeakPolarHBondContact OG-CB 3.44Å; S868-R874 VanDerWaalsContact O-CZ 3.27Å; S868-R874 PolarHBondContact O-NE 3Å; S868-R874 PolarHBondContact O-NH2 3.34Å
869	S	75	Confident	82.9	Confident	97 Å²	97	52.8 Å²	52.8	68%	0.678	27%	0.271	S	S	*	.	S	Bend	trans	-67.4	-28.1	172.3	37.6	0	0	0	0	113.3	R874	S869-R874 PolarHBondContact O-NH2 2.93Å
870	D	78.5	Confident	82.6	Confident	47 Å²	47	51.1 Å²	51.1	25%	0.251	26%	0.264	S	S	.	.			trans	-90.5	127.8	-167.2	-73.2	-76.2	0	0	0	114.5	R761 S868 S872 L873 R874	R761-D870 IonicContact CZ-OD1 3.73Å; R761-D870 VanDerWaalsContact NH1-CG 3.31Å; R761-D870 IonicContact NH1-OD1 2.66Å; R761-D870 PolarHBondContact NH1-OD1 2.94Å; R761-D870 IonicContact NH2-OD1 2.77Å; R761-D870 PolarHBondContact NH2-OD1 3.36Å; S868-D870 VanDerWaalsContact C-N 3.3Å; D870-S872 VanDerWaalsContact C-N 3.27Å; D870-S872 PolarHBondContact O-N 3.28Å; D870-L873 HydrophobicContact CB-CB 4.18Å; D870-L873 HydrophobicContact CB-CD1 4.11Å; D870-L873 HydrophobicContact CB-CG 4.01Å; D870-L873 PolarHBondContact O-N 2.93Å; D870-R874 WeakPolarHBondContact O-CG 3.45Å; D870-R874 PolarHBondContact O-N 2.68Å; D870-R874 VanDerWaalsContact O-N 3.1Å
871	E	80.3	Confident	82.3	Confident	154 Å²	154	46.5 Å²	46.5	72%	0.72	24%	0.243	S	C	*	.	H	α-helix	trans	-64	-33.8	179	-52.5	-159.4	140.4	0	0	112.2	L873 R874 F875	E871-L873 PolarHBondContact O-N 3.48Å; E871-R874 PolarHBondContact O-N 3.42Å; E871-F875 WeakPolarHBondContact O-CB 3.48Å; E871-F875 PolarHBondContact O-N 3.32Å
872	S	78.4	Confident	81.4	Confident	29 Å²	29	52.8 Å²	52.8	20%	0.203	27%	0.27	C	S	.	.	H	α-helix	trans	-63.4	-39.2	174.9	66.9	0	0	0	0	112.7	Y721 R761 D870 F875 L876	Y721-S872 PolarHBondContact OH-OG 3.44Å; Y721-S872 VanDerWaalsContact OH-OG 3.11Å; R761-S872 PolarHBondContact NH1-OG 3.16Å; D870-S872 VanDerWaalsContact C-N 3.27Å; D870-S872 PolarHBondContact O-N 3.28Å; S872-F875 PolarHBondContact O-N 3.4Å; S872-L876 WeakPolarHBondContact O-CB 3.4Å; S872-L876 PolarHBondContact O-N 3.08Å
873	L	81.4	Confident	80.6	Confident	12 Å²	12	59 Å²	59	6%	0.063	30%	0.304	C	S	.	.	H	α-helix	trans	-75.8	-31.4	179.4	-64.9	-177.9	0	0	0	112	Y721 L763 L771 L865 S868 D870 E871 L876 S877	Y721-L873 HydrophobicContact CE1-CD2 3.81Å; Y721-L873 WeakPolarHBondContact OH-CD2 3.35Å; L763-L873 HydrophobicContact CD2-CD1 3.74Å; L763-L873 HydrophobicContact CD2-CD2 3.81Å; L763-L873 HydrophobicContact CD2-CG 4.45Å; L771-L873 HydrophobicContact CD2-CD1 4.43Å; L865-L873 HydrophobicContact CD2-CB 3.99Å; L865-L873 HydrophobicContact CD2-CD2 4.27Å; S868-L873 WeakPolarHBondContact OG-CB 3.44Å; D870-L873 HydrophobicContact CB-CB 4.18Å; D870-L873 HydrophobicContact CB-CD1 4.11Å; D870-L873 HydrophobicContact CB-CG 4.01Å; D870-L873 PolarHBondContact O-N 2.93Å; E871-L873 PolarHBondContact O-N 3.48Å; L873-L876 HydrophobicContact CD2-CD2 4.2Å; L873-S877 PolarHBondContact O-N 3.2Å
874	R	82.8	Confident	79.8	Confident	62 Å²	62	62 Å²	62	23%	0.234	32%	0.316	C	S	.	.	H	α-helix	trans	-67.3	-38.2	168.1	-62.7	-179.4	-155.8	129	4.1	112.1	S868 S869 D870 E871 S877 F878 L897	S868-R874 VanDerWaalsContact O-CZ 3.27Å; S868-R874 PolarHBondContact O-NE 3Å; S868-R874 PolarHBondContact O-NH2 3.34Å; S869-R874 PolarHBondContact O-NH2 2.93Å; D870-R874 WeakPolarHBondContact O-CG 3.45Å; D870-R874 PolarHBondContact O-N 2.68Å; D870-R874 VanDerWaalsContact O-N 3.1Å; E871-R874 PolarHBondContact O-N 3.42Å; R874-S877 WeakPolarHBondContact O-CB 3.34Å; R874-S877 PolarHBondContact O-N 3.08Å; R874-F878 PolarHBondContact O-N 3.14Å; R874-L897 HydrophobicContact CB-CD1 4.12Å; R874-L897 HydrophobicContact CB-CD2 4.36Å; R874-L897 HydrophobicContact CG-CD1 4.46Å
875	F	82.6	Confident	79.3	Confident	105 Å²	105	62.8 Å²	62.8	46%	0.461	32%	0.317	S	S	.	.	H	α-helix	trans	-66.9	-40.7	174.8	-174.7	-113.7	0	0	0	111.9	E871 S872 S877 F878 R879	E871-F875 WeakPolarHBondContact O-CB 3.48Å; E871-F875 PolarHBondContact O-N 3.32Å; S872-F875 PolarHBondContact O-N 3.4Å; F875-S877 VanDerWaalsContact C-N 3.3Å; F875-S877 PolarHBondContact O-N 3.31Å; F875-F878 HydrophobicContact CD2-CD1 4.48Å; F875-F878 HydrophobicContact CE2-CD1 4.24Å; F875-F878 WeakPolarHBondContact O-CA 3.48Å; F875-F878 WeakPolarHBondContact O-CB 3.43Å; F875-F878 PolarHBondContact O-N 3.47Å; F875-R879 HydrophobicContact CD1-CG 4.33Å; F875-R879 HydrophobicContact CE1-CG 4.05Å; F875-R879 HydrophobicContact CZ-CG 4.28Å; F875-R879 PolarHBondContact O-N 2.97Å
876	L	83.3	Confident	78.8	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-55	-43.2	168.9	172.2	60.1	0	0	0	112	M718 Y721 L865 S872 L873 F878 R879 L880	M718-L876 HydrophobicContact CE-CD2 3.97Å; M718-L876 HydrophobicContact SD-CD1 3.97Å; M718-L876 HydrophobicContact SD-CD2 3.86Å; M718-L876 HydrophobicContact SD-CG 4.35Å; Y721-L876 HydrophobicContact CD1-CD2 3.84Å; Y721-L876 HydrophobicContact CD2-CB 4.24Å; Y721-L876 HydrophobicContact CD2-CD2 4.4Å; Y721-L876 HydrophobicContact CE1-CD2 4.23Å; Y721-L876 HydrophobicContact CG-CD1 4.21Å; Y721-L876 HydrophobicContact CG-CD2 3.95Å; Y721-L876 HydrophobicContact CG-CG 4.45Å; L865-L876 HydrophobicContact CD1-CD2 4.28Å; L865-L876 HydrophobicContact CD1-CG 4.13Å; L865-L876 HydrophobicContact CD2-CD2 4.16Å; S872-L876 WeakPolarHBondContact O-CB 3.4Å; S872-L876 PolarHBondContact O-N 3.08Å; L873-L876 HydrophobicContact CD2-CD2 4.2Å; L876-F878 VanDerWaalsContact C-N 3.26Å; L876-F878 PolarHBondContact O-N 3.07Å; L876-R879 PolarHBondContact O-N 3.3Å; L876-R879 VanDerWaalsContact O-N 3.11Å; L876-L880 HydrophobicContact CD1-CD1 3.76Å; L876-L880 HydrophobicContact CD1-CG 3.88Å; L876-L880 HydrophobicContact CG-CD1 3.81Å; L876-L880 HydrophobicContact CG-CG 4.39Å; L876-L880 WeakPolarHBondContact O-CG 3.33Å; L876-L880 PolarHBondContact O-N 2.78Å
877	S	83.6	Confident	78.1	Confident	13 Å²	13	64.3 Å²	64.3	9%	0.091	32%	0.32	C	S	.	.	H	α-helix	trans	-59.5	-35.3	174.7	-167.5	0	0	0	0	113.1	L873 R874 F875 D881	L873-S877 PolarHBondContact O-N 3.2Å; R874-S877 WeakPolarHBondContact O-CB 3.34Å; R874-S877 PolarHBondContact O-N 3.08Å; F875-S877 VanDerWaalsContact C-N 3.3Å; F875-S877 PolarHBondContact O-N 3.31Å; S877-D881 PolarHBondContact O-N 3.24Å
878	F	81.3	Confident	77.1	Confident	117 Å²	117	62.8 Å²	62.8	51%	0.513	32%	0.318	S	S	.	.	H	α-helix	trans	-72.7	-36.3	174.3	174.8	-103.8	0	0	0	112.3	R874 F875 L876 D881 F882	R874-F878 PolarHBondContact O-N 3.14Å; F875-F878 HydrophobicContact CD2-CD1 4.48Å; F875-F878 HydrophobicContact CE2-CD1 4.24Å; F875-F878 WeakPolarHBondContact O-CA 3.48Å; F875-F878 WeakPolarHBondContact O-CB 3.43Å; F875-F878 PolarHBondContact O-N 3.47Å; L876-F878 VanDerWaalsContact C-N 3.26Å; L876-F878 PolarHBondContact O-N 3.07Å; F878-D881 CarbonylContact O-C 3.56Å; F878-F882 AromaticContact CE1-CD2 3.82Å; F878-F882 HydrophobicContact CE1-CD2 3.82Å; F878-F882 HydrophobicContact CE1-CE2 4.14Å; F878-F882 HydrophobicContact CE2-CD2 4.4Å; F878-F882 AromaticContact CZ-CD2 3.67Å; F878-F882 HydrophobicContact CZ-CD2 3.67Å; F878-F882 AromaticContact CZ-CE2 3.88Å; F878-F882 HydrophobicContact CZ-CE2 3.88Å; F878-F882 WeakPolarHBondContact O-CA 3.47Å; F878-F882 PolarHBondContact O-N 3.11Å
879	R	79.6	Confident	76.4	Confident	62 Å²	62	68.4 Å²	68.4	23%	0.234	34%	0.336	C	S	.	.	H	α-helix	trans	-65.8	-37.4	174.8	-69.4	-176.4	60.5	157.1	3	112.8	Y720 E725 F875 L876	Y720-R879 VanDerWaalsContact CB-NH2 3.35Å; E725-R879 WeakPolarHBondContact OE1-CD 3.17Å; E725-R879 IonicContact OE1-CZ 2.94Å; E725-R879 IonicContact OE1-NE 2.76Å; E725-R879 IonicContact OE1-NH1 2.81Å; E725-R879 PolarHBondContact OE1-NH1 2.91Å; F875-R879 HydrophobicContact CD1-CG 4.33Å; F875-R879 HydrophobicContact CE1-CG 4.05Å; F875-R879 HydrophobicContact CZ-CG 4.28Å; F875-R879 PolarHBondContact O-N 2.97Å; L876-R879 PolarHBondContact O-N 3.3Å; L876-R879 VanDerWaalsContact O-N 3.11Å
880	L	81.8	Confident	75.9	Confident	5 Å²	5	65.2 Å²	65.2	3%	0.026	31%	0.31	C	S	.	.	H	α-helix	trans	-74.8	-28.2	-178.9	-73	166.6	0	0	0	113.8	F714 Q717 M718 F861 L862 L865 L876	F714-L880 HydrophobicContact CD2-CD2 3.73Å; F714-L880 HydrophobicContact CE2-CD1 4.33Å; F714-L880 HydrophobicContact CE2-CD2 4.08Å; F714-L880 HydrophobicContact CG-CD2 4.36Å; Q717-L880 HydrophobicContact CB-CD2 3.7Å; Q717-L880 HydrophobicContact CB-CG 4.43Å; Q717-L880 HydrophobicContact CG-CD2 4.43Å; M718-L880 HydrophobicContact SD-CD1 4.11Å; M718-L880 HydrophobicContact SD-CD2 4.49Å; F861-L880 HydrophobicContact CD1-CD1 4.37Å; F861-L880 HydrophobicContact CE1-CD1 3.85Å; L862-L880 HydrophobicContact CD2-CB 3.75Å; L862-L880 HydrophobicContact CD2-CD1 4.16Å; L865-L880 HydrophobicContact CD1-CD1 3.71Å; L876-L880 HydrophobicContact CD1-CD1 3.76Å; L876-L880 HydrophobicContact CD1-CG 3.88Å; L876-L880 HydrophobicContact CG-CD1 3.81Å; L876-L880 HydrophobicContact CG-CG 4.39Å; L876-L880 WeakPolarHBondContact O-CG 3.33Å; L876-L880 PolarHBondContact O-N 2.78Å
881	D	81.3	Confident	75	Confident	18 Å²	18	67.2 Å²	67.2	10%	0.096	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.1	38.8	176.5	-162.7	28.8	0	0	0	112.9	L862 S877 F878 N883 E884 H885 Y886 K887	L862-D881 HydrophobicContact CD1-CB 4.35Å; S877-D881 PolarHBondContact O-N 3.24Å; F878-D881 CarbonylContact O-C 3.56Å; D881-N883 PolarHBondContact O-N 3.35Å; D881-N883 VanDerWaalsContact O-N 3.1Å; D881-E884 PolarHBondContact O-N 3.48Å; D881-E884 VanDerWaalsContact OD1-C 3.25Å; D881-E884 WeakPolarHBondContact OD1-CA 3.33Å; D881-E884 PolarHBondContact OD1-N 3.41Å; D881-H885 PolarHBondContact OD1-N 3.1Å; D881-Y886 HydrophobicContact CB-CD2 4.04Å; D881-Y886 VanDerWaalsContact OD1-CD2 3.32Å; D881-Y886 WeakPolarHBondContact OD1-CD2 3.44Å; D881-Y886 PolarHBondContact OD1-N 3.16Å; D881-Y886 PolarHBondContact OD2-N 3.26Å; D881-K887 WeakPolarHBondContact OD2-CB 3.34Å; D881-K887 PolarHBondContact OD2-N 3.29Å
882	F	70.5	Confident	74.1	Confident	132 Å²	132	68.4 Å²	68.4	58%	0.579	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-28.1	179.9	-179	-95.8	0	0	0	113.2	F878	F878-F882 AromaticContact CE1-CD2 3.82Å; F878-F882 HydrophobicContact CE1-CD2 3.82Å; F878-F882 HydrophobicContact CE1-CE2 4.14Å; F878-F882 HydrophobicContact CE2-CD2 4.4Å; F878-F882 AromaticContact CZ-CD2 3.67Å; F878-F882 HydrophobicContact CZ-CD2 3.67Å; F878-F882 AromaticContact CZ-CE2 3.88Å; F878-F882 HydrophobicContact CZ-CE2 3.88Å; F878-F882 WeakPolarHBondContact O-CA 3.47Å; F878-F882 PolarHBondContact O-N 3.11Å
883	N	69.4	Low	73.1	Confident	131 Å²	131	67.9 Å²	67.9	70%	0.701	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	3.9	178.5	-63.6	-31.2	0	0	0	113.7	D881 H885	D881-N883 PolarHBondContact O-N 3.35Å; D881-N883 VanDerWaalsContact O-N 3.1Å; N883-H885 PolarHBondContact O-N 2.77Å; N883-H885 VanDerWaalsContact O-N 3.1Å
884	E	70.1	Confident	71.9	Confident	101 Å²	101	74.7 Å²	74.7	47%	0.472	34%	0.343	S	S	.	.			trans	52.9	23.2	-173.1	-49.2	-154.2	160.6	0	0	115.2	D881 Y886 K887 A888	D881-E884 PolarHBondContact O-N 3.48Å; D881-E884 VanDerWaalsContact OD1-C 3.25Å; D881-E884 WeakPolarHBondContact OD1-CA 3.33Å; D881-E884 PolarHBondContact OD1-N 3.41Å; E884-Y886 VanDerWaalsContact C-N 3.34Å; E884-Y886 PolarHBondContact O-N 3Å; E884-K887 HydrophobicContact CB-CB 4.29Å; E884-K887 HydrophobicContact CB-CD 4.29Å; E884-K887 HydrophobicContact CG-CD 4.14Å; E884-K887 IonicContact OE1-NZ 3.67Å; E884-K887 PolarHBondContact OE1-NZ 2.98Å; E884-K887 IonicContact OE2-NZ 2.62Å; E884-K887 PolarHBondContact OE2-NZ 2.99Å; E884-A888 VanDerWaalsContact O-CB 3.26Å; E884-A888 WeakPolarHBondContact O-CB 3.43Å; E884-A888 PolarHBondContact O-N 2.79Å
885	H	75.4	Confident	70.4	Confident	70 Å²	70	77.5 Å²	77.5	32%	0.324	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-37.1	-177.1	178.7	-116.2	0	0	0	112.8	E710 D881 N883 R889	E710-H885 IonicContact OE1-CE1 2.69Å; E710-H885 PolarHBondContact OE1-CE1 2.69Å; E710-H885 IonicContact OE1-ND1 3.65Å; D881-H885 PolarHBondContact OD1-N 3.1Å; N883-H885 PolarHBondContact O-N 2.77Å; N883-H885 VanDerWaalsContact O-N 3.1Å; H885-R889 PolarHBondContact NE2-NH2 2.97Å
886	Y	75.6	Confident	68.5	Low	11 Å²	11	76.6 Å²	76.6	4%	0.043	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-40.4	178.5	-55.4	-78.8	0	0	0	111.3	E710 Q855 V858 L862 D881 E884 A888 R889 E890	E710-Y886 PolarHBondContact OE1-OH 3.08Å; Q855-Y886 HydrophobicContact CG-CD1 4.22Å; Q855-Y886 HydrophobicContact CG-CE1 4.22Å; V858-Y886 HydrophobicContact CB-CE1 4.29Å; V858-Y886 HydrophobicContact CG1-CD1 4.2Å; V858-Y886 HydrophobicContact CG1-CE1 3.74Å; V858-Y886 HydrophobicContact CG1-CE2 4.1Å; L862-Y886 HydrophobicContact CD1-CD2 3.67Å; L862-Y886 HydrophobicContact CD1-CE2 4.42Å; L862-Y886 HydrophobicContact CD1-CG 3.71Å; D881-Y886 HydrophobicContact CB-CD2 4.04Å; D881-Y886 VanDerWaalsContact OD1-CD2 3.32Å; D881-Y886 WeakPolarHBondContact OD1-CD2 3.44Å; D881-Y886 PolarHBondContact OD1-N 3.16Å; D881-Y886 PolarHBondContact OD2-N 3.26Å; E884-Y886 VanDerWaalsContact C-N 3.34Å; E884-Y886 PolarHBondContact O-N 3Å; Y886-A888 VanDerWaalsContact C-N 3.28Å; Y886-A888 PolarHBondContact O-N 3.08Å; Y886-R889 WeakPolarHBondContact O-CA 3.36Å; Y886-R889 WeakPolarHBondContact O-CB 3.31Å; Y886-R889 PolarHBondContact O-N 3.08Å; Y886-E890 PolarHBondContact O-N 3.25Å
887	K	66.7	Low	66.6	Low	64 Å²	64	82.7 Å²	82.7	28%	0.278	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-27.2	175.1	177.5	-177.1	173.7	-161.5	0	114.4	D881 E884 R889 L893 R894	D881-K887 WeakPolarHBondContact OD2-CB 3.34Å; D881-K887 PolarHBondContact OD2-N 3.29Å; E884-K887 HydrophobicContact CB-CB 4.29Å; E884-K887 HydrophobicContact CB-CD 4.29Å; E884-K887 HydrophobicContact CG-CD 4.14Å; E884-K887 IonicContact OE1-NZ 3.67Å; E884-K887 PolarHBondContact OE1-NZ 2.98Å; E884-K887 IonicContact OE2-NZ 2.62Å; E884-K887 PolarHBondContact OE2-NZ 2.99Å; K887-R889 VanDerWaalsContact C-N 3.29Å; K887-L893 HydrophobicContact CB-CB 4.1Å; K887-L893 HydrophobicContact CG-CB 4.27Å; K887-R894 HydrophobicContact CG-CG 4.32Å
888	A	62.1	Low	64.5	Low	68 Å²	68	85.1 Å²	85.1	56%	0.562	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-35.8	168.1	0	0	0	0	0	112.1	E884 Y886	E884-A888 VanDerWaalsContact O-CB 3.26Å; E884-A888 WeakPolarHBondContact O-CB 3.43Å; E884-A888 PolarHBondContact O-N 2.79Å; Y886-A888 VanDerWaalsContact C-N 3.28Å; Y886-A888 PolarHBondContact O-N 3.08Å
889	R	64.4	Low	62.2	Low	139 Å²	139	85.5 Å²	85.5	53%	0.525	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-34	-173.2	-58.7	179.1	-169.2	-132.2	-4.1	113.7	Q855 H885 Y886 K887	Q855-R889 VanDerWaalsContact OE1-CD 3.26Å; H885-R889 PolarHBondContact NE2-NH2 2.97Å; Y886-R889 WeakPolarHBondContact O-CA 3.36Å; Y886-R889 WeakPolarHBondContact O-CB 3.31Å; Y886-R889 PolarHBondContact O-N 3.08Å; K887-R889 VanDerWaalsContact C-N 3.29Å
890	E	65	Low	60.1	Low	29 Å²	29	94.7 Å²	94.7	14%	0.136	48%	0.48	C	S	.	.			trans	-115	119.7	177.8	-166.1	-179.2	-175.2	0	0	112.9	V863 Y886 R892 L893	V863-E890 WeakPolarHBondContact CG2-OE2 3.42Å; Y886-E890 PolarHBondContact O-N 3.25Å; E890-R892 VanDerWaalsContact C-N 3.26Å; E890-R892 HydrophobicContact CG-CB 4.19Å; E890-R892 PolarHBondContact O-N 2.78Å; E890-R892 WeakPolarHBondContact OE1-CD 3.38Å; E890-R892 IonicContact OE1-NH1 3.16Å; E890-L893 HydrophobicContact CB-CD1 4.24Å; E890-L893 HydrophobicContact CB-CG 4.4Å; E890-L893 PolarHBondContact O-N 3.45Å
891	P	60.4	Low	57.8	Low	90 Å²	90	98.3 Å²	98.3	58%	0.584	52%	0.518	S	S	*	.	G	3₁₀ helix	trans	-70.6	-16.5	-177.2	28.7	-35.2	0	0	0	114.1	L893 R894	P891-L893 VanDerWaalsContact C-N 3.31Å; P891-L893 PolarHBondContact O-N 3.17Å; P891-R894 VanDerWaalsContact O-CB 3.29Å; P891-R894 WeakPolarHBondContact O-CB 3.41Å; P891-R894 WeakPolarHBondContact O-CG 3.25Å; P891-R894 PolarHBondContact O-N 3.11Å
892	R	60.1	Low	55.4	Low	178 Å²	178	109 Å²	109	67%	0.672	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-67.2	-31.8	176.9	-67.6	-176.1	177	146.3	-8.3	112.5	V863 E890 R894	V863-R892 HydrophobicContact CG2-CB 4.25Å; E890-R892 VanDerWaalsContact C-N 3.26Å; E890-R892 HydrophobicContact CG-CB 4.19Å; E890-R892 PolarHBondContact O-N 2.78Å; E890-R892 WeakPolarHBondContact OE1-CD 3.38Å; E890-R892 IonicContact OE1-NH1 3.16Å; R892-R894 PolarHBondContact O-N 3.23Å; R892-R894 VanDerWaalsContact O-N 3.12Å
893	L	58.3	Low	53.7	Low	19 Å²	19	114.4 Å²	114.4	10%	0.099	57%	0.573	C	S	.	*	G	3₁₀ helix	trans	-70.9	0.4	175.1	-61.1	174.8	0	0	0	113.5	L862 V863 T866 K887 E890 P891	L862-L893 HydrophobicContact CB-CD1 4.34Å; L862-L893 HydrophobicContact CB-CD2 3.76Å; L862-L893 HydrophobicContact CD1-CD1 4.3Å; V863-L893 HydrophobicContact CB-CD2 4.45Å; V863-L893 HydrophobicContact CG2-CD2 3.68Å; V863-L893 HydrophobicContact CG2-CG 4.19Å; T866-L893 HydrophobicContact CG2-CD2 4.4Å; K887-L893 HydrophobicContact CB-CB 4.1Å; K887-L893 HydrophobicContact CG-CB 4.27Å; E890-L893 HydrophobicContact CB-CD1 4.24Å; E890-L893 HydrophobicContact CB-CG 4.4Å; E890-L893 PolarHBondContact O-N 3.45Å; P891-L893 VanDerWaalsContact C-N 3.31Å; P891-L893 PolarHBondContact O-N 3.17Å
894	R	56.1	Low	52	Low	154 Å²	154	114 Å²	114	58%	0.581	58%	0.581	S	S	*	*	G	3₁₀ helix	trans	-86.9	-0.8	178.1	-58.7	-179.4	-179.2	-175.3	0.7	114.1	K887 P891 R892 S896	K887-R894 HydrophobicContact CG-CG 4.32Å; P891-R894 VanDerWaalsContact O-CB 3.29Å; P891-R894 WeakPolarHBondContact O-CB 3.41Å; P891-R894 WeakPolarHBondContact O-CG 3.25Å; P891-R894 PolarHBondContact O-N 3.11Å; R892-R894 PolarHBondContact O-N 3.23Å; R892-R894 VanDerWaalsContact O-N 3.12Å; R894-S896 PolarHBondContact O-N 2.99Å
895	V	50.7	Low	50.2	Low	121 Å²	121	114.3 Å²	114.3	73%	0.733	59%	0.594	S	S	*	*			trans	-68.7	95.6	173.4	-179.3	0	0	0	0	108.9
896	S	42.1	Very low	48.2	Very low	86 Å²	86	119.9 Å²	119.9	60%	0.601	62%	0.62	S	S	*	*			trans	-72.9	134.8	-173.2	52.2	0	0	0	0	112.2	R894 G898	R894-S896 PolarHBondContact O-N 2.99Å; S896-G898 PolarHBondContact O-N 3.22Å
897	L	45	Very low	46.2	Very low	129 Å²	129	130 Å²	130	68%	0.675	68%	0.684	S	S	*	*	S	Bend	trans	-66.6	13	175.5	-109.2	117	0	0	0	114.4	R874	R874-L897 HydrophobicContact CB-CD1 4.12Å; R874-L897 HydrophobicContact CB-CD2 4.36Å; R874-L897 HydrophobicContact CG-CD1 4.46Å
898	G	38.5	Very low	45.1	Very low	64 Å²	64	133.4 Å²	133.4	66%	0.66	70%	0.704	S	S	*	*	S	Bend	trans	-110.5	17.9	-159.8	0	0	0	0	0	116.8	S896	S896-G898 PolarHBondContact O-N 3.22Å
899	T	33.4	Very low	44.2	Very low	124 Å²	124	136.8 Å²	136.8	76%	0.761	71%	0.711	S	S	*	*	S	Bend	trans	-146.4	10.6	-174.8	-16.5	0	0	0	0	117.5
900	R	35.5	Very low	43.1	Very low	256 Å²	256	136.7 Å²	136.7	97%	0.966	72%	0.722	S	S	*	*	S	Bend	trans	-103.4	2.8	-176.7	-126.2	179.4	-172.8	-171.2	1.2	116.9
901	G	32.7	Very low	41.8	Very low	80 Å²	80	143 Å²	143	83%	0.825	76%	0.756	S	S	*	*	S	Bend	trans	-107.3	7.9	-173.4	0	0	0	0	0	117.5
902	R	32.4	Very low	40.7	Very low	242 Å²	242	146.3 Å²	146.3	91%	0.913	77%	0.767	S	S	*	*	S	Bend	trans	-154.6	53.4	-170.5	-147.2	178.1	-167.5	-169.8	4.1	117.6
903	R	34.3	Very low	39.4	Very low	247 Å²	247	144.2 Å²	144.2	93%	0.932	77%	0.773	S	S	*	*			trans	-170.3	78.3	162	-111.9	169.6	-171	-171.7	2.7	113.8
904	S	32.2	Very low	38	Very low	122 Å²	122	153.1 Å²	153.1	85%	0.853	82%	0.821	S	S	*	*			trans	-166.5	63.9	166.9	58.2	0	0	0	0	112.4
905	S	32.6	Very low	36.6	Very low	108 Å²	108	153.1 Å²	153.1	76%	0.755	84%	0.84	S	S	*	*			trans	-155.8	46.7	176.9	67.8	0	0	0	0	112.7
906	H	33.3	Very low	35.5	Very low	186 Å²	186	155.8 Å²	155.8	86%	0.861	85%	0.849	S	S	*	*			trans	-152.6	72.5	169.4	-92.2	-51.9	0	0	0	110.6
907	T	33.7	Very low	34.9	Very low	225 Å²	225	162.1 Å²	162.1	100%	1.38	87%	0.871	S	S	*	*			trans	-168.4	0	147.9	7.5	0	0	0	0	107.1

Retrieved 907 of 907 residues in 1207 ms (Link to these results)

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