A0A087XJX6_POEFO Loading...

Chloride channel protein

AlphaFold DB , UniProt , Accession A0A087XJX6, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 769 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.9	Very low	27.5	Very low	245 Å²	245	131.2 Å²	131.2	100%	1.207	83%	0.831	S	S	*	*				0	74.7	0	-76	170.6	163.7	0	0	106.3
2	A	26.6	Very low	27.6	Very low	96 Å²	96	128.8 Å²	128.8	79%	0.793	82%	0.818	S	S	*	*				65.7	93.4	90.7	0	0	0	0	0	110.2
3	A	25.7	Very low	27.2	Very low	98 Å²	98	129.2 Å²	129.2	81%	0.81	82%	0.818	S	S	*	*				82.1	115.9	84.6	0	0	0	0	0	111.6
4	A	26.6	Very low	27.6	Very low	89 Å²	89	133.6 Å²	133.6	74%	0.736	82%	0.823	S	S	*	*				116.8	150.2	110.7	0	0	0	0	0	107.3
5	E	27.3	Very low	27.3	Very low	193 Å²	193	137.1 Å²	137.1	90%	0.902	83%	0.826	S	S	*	*			cis	-166.8	170.7	9.2	-123	164.7	-170.9	0	0	106.9
6	G	25.5	Very low	27.6	Very low	70 Å²	70	139.6 Å²	139.6	72%	0.722	83%	0.829	S	S	*	*			trans	-84.2	-179.9	-160.4	0	0	0	0	0	117.2
7	V	26.6	Very low	27.4	Very low	148 Å²	148	141.2 Å²	141.2	90%	0.897	83%	0.833	S	S	*	*			trans	-144.1	132.9	150.4	-179.6	0	0	0	0	109.5
8	S	24.5	Very low	27.5	Very low	104 Å²	104	137.7 Å²	137.7	73%	0.727	83%	0.831	S	S	*	*			trans	-76.9	156.4	-172.6	46.5	0	0	0	0	115.4
9	L	26.9	Very low	27.4	Very low	159 Å²	159	135.5 Å²	135.5	83%	0.832	83%	0.829	S	S	*	*			trans	-50.2	156.1	158.6	-84.5	128.9	0	0	0	112.8
10	P	25.2	Very low	27.4	Very low	115 Å²	115	132.8 Å²	132.8	75%	0.747	83%	0.829	S	S	*	*				-134.1	137	121.8	34.1	-21.4	0	0	0	113
11	T	29.5	Very low	27.4	Very low	126 Å²	126	132 Å²	132	77%	0.773	82%	0.824	S	S	*	*			trans	-67.7	146.1	150.9	45.4	0	0	0	0	109.6
12	P	28.5	Very low	26.9	Very low	103 Å²	103	128.1 Å²	128.1	67%	0.669	81%	0.807	S	S	*	*				-147.8	130.6	121.1	38.4	-21.5	0	0	0	112.9
13	T	23.3	Very low	26.9	Very low	133 Å²	133	130.9 Å²	130.9	82%	0.816	81%	0.805	S	S	*	*				89	126.7	104.5	58.6	0	0	0	0	115.5
14	E	32.2	Very low	26.9	Very low	191 Å²	191	132.6 Å²	132.6	89%	0.893	80%	0.801	S	S	*	*			trans	-53.5	132.8	163.6	-66.2	173.3	130.3	0	0	111.6
15	E	23.3	Very low	26.8	Very low	187 Å²	187	136.8 Å²	136.8	87%	0.874	80%	0.803	S	S	*	*			trans	-143	126.2	145.7	-84.9	-164	160.2	0	0	110.5
16	M	31.8	Very low	26.9	Very low	176 Å²	176	134.8 Å²	134.8	87%	0.867	80%	0.798	S	S	*	*			trans	-59.7	129.9	162.4	-78.1	155.7	41.8	0	0	110.3
17	N	24.8	Very low	27	Very low	168 Å²	168	138.3 Å²	138.3	90%	0.898	80%	0.8	S	S	*	*			trans	-167	138.3	135.3	-97.1	-29.1	0	0	0	112
18	G	28.1	Very low	27	Very low	77 Å²	77	138.7 Å²	138.7	79%	0.794	79%	0.792	S	S	*	*			trans	-86.8	151.2	-174.4	0	0	0	0	0	114.1
19	A	25.7	Very low	27.1	Very low	96 Å²	96	139.2 Å²	139.2	79%	0.793	79%	0.793	S	S	*	*			trans	-173.9	75.6	145.1	0	0	0	0	0	105.8	T21	A19-T21 PolarHBondContact O-N 2.85Å
20	G	27.4	Very low	27.5	Very low	81 Å²	81	135.9 Å²	135.9	84%	0.835	77%	0.772	S	S	*	*			trans	-68.2	110.8	175.5	0	0	0	0	0	109.8	L22	G20-L22 PolarHBondContact O-N 2.84Å
21	T	27.6	Very low	27.8	Very low	116 Å²	116	135.1 Å²	135.1	71%	0.712	77%	0.767	S	S	*	*			trans	-58.6	112.6	177.6	-12.5	0	0	0	0	110.2	A19 M23	A19-T21 PolarHBondContact O-N 2.85Å; T21-M23 PolarHBondContact O-N 2.72Å; T21-M23 VanDerWaalsContact O-N 3.07Å
22	L	28.4	Very low	27.8	Very low	164 Å²	164	134.7 Å²	134.7	86%	0.859	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	5	178.5	-163.2	73.6	0	0	0	113.6	G20	G20-L22 PolarHBondContact O-N 2.84Å
23	M	25.9	Very low	28.4	Very low	154 Å²	154	132.5 Å²	132.5	76%	0.759	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.4	-3.7	-171.2	-79.2	-164.6	177.3	0	0	115.6	T21 F25	T21-M23 PolarHBondContact O-N 2.72Å; T21-M23 VanDerWaalsContact O-N 3.07Å; M23-F25 VanDerWaalsContact C-N 3.31Å; M23-F25 PolarHBondContact O-N 2.92Å
24	D	25.6	Very low	28.9	Very low	134 Å²	134	127.6 Å²	127.6	72%	0.717	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	0.8	-178.4	-103.2	-7.6	0	0	0	115
25	F	25.8	Very low	29.2	Very low	178 Å²	178	121.8 Å²	121.8	78%	0.781	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-1.3	178.6	-85.2	-77	0	0	0	114.8	M23	M23-F25 VanDerWaalsContact C-N 3.31Å; M23-F25 PolarHBondContact O-N 2.92Å
26	L	29.3	Very low	30	Very low	150 Å²	150	114.1 Å²	114.1	79%	0.785	66%	0.661	S	S	*	*	S	Bend	trans	-101.9	-12.2	-174.3	-67.3	176.8	0	0	0	114.6
27	D	26.9	Very low	30.3	Very low	144 Å²	144	113.2 Å²	113.2	77%	0.77	66%	0.655	S	S	*	*	S	Bend	trans	-112.6	6.8	-175.1	-78.7	-25.8	0	0	0	114.7	P29	D27-P29 WeakPolarHBondContact O-CD 3.29Å
28	E	26.8	Very low	31	Very low	157 Å²	157	110.4 Å²	110.4	73%	0.734	64%	0.64	S	S	*	*	S	Bend	trans	-71.1	117.4	162.8	-84.1	-172.2	163.7	0	0	108.9	F30	E28-F30 PolarHBondContact O-N 2.8Å
29	P	25.8	Very low	32.2	Very low	115 Å²	115	108 Å²	108	75%	0.747	61%	0.607	S	S	*	*			trans	-54.4	142.9	159.5	25.4	-30	0	0	0	107	D27	D27-P29 WeakPolarHBondContact O-CD 3.29Å
30	F	35.6	Very low	34	Very low	88 Å²	88	106.5 Å²	106.5	39%	0.386	58%	0.584	S	S	.	*			trans	-34.7	150.8	179.5	-62.4	-87.9	0	0	0	111.9	E28 D32 P378	E28-F30 PolarHBondContact O-N 2.8Å; F30-D32 PolarHBondContact O-N 3.38Å; F30-P378 HydrophobicContact CE1-CG 4.34Å; F30-P378 HydrophobicContact CZ-CG 3.84Å
31	P	31.5	Very low	35.9	Very low	100 Å²	100	103.8 Å²	103.8	65%	0.649	55%	0.551	S	S	*	*			trans	-57.6	98.9	160.1	26.1	-30.3	0	0	0	105.9	V33	P31-V33 PolarHBondContact O-N 3.47Å
32	D	30.1	Very low	38	Very low	117 Å²	117	98.8 Å²	98.8	63%	0.626	52%	0.52	S	S	*	.			trans	-50.8	133.6	157	-116.5	-16.7	0	0	0	104.1	F30 G34	F30-D32 PolarHBondContact O-N 3.38Å; D32-G34 WeakPolarHBondContact O-CA 3.42Å; D32-G34 PolarHBondContact O-N 3.15Å
33	V	40.3	Very low	40.1	Very low	56 Å²	56	92.5 Å²	92.5	34%	0.339	49%	0.487	S	S	.	.	S	Bend	trans	-43.6	108.1	-170.6	174.2	0	0	0	0	108.1	P31 T35 N588 Y590	P31-V33 PolarHBondContact O-N 3.47Å; V33-T35 PolarHBondContact O-N 3.41Å; V33-N588 WeakPolarHBondContact CG1-O 3.4Å; V33-Y590 HydrophobicContact CG1-CE1 4.18Å
34	G	34.8	Very low	42.4	Very low	30 Å²	30	87.6 Å²	87.6	31%	0.309	46%	0.461	S	S	.	.			trans	-39.9	128.4	-162.8	0	0	0	0	0	113.2	D32 Y36	D32-G34 WeakPolarHBondContact O-CA 3.42Å; D32-G34 PolarHBondContact O-N 3.15Å; G34-Y36 PolarHBondContact O-N 3.15Å
35	T	37.1	Very low	44.7	Very low	69 Å²	69	84.8 Å²	84.8	42%	0.423	45%	0.445	S	S	.	.			trans	-35.6	135.9	163.2	41.7	0	0	0	0	109.4	V33 E37 D38 N769	V33-T35 PolarHBondContact O-N 3.41Å; T35-E37 PolarHBondContact O-N 2.93Å; T35-D38 PolarHBondContact O-N 2.97Å; T35-N769 WeakPolarHBondContact CG2-OXT 3.24Å
36	Y	40.4	Very low	47	Very low	26 Å²	26	79 Å²	79	10%	0.102	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.3	-3.9	-176.2	-115	-107.9	0	0	0	116	G34 G589 P591 K749 I766	G34-Y36 PolarHBondContact O-N 3.15Å; Y36-G589 WeakPolarHBondContact CE2-O 3.32Å; Y36-P591 HydrophobicContact CD1-CG 4.46Å; Y36-P591 HydrophobicContact CE1-CB 3.53Å; Y36-P591 HydrophobicContact CE1-CG 3.74Å; Y36-P591 HydrophobicContact CE2-CG 4.4Å; Y36-P591 VanDerWaalsContact CZ-CB 3.48Å; Y36-P591 WeakPolarHBondContact OH-CA 3.44Å; Y36-P591 WeakPolarHBondContact OH-CB 3.46Å; Y36-K749 HydrophobicContact CD1-CD 4.21Å; Y36-K749 HydrophobicContact CD1-CG 4.43Å; Y36-K749 HydrophobicContact CE1-CG 4.49Å; Y36-K749 PolarHBondContact O-NZ 3.43Å; Y36-I766 WeakPolarHBondContact CD2-O 3.36Å; Y36-I766 HydrophobicContact CE2-CG2 4.1Å; Y36-I766 WeakPolarHBondContact CE2-O 3.29Å; Y36-I766 WeakPolarHBondContact OH-CG2 3.23Å
37	E	38.8	Very low	49.4	Very low	157 Å²	157	72.7 Å²	72.7	73%	0.734	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-29	-179.9	-55.9	-156.5	154.6	0	0	112.6	T35	T35-E37 PolarHBondContact O-N 2.93Å
38	D	39.6	Very low	51.9	Low	109 Å²	109	72.6 Å²	72.6	58%	0.583	38%	0.377	S	S	*	.	S	Bend	trans	-81.6	-14.1	-179.8	-85.1	-18.8	0	0	0	114.7	T35 H40	T35-D38 PolarHBondContact O-N 2.97Å; D38-H40 PolarHBondContact O-N 3.28Å
39	F	53.6	Low	54.4	Low	26 Å²	26	68 Å²	68	11%	0.114	36%	0.363	C	S	.	.			trans	-88	102	-179.4	-60.5	-65.7	0	0	0	112.1	F202 I204 Y590	F39-F202 HydrophobicContact CB-CD1 4.15Å; F39-I204 HydrophobicContact CD1-CG1 4.38Å; F39-I204 HydrophobicContact CE1-CD1 4.42Å; F39-I204 HydrophobicContact CE1-CG1 3.91Å; F39-Y590 HydrophobicContact CZ-CD1 4.25Å; F39-Y590 HydrophobicContact CZ-CE1 4.23Å
40	H	62.1	Low	56.9	Low	65 Å²	65	67.9 Å²	67.9	30%	0.301	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	133.2	169.1	-62.9	-60.4	0	0	0	111.8	D38 I203 R205	D38-H40 PolarHBondContact O-N 3.28Å; H40-I203 PolarHBondContact O-N 3.26Å; H40-R205 PolarHBondContact NE2-NH2 3.19Å
41	T	68.1	Low	59.1	Low	24 Å²	24	65 Å²	65	15%	0.147	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	137	171.1	53	0	0	0	0	111.3	G201 F202 R732 K748	T41-G201 WeakPolarHBondContact CA-O 3.34Å; T41-F202 HydrophobicContact CG2-CD1 3.79Å; T41-F202 HydrophobicContact CG2-CE1 3.35Å; T41-F202 HydrophobicContact CG2-CZ 4.01Å; T41-R732 WeakPolarHBondContact OG1-CD 3.41Å; T41-R732 WeakPolarHBondContact OG1-CG 3.17Å; T41-R732 PolarHBondContact OG1-NE 3.42Å; T41-K748 HydrophobicContact CG2-CD 4.43Å
42	I	71.2	Confident	61.7	Low	12 Å²	12	63.1 Å²	63.1	6%	0.062	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-78.5	155.3	173.9	62.7	161.6	0	0	0	112.3	W44 G201 I203 E258	I42-W44 HydrophobicContact CD1-CD2 3.51Å; I42-W44 HydrophobicContact CD1-CE3 3.84Å; I42-W44 HydrophobicContact CD1-CG 4.11Å; I42-W44 HydrophobicContact CD1-CH2 3.9Å; I42-W44 HydrophobicContact CD1-CZ2 3.56Å; I42-W44 HydrophobicContact CD1-CZ3 4.02Å; I42-W44 HydrophobicContact CG1-CD2 4.3Å; I42-W44 HydrophobicContact CG1-CG 4.49Å; I42-W44 HydrophobicContact CG1-CZ2 4.38Å; I42-G201 PolarHBondContact N-O 2.77Å; I42-I203 HydrophobicContact CG2-CD1 3.82Å; I42-I203 HydrophobicContact CG2-CG1 4.28Å; I42-E258 HydrophobicContact CG2-CB 3.87Å; I42-E258 HydrophobicContact CG2-CG 4.25Å
43	D	72.3	Confident	64.1	Low	31 Å²	31	61 Å²	61	17%	0.166	31%	0.311	C	S	.	.			trans	-107.7	96.9	171.6	-180	-8.8	0	0	0	108.7	L45 R46 E47	D43-L45 VanDerWaalsContact C-N 3.29Å; D43-L45 PolarHBondContact O-N 3.42Å; D43-L45 PolarHBondContact OD1-N 3.38Å; D43-R46 HydrophobicContact CB-CB 4.04Å; D43-R46 PolarHBondContact O-N 2.83Å; D43-R46 PolarHBondContact OD1-N 2.93Å; D43-R46 WeakPolarHBondContact OD2-CB 3.46Å; D43-E47 PolarHBondContact O-N 2.91Å
44	W	74.1	Confident	66.2	Low	52 Å²	52	61.9 Å²	61.9	20%	0.197	31%	0.308	C	S	.	.	H	α-helix	trans	-62.3	-35.2	-175.5	-63.2	91.6	0	0	0	113	I42 E47 K48 R262	I42-W44 HydrophobicContact CD1-CD2 3.51Å; I42-W44 HydrophobicContact CD1-CE3 3.84Å; I42-W44 HydrophobicContact CD1-CG 4.11Å; I42-W44 HydrophobicContact CD1-CH2 3.9Å; I42-W44 HydrophobicContact CD1-CZ2 3.56Å; I42-W44 HydrophobicContact CD1-CZ3 4.02Å; I42-W44 HydrophobicContact CG1-CD2 4.3Å; I42-W44 HydrophobicContact CG1-CG 4.49Å; I42-W44 HydrophobicContact CG1-CZ2 4.38Å; W44-E47 PolarHBondContact O-N 3.2Å; W44-K48 VanDerWaalsContact O-CB 3.3Å; W44-K48 WeakPolarHBondContact O-CB 3.49Å; W44-K48 PolarHBondContact O-N 3.09Å; W44-R262 HydrophobicContact CH2-CB 4.11Å; W44-R262 VanDerWaalsContact CH2-CD 3.47Å; W44-R262 HydrophobicContact CH2-CG 4.44Å; W44-R262 HydrophobicContact CZ3-CB 4.49Å
45	L	74.3	Confident	68.6	Low	74 Å²	74	64.6 Å²	64.6	39%	0.387	31%	0.313	S	S	.	.	H	α-helix	trans	-64.5	-45.9	178.5	-74	175.4	0	0	0	110.4	D43 K48 S49 F711 L731	D43-L45 VanDerWaalsContact C-N 3.29Å; D43-L45 PolarHBondContact O-N 3.42Å; D43-L45 PolarHBondContact OD1-N 3.38Å; L45-K48 PolarHBondContact O-N 2.89Å; L45-S49 PolarHBondContact O-N 3.04Å; L45-F711 HydrophobicContact CD1-CD2 4.2Å; L45-L731 HydrophobicContact CD1-CD2 3.46Å; L45-L731 VanDerWaalsContact CD1-CD2 3.46Å; L45-L731 HydrophobicContact CG-CD2 4.05Å
46	R	75.1	Confident	71	Confident	56 Å²	56	69.5 Å²	69.5	21%	0.211	32%	0.324	C	S	.	.	H	α-helix	trans	-63.6	-44.3	177.7	-174.8	174.6	-178	-172.6	-1	112.1	D43 K48 S49 R50 D662	D43-R46 HydrophobicContact CB-CB 4.04Å; D43-R46 PolarHBondContact O-N 2.83Å; D43-R46 PolarHBondContact OD1-N 2.93Å; D43-R46 WeakPolarHBondContact OD2-CB 3.46Å; R46-K48 VanDerWaalsContact C-N 3.32Å; R46-K48 PolarHBondContact O-N 3.38Å; R46-S49 PolarHBondContact O-N 2.93Å; R46-R50 WeakPolarHBondContact O-CG 3.48Å; R46-R50 PolarHBondContact O-N 3.46Å; R46-D662 IonicContact CZ-OD2 3.61Å; R46-D662 IonicContact NH1-OD2 2.66Å; R46-D662 PolarHBondContact NH1-OD2 2.94Å; R46-D662 VanDerWaalsContact NH2-CG 3.34Å; R46-D662 IonicContact NH2-OD1 3.38Å; R46-D662 PolarHBondContact NH2-OD1 3.3Å; R46-D662 IonicContact NH2-OD2 2.84Å; R46-D662 PolarHBondContact NH2-OD2 3.39Å
47	E	78.6	Confident	73.2	Confident	18 Å²	18	75 Å²	75	8%	0.084	35%	0.348	C	S	.	.	H	α-helix	trans	-63.5	-38.1	178	-70.7	-56.5	147.8	0	0	112	D43 W44 R50 D51 N257	D43-E47 PolarHBondContact O-N 2.91Å; W44-E47 PolarHBondContact O-N 3.2Å; E47-R50 PolarHBondContact O-N 2.95Å; E47-D51 PolarHBondContact O-N 2.84Å; E47-N257 PolarHBondContact OE2-OD1 3.33Å
48	K	79.9	Confident	75.4	Confident	142 Å²	142	69.1 Å²	69.1	62%	0.617	32%	0.321	S	S	*	.	H	α-helix	trans	-65.1	-41.3	174.2	-173.3	175.7	-178.9	178.8	0	112.3	W44 L45 R46 D51 T52	W44-K48 VanDerWaalsContact O-CB 3.3Å; W44-K48 WeakPolarHBondContact O-CB 3.49Å; W44-K48 PolarHBondContact O-N 3.09Å; L45-K48 PolarHBondContact O-N 2.89Å; R46-K48 VanDerWaalsContact C-N 3.32Å; R46-K48 PolarHBondContact O-N 3.38Å; K48-D51 PolarHBondContact O-N 3.02Å; K48-T52 PolarHBondContact O-N 2.86Å; K48-T52 PolarHBondContact O-OG1 3.37Å
49	S	78.8	Confident	77.6	Confident	62 Å²	62	67 Å²	67	43%	0.434	31%	0.313	S	S	.	.	H	α-helix	trans	-62	-47.4	174.4	-169.9	0	0	0	0	111.2	L45 R46 D51 T52 D53	L45-S49 PolarHBondContact O-N 3.04Å; R46-S49 PolarHBondContact O-N 2.93Å; S49-D51 VanDerWaalsContact C-N 3.3Å; S49-D51 PolarHBondContact O-N 3.36Å; S49-T52 WeakPolarHBondContact O-CB 3.38Å; S49-T52 PolarHBondContact O-N 2.91Å; S49-T52 VanDerWaalsContact O-N 3.16Å; S49-D53 PolarHBondContact O-N 2.9Å
50	R	77.8	Confident	79.3	Confident	111 Å²	111	68.9 Å²	68.9	42%	0.419	33%	0.329	S	S	.	.	H	α-helix	trans	-59	-40.1	178.1	-74.7	175.3	64.4	143.9	-0.8	112.4	R46 E47 R54	R46-R50 WeakPolarHBondContact O-CG 3.48Å; R46-R50 PolarHBondContact O-N 3.46Å; E47-R50 PolarHBondContact O-N 2.95Å; R50-R54 WeakPolarHBondContact O-CB 3.39Å; R50-R54 PolarHBondContact O-N 3.12Å; R50-R54 VanDerWaalsContact O-N 3.07Å
51	D	83	Confident	80.4	Confident	29 Å²	29	70.8 Å²	70.8	16%	0.155	34%	0.336	C	S	.	.	H	α-helix	trans	-65.9	-43.1	176.5	-165.1	46.1	0	0	0	111.6	E47 K48 S49 D53 R54 H55 K260	E47-D51 PolarHBondContact O-N 2.84Å; K48-D51 PolarHBondContact O-N 3.02Å; S49-D51 VanDerWaalsContact C-N 3.3Å; S49-D51 PolarHBondContact O-N 3.36Å; D51-D53 PolarHBondContact O-N 2.83Å; D51-R54 PolarHBondContact O-N 2.9Å; D51-H55 WeakPolarHBondContact O-CB 3.39Å; D51-H55 PolarHBondContact O-N 2.68Å; D51-K260 WeakPolarHBondContact OD2-CE 3.43Å
52	T	85	Confident	81.2	Confident	60 Å²	60	70.6 Å²	70.6	37%	0.368	34%	0.336	S	S	.	.	H	α-helix	trans	-62	-45.3	178.5	-54.4	0	0	0	0	111.5	K48 S49 H55 R56	K48-T52 PolarHBondContact O-N 2.86Å; K48-T52 PolarHBondContact O-OG1 3.37Å; S49-T52 WeakPolarHBondContact O-CB 3.38Å; S49-T52 PolarHBondContact O-N 2.91Å; S49-T52 VanDerWaalsContact O-N 3.16Å; T52-H55 PolarHBondContact O-N 3.16Å; T52-R56 WeakPolarHBondContact O-CG 3.17Å; T52-R56 PolarHBondContact O-N 3.2Å
53	D	82.2	Confident	81.9	Confident	72 Å²	72	78.6 Å²	78.6	39%	0.385	37%	0.37	S	S	.	.	H	α-helix	trans	-65.9	-39.2	178	-70.3	-25.3	0	0	0	112.2	S49 D51 K57	S49-D53 PolarHBondContact O-N 2.9Å; D51-D53 PolarHBondContact O-N 2.83Å; D53-K57 WeakPolarHBondContact O-CG 3.46Å; D53-K57 PolarHBondContact O-N 2.94Å; D53-K57 VanDerWaalsContact O-N 3.11Å
54	R	84.4	Confident	82.7	Confident	74 Å²	74	84.4 Å²	84.4	28%	0.279	40%	0.396	S	S	.	.	H	α-helix	trans	-61.1	-46.4	172.6	174.2	-175	165.5	149.4	-2.2	110.6	R50 D51 R56 K57 I58 D75	R50-R54 WeakPolarHBondContact O-CB 3.39Å; R50-R54 PolarHBondContact O-N 3.12Å; R50-R54 VanDerWaalsContact O-N 3.07Å; D51-R54 PolarHBondContact O-N 2.9Å; R54-R56 PolarHBondContact O-N 3.37Å; R54-K57 PolarHBondContact O-N 3.14Å; R54-I58 HydrophobicContact CG-CD1 3.81Å; R54-I58 WeakPolarHBondContact O-CG1 3.42Å; R54-I58 PolarHBondContact O-N 2.86Å; R54-D75 IonicContact CZ-OD1 3.88Å; R54-D75 IonicContact NH2-OD1 2.62Å; R54-D75 PolarHBondContact NH2-OD1 2.84Å
55	H	85.4	Confident	83.4	Confident	87 Å²	87	84.6 Å²	84.6	40%	0.403	41%	0.406	S	S	.	.	H	α-helix	trans	-60	-47.7	179.8	-124.9	71.5	0	0	0	111.2	D51 T52 K57 I58 T59	D51-H55 WeakPolarHBondContact O-CB 3.39Å; D51-H55 PolarHBondContact O-N 2.68Å; T52-H55 PolarHBondContact O-N 3.16Å; H55-K57 VanDerWaalsContact C-N 3.31Å; H55-K57 PolarHBondContact O-N 3.05Å; H55-I58 PolarHBondContact O-N 3.37Å; H55-I58 VanDerWaalsContact O-N 3.14Å; H55-T59 PolarHBondContact O-N 3.08Å; H55-T59 PolarHBondContact O-OG1 3.28Å
56	R	86.8	Confident	84.1	Confident	173 Å²	173	87.3 Å²	87.3	65%	0.653	42%	0.419	S	S	*	.	H	α-helix	trans	-55.8	-44.3	176.2	-73.5	175	177.1	-179.3	-2.6	112.2	T52 R54 T59 S60	T52-R56 WeakPolarHBondContact O-CG 3.17Å; T52-R56 PolarHBondContact O-N 3.2Å; R54-R56 PolarHBondContact O-N 3.37Å; R56-T59 PolarHBondContact O-N 3.47Å; R56-S60 WeakPolarHBondContact O-CB 3.37Å; R56-S60 PolarHBondContact O-N 2.9Å; R56-S60 PolarHBondContact O-OG 2.88Å
57	K	86.3	Confident	84.8	Confident	140 Å²	140	94.3 Å²	94.3	61%	0.609	45%	0.446	S	S	*	.	H	α-helix	trans	-64.9	-37.4	177.7	-72.3	172.9	-175	178.1	0	113.2	D53 R54 H55 S60 K61	D53-K57 WeakPolarHBondContact O-CG 3.46Å; D53-K57 PolarHBondContact O-N 2.94Å; D53-K57 VanDerWaalsContact O-N 3.11Å; R54-K57 PolarHBondContact O-N 3.14Å; H55-K57 VanDerWaalsContact C-N 3.31Å; H55-K57 PolarHBondContact O-N 3.05Å; K57-S60 PolarHBondContact O-OG 3.07Å; K57-K61 WeakPolarHBondContact O-CB 3.48Å; K57-K61 WeakPolarHBondContact O-CG 3.4Å; K57-K61 PolarHBondContact O-N 2.87Å
58	I	85.6	Confident	85.2	Confident	34 Å²	34	96 Å²	96	17%	0.174	45%	0.454	C	S	.	.	H	α-helix	trans	-70.7	-45.8	177.6	-66.7	168.9	0	0	0	109.7	R54 H55 S60 K61 S62	R54-I58 HydrophobicContact CG-CD1 3.81Å; R54-I58 WeakPolarHBondContact O-CG1 3.42Å; R54-I58 PolarHBondContact O-N 2.86Å; H55-I58 PolarHBondContact O-N 3.37Å; H55-I58 VanDerWaalsContact O-N 3.14Å; I58-S60 VanDerWaalsContact C-N 3.33Å; I58-S60 PolarHBondContact O-N 2.91Å; I58-K61 PolarHBondContact O-N 2.7Å; I58-S62 WeakPolarHBondContact O-CB 3.48Å; I58-S62 PolarHBondContact O-N 3.23Å
59	T	85.5	Confident	85.6	Confident	66 Å²	66	93.1 Å²	93.1	41%	0.405	45%	0.445	S	S	.	.	H	α-helix	trans	-67.3	-30.7	179.1	-52.2	0	0	0	0	113.1	H55 R56 S62	H55-T59 PolarHBondContact O-N 3.08Å; H55-T59 PolarHBondContact O-OG1 3.28Å; R56-T59 PolarHBondContact O-N 3.47Å; T59-S62 PolarHBondContact O-OG 3.22Å
60	S	88.4	Confident	86	Confident	64 Å²	64	94 Å²	94	45%	0.448	44%	0.443	S	S	.	.	H	α-helix	trans	-69	-45.7	173.1	67.6	0	0	0	0	110.9	R56 K57 I58 S62 K63	R56-S60 WeakPolarHBondContact O-CB 3.37Å; R56-S60 PolarHBondContact O-N 2.9Å; R56-S60 PolarHBondContact O-OG 2.88Å; K57-S60 PolarHBondContact O-OG 3.07Å; I58-S60 VanDerWaalsContact C-N 3.33Å; I58-S60 PolarHBondContact O-N 2.91Å; S60-S62 PolarHBondContact O-N 3.29Å; S60-K63 PolarHBondContact O-N 2.88Å
61	K	86.8	Confident	86.4	Confident	105 Å²	105	94.6 Å²	94.6	46%	0.457	45%	0.449	S	S	.	.	H	α-helix	trans	-69.7	-29.1	179.5	-74	-173.4	172.5	-157.6	0	113.8	K57 I58 K63 E64 E68	K57-K61 WeakPolarHBondContact O-CB 3.48Å; K57-K61 WeakPolarHBondContact O-CG 3.4Å; K57-K61 PolarHBondContact O-N 2.87Å; I58-K61 PolarHBondContact O-N 2.7Å; K61-K63 PolarHBondContact O-N 3.18Å; K61-K63 VanDerWaalsContact O-N 3.1Å; K61-E64 WeakPolarHBondContact O-CB 3.46Å; K61-E64 PolarHBondContact O-N 3.22Å; K61-E68 WeakPolarHBondContact O-CB 3.3Å
62	S	84.8	Confident	86.5	Confident	20 Å²	20	94.5 Å²	94.5	14%	0.14	45%	0.45	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-17.3	178	69.7	0	0	0	0	113.2	I58 T59 S60 E64	I58-S62 WeakPolarHBondContact O-CB 3.48Å; I58-S62 PolarHBondContact O-N 3.23Å; T59-S62 PolarHBondContact O-OG 3.22Å; S60-S62 PolarHBondContact O-N 3.29Å; S62-E64 VanDerWaalsContact C-N 3.34Å
63	K	85.7	Confident	86.6	Confident	181 Å²	181	96.1 Å²	96.1	79%	0.787	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-12.4	174.7	-62.8	-176.5	179.3	-175.5	0	113.3	S60 K61	S60-K63 PolarHBondContact O-N 2.88Å; K61-K63 PolarHBondContact O-N 3.18Å; K61-K63 VanDerWaalsContact O-N 3.1Å
64	E	87.4	Confident	86.8	Confident	152 Å²	152	98.3 Å²	98.3	71%	0.71	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-28.9	-174.3	-61.2	175.7	172.7	0	0	112.7	K61 S62	K61-E64 WeakPolarHBondContact O-CB 3.46Å; K61-E64 PolarHBondContact O-N 3.22Å; S62-E64 VanDerWaalsContact C-N 3.34Å
65	S	90.4	Very high	86.9	Confident	56 Å²	56	95.8 Å²	95.8	39%	0.392	46%	0.46	S	S	.	.			trans	-154.2	147.6	-175.2	177.3	0	0	0	0	113.2	W67 E68 L69	S65-W67 PolarHBondContact O-N 2.66Å; S65-W67 PolarHBondContact OG-N 3.35Å; S65-E68 PolarHBondContact O-N 3.03Å; S65-L69 PolarHBondContact O-N 3.31Å
66	I	88.8	Confident	86.9	Confident	131 Å²	131	94 Å²	94	67%	0.672	46%	0.46	S	S	*	.	H	α-helix	trans	-60.3	-35.6	172.8	-61.3	171.1	0	0	0	111	L69 I70	I66-L69 WeakPolarHBondContact O-CB 3.35Å; I66-L69 PolarHBondContact O-N 2.89Å; I66-I70 HydrophobicContact CG2-CD1 4.23Å; I66-I70 WeakPolarHBondContact O-CG1 3.43Å; I66-I70 PolarHBondContact O-N 2.7Å
67	W	88.4	Confident	87	Confident	204 Å²	204	93.7 Å²	93.7	77%	0.773	46%	0.459	S	S	*	.	H	α-helix	trans	-65.9	-40.9	176.8	-103.8	95.6	0	0	0	112.2	S65 L69 I70 K71	S65-W67 PolarHBondContact O-N 2.66Å; S65-W67 PolarHBondContact OG-N 3.35Å; W67-L69 VanDerWaalsContact C-N 3.33Å; W67-I70 PolarHBondContact O-N 2.94Å; W67-K71 WeakPolarHBondContact O-CB 3.15Å; W67-K71 PolarHBondContact O-N 3.18Å
68	E	87.9	Confident	87.2	Confident	54 Å²	54	87.5 Å²	87.5	25%	0.252	43%	0.434	S	S	.	.	H	α-helix	trans	-71.8	-29.5	175.5	-71.9	-66.8	165.8	0	0	111.5	K61 S65 K71 S72	K61-E68 WeakPolarHBondContact O-CB 3.3Å; S65-E68 PolarHBondContact O-N 3.03Å; E68-K71 PolarHBondContact O-N 2.96Å; E68-S72 WeakPolarHBondContact O-CB 3.28Å; E68-S72 PolarHBondContact O-N 3.15Å
69	L	87.5	Confident	87.4	Confident	81 Å²	81	85.9 Å²	85.9	42%	0.424	43%	0.425	S	S	.	.	H	α-helix	trans	-63.4	-48	169.1	-175	69.6	0	0	0	111.6	S65 I66 W67 K71 S72 L73	S65-L69 PolarHBondContact O-N 3.31Å; I66-L69 WeakPolarHBondContact O-CB 3.35Å; I66-L69 PolarHBondContact O-N 2.89Å; W67-L69 VanDerWaalsContact C-N 3.33Å; L69-K71 VanDerWaalsContact C-N 3.31Å; L69-K71 PolarHBondContact O-N 2.79Å; L69-S72 WeakPolarHBondContact O-CB 3.33Å; L69-S72 PolarHBondContact O-N 3.21Å; L69-L73 HydrophobicContact CG-CD1 4.42Å; L69-L73 WeakPolarHBondContact O-CG 3.23Å; L69-L73 PolarHBondContact O-N 3.37Å
70	I	87.9	Confident	87.8	Confident	79 Å²	79	87.7 Å²	87.7	41%	0.405	43%	0.425	S	S	.	.	H	α-helix	trans	-60	-43.6	176	-69.3	167.5	0	0	0	110.5	I66 W67 S72 L73 L74	I66-I70 HydrophobicContact CG2-CD1 4.23Å; I66-I70 WeakPolarHBondContact O-CG1 3.43Å; I66-I70 PolarHBondContact O-N 2.7Å; W67-I70 PolarHBondContact O-N 2.94Å; I70-S72 VanDerWaalsContact C-N 3.34Å; I70-S72 PolarHBondContact O-N 3.43Å; I70-L73 PolarHBondContact O-N 3.28Å; I70-L74 HydrophobicContact CG2-CD1 4Å; I70-L74 HydrophobicContact CG2-CG 4.45Å; I70-L74 WeakPolarHBondContact O-CB 3.34Å; I70-L74 WeakPolarHBondContact O-CG 3.41Å; I70-L74 PolarHBondContact O-N 2.99Å
71	K	85.9	Confident	88.1	Confident	125 Å²	125	87.5 Å²	87.5	54%	0.543	42%	0.421	S	S	.	.	H	α-helix	trans	-63.8	-38.7	177.4	-169.1	175.8	-178.8	178.3	0	112.5	W67 E68 L69 L74 D75	W67-K71 WeakPolarHBondContact O-CB 3.15Å; W67-K71 PolarHBondContact O-N 3.18Å; E68-K71 PolarHBondContact O-N 2.96Å; L69-K71 VanDerWaalsContact C-N 3.31Å; L69-K71 PolarHBondContact O-N 2.79Å; K71-L74 PolarHBondContact O-N 3.33Å; K71-D75 PolarHBondContact O-N 3.41Å
72	S	86.3	Confident	88.5	Confident	26 Å²	26	82.5 Å²	82.5	18%	0.182	40%	0.399	C	S	.	.	H	α-helix	trans	-63.9	-42.5	173.2	-178.3	0	0	0	0	111.7	E68 L69 I70 D75 A76	E68-S72 WeakPolarHBondContact O-CB 3.28Å; E68-S72 PolarHBondContact O-N 3.15Å; L69-S72 WeakPolarHBondContact O-CB 3.33Å; L69-S72 PolarHBondContact O-N 3.21Å; I70-S72 VanDerWaalsContact C-N 3.34Å; I70-S72 PolarHBondContact O-N 3.43Å; S72-D75 PolarHBondContact O-N 2.91Å; S72-A76 PolarHBondContact O-N 2.88Å
73	L	86.6	Confident	89	Confident	95 Å²	95	81.7 Å²	81.7	50%	0.497	39%	0.393	S	S	.	.	H	α-helix	trans	-63.9	-44.6	175.3	-71	169.4	0	0	0	111.4	L69 I70 D75 A76 W77	L69-L73 HydrophobicContact CG-CD1 4.42Å; L69-L73 WeakPolarHBondContact O-CG 3.23Å; L69-L73 PolarHBondContact O-N 3.37Å; I70-L73 PolarHBondContact O-N 3.28Å; L73-D75 VanDerWaalsContact C-N 3.35Å; L73-D75 PolarHBondContact O-N 2.81Å; L73-A76 WeakPolarHBondContact O-CB 3.05Å; L73-A76 PolarHBondContact O-N 3.45Å; L73-W77 WeakPolarHBondContact O-CB 3.46Å; L73-W77 VanDerWaalsContact O-CD1 3.29Å; L73-W77 PolarHBondContact O-N 2.77Å
74	L	85.3	Confident	89.6	Confident	117 Å²	117	76.4 Å²	76.4	61%	0.613	37%	0.373	S	S	*	.	H	α-helix	trans	-60.8	-40.5	174.5	-76.2	168.9	0	0	0	112.2	I70 K71 A76 W77 S78	I70-L74 HydrophobicContact CG2-CD1 4Å; I70-L74 HydrophobicContact CG2-CG 4.45Å; I70-L74 WeakPolarHBondContact O-CB 3.34Å; I70-L74 WeakPolarHBondContact O-CG 3.41Å; I70-L74 PolarHBondContact O-N 2.99Å; K71-L74 PolarHBondContact O-N 3.33Å; L74-A76 VanDerWaalsContact C-N 3.34Å; L74-A76 PolarHBondContact O-N 3.27Å; L74-W77 PolarHBondContact O-N 3.07Å; L74-S78 WeakPolarHBondContact O-CB 3.2Å; L74-S78 PolarHBondContact O-N 2.96Å
75	D	86.3	Confident	90	Very high	22 Å²	22	71.9 Å²	71.9	12%	0.118	35%	0.353	C	S	.	.	H	α-helix	trans	-65.2	-37.9	175.2	-169.3	91.5	0	0	0	111.7	R54 K71 S72 L73 S78 K253	R54-D75 IonicContact CZ-OD1 3.88Å; R54-D75 IonicContact NH2-OD1 2.62Å; R54-D75 PolarHBondContact NH2-OD1 2.84Å; K71-D75 PolarHBondContact O-N 3.41Å; S72-D75 PolarHBondContact O-N 2.91Å; L73-D75 VanDerWaalsContact C-N 3.35Å; L73-D75 PolarHBondContact O-N 2.81Å; D75-S78 PolarHBondContact O-OG 2.89Å; D75-K253 PolarHBondContact O-NZ 3.42Å; D75-K253 IonicContact OD2-NZ 3.36Å; D75-K253 PolarHBondContact OD2-NZ 2.93Å
76	A	85.6	Confident	90.3	Very high	50 Å²	50	69.2 Å²	69.2	41%	0.413	34%	0.335	S	S	.	.	H	α-helix	trans	-64.9	-43.9	174.5	0	0	0	0	0	112.2	S72 L73 L74	S72-A76 PolarHBondContact O-N 2.88Å; L73-A76 WeakPolarHBondContact O-CB 3.05Å; L73-A76 PolarHBondContact O-N 3.45Å; L74-A76 VanDerWaalsContact C-N 3.34Å; L74-A76 PolarHBondContact O-N 3.27Å
77	W	89.5	Confident	90.7	Very high	165 Å²	165	63 Å²	63	63%	0.625	30%	0.303	S	S	*	.	H	α-helix	trans	-75.1	-24.4	179.3	-85.5	74	0	0	0	114.1	L73 L74 G79 W80 V81	L73-W77 WeakPolarHBondContact O-CB 3.46Å; L73-W77 VanDerWaalsContact O-CD1 3.29Å; L73-W77 PolarHBondContact O-N 2.77Å; L74-W77 PolarHBondContact O-N 3.07Å; W77-G79 PolarHBondContact O-N 2.77Å; W77-W80 PolarHBondContact O-N 3.44Å; W77-V81 PolarHBondContact O-N 2.91Å
78	S	90	Very high	91.2	Very high	11 Å²	11	56.8 Å²	56.8	8%	0.077	28%	0.284	C	S	.	.	H	α-helix	trans	-51.3	-32.3	-176.2	65.4	0	0	0	0	113.9	L74 D75 V82 K253	L74-S78 WeakPolarHBondContact O-CB 3.2Å; L74-S78 PolarHBondContact O-N 2.96Å; D75-S78 PolarHBondContact O-OG 2.89Å; S78-V82 WeakPolarHBondContact O-CB 3.37Å; S78-V82 WeakPolarHBondContact O-CG2 3.33Å; S78-V82 PolarHBondContact O-N 3.39Å; S78-K253 WeakPolarHBondContact OG-CD 3.49Å
79	G	90.1	Very high	91.6	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-64	-43.6	175.6	0	0	0	0	0	113.7	W77 V82 M83 Y254	W77-G79 PolarHBondContact O-N 2.77Å; G79-V82 PolarHBondContact O-N 3.47Å; G79-M83 VanDerWaalsContact O-CG 3.31Å; G79-M83 WeakPolarHBondContact O-CG 2.89Å; G79-M83 PolarHBondContact O-N 3.21Å; G79-M83 VanDerWaalsContact O-N 3.08Å; G79-Y254 WeakPolarHBondContact CA-OH 3.42Å; G79-Y254 PolarHBondContact N-OH 3.29Å
80	W	93.8	Very high	92	Very high	104 Å²	104	52.7 Å²	52.7	39%	0.394	27%	0.265	S	S	.	.	H	α-helix	trans	-70.1	-38.6	178.4	-66	100.2	0	0	0	111.7	W77 M83 L84 F305	W77-W80 PolarHBondContact O-N 3.44Å; W80-M83 PolarHBondContact O-N 3.48Å; W80-L84 WeakPolarHBondContact O-CB 3.38Å; W80-L84 PolarHBondContact O-N 3.5Å; W80-F305 HydrophobicContact CE3-CB 4.15Å; W80-F305 AromaticContact CE3-CD1 3.68Å; W80-F305 HydrophobicContact CE3-CD1 3.68Å; W80-F305 HydrophobicContact CE3-CD2 4.28Å; W80-F305 HydrophobicContact CE3-CE1 4.12Å; W80-F305 AromaticContact CE3-CG 3.77Å; W80-F305 HydrophobicContact CE3-CG 3.77Å; W80-F305 HydrophobicContact CZ3-CB 3.62Å; W80-F305 HydrophobicContact CZ3-CD1 4.06Å; W80-F305 HydrophobicContact CZ3-CD2 4.08Å; W80-F305 AromaticContact CZ3-CG 3.65Å; W80-F305 HydrophobicContact CZ3-CG 3.65Å
81	V	94.6	Very high	92.4	Very high	60 Å²	60	49 Å²	49	36%	0.364	25%	0.246	S	C	.	.	H	α-helix	trans	-61.9	-44.4	174.9	177.7	0	0	0	0	111	W77 M83 L84 L85 F251	W77-V81 PolarHBondContact O-N 2.91Å; V81-M83 VanDerWaalsContact C-N 3.35Å; V81-M83 PolarHBondContact O-N 2.88Å; V81-L84 WeakPolarHBondContact O-CB 3.22Å; V81-L84 PolarHBondContact O-N 3.39Å; V81-L85 HydrophobicContact CG1-CD1 4.23Å; V81-L85 WeakPolarHBondContact O-CG 3.49Å; V81-L85 PolarHBondContact O-N 3.02Å; V81-F251 HydrophobicContact CG1-CZ 4.34Å
82	V	95.3	Very high	92.9	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-61.2	-43.7	175.6	169.5	0	0	0	0	111.1	S78 G79 L84 L85 I86 F247 F251 Y254 V264	S78-V82 WeakPolarHBondContact O-CB 3.37Å; S78-V82 WeakPolarHBondContact O-CG2 3.33Å; S78-V82 PolarHBondContact O-N 3.39Å; G79-V82 PolarHBondContact O-N 3.47Å; V82-L84 PolarHBondContact O-N 2.87Å; V82-L85 PolarHBondContact O-N 2.82Å; V82-I86 HydrophobicContact CG1-CD1 3.63Å; V82-I86 HydrophobicContact CG1-CG1 4.37Å; V82-I86 WeakPolarHBondContact O-CD1 3.33Å; V82-I86 VanDerWaalsContact O-CG1 3.22Å; V82-I86 WeakPolarHBondContact O-CG1 3.22Å; V82-I86 PolarHBondContact O-N 2.84Å; V82-F247 HydrophobicContact CG1-CB 4.41Å; V82-F251 HydrophobicContact CG2-CD1 4.44Å; V82-F251 HydrophobicContact CG2-CD2 3.34Å; V82-F251 HydrophobicContact CG2-CE2 3.45Å; V82-F251 VanDerWaalsContact CG2-CE2 3.45Å; V82-F251 HydrophobicContact CG2-CG 3.88Å; V82-F251 HydrophobicContact CG2-CZ 4.06Å; V82-Y254 HydrophobicContact CB-CE2 4.48Å; V82-Y254 HydrophobicContact CG2-CD2 4.15Å; V82-Y254 HydrophobicContact CG2-CE2 3.91Å; V82-V264 HydrophobicContact CG1-CG1 3.82Å; V82-V264 HydrophobicContact CG1-CG2 4.44Å
83	M	96.2	Very high	93.4	Very high	3 Å²	3	46.4 Å²	46.4	2%	0.015	24%	0.238	C	C	.	.	H	α-helix	trans	-62.5	-40.9	176.4	-66.9	-48.6	140.9	0	0	112.9	G79 W80 V81 I86 G87 V264 A267 R302 F305 A306	G79-M83 VanDerWaalsContact O-CG 3.31Å; G79-M83 WeakPolarHBondContact O-CG 2.89Å; G79-M83 PolarHBondContact O-N 3.21Å; G79-M83 VanDerWaalsContact O-N 3.08Å; W80-M83 PolarHBondContact O-N 3.48Å; V81-M83 VanDerWaalsContact C-N 3.35Å; V81-M83 PolarHBondContact O-N 2.88Å; M83-I86 PolarHBondContact O-N 2.94Å; M83-G87 PolarHBondContact O-N 3.07Å; M83-V264 HydrophobicContact CE-CB 4.09Å; M83-V264 HydrophobicContact CE-CG1 3.94Å; M83-V264 HydrophobicContact CE-CG2 3.74Å; M83-A267 HydrophobicContact CE-CB 3.93Å; M83-A267 HydrophobicContact SD-CB 3.43Å; M83-A267 WeakPolarHBondContact SD-CB 3.13Å; M83-R302 HydrophobicContact CE-CB 4.36Å; M83-R302 HydrophobicContact CG-CB 3.9Å; M83-R302 HydrophobicContact CG-CG 4.36Å; M83-R302 HydrophobicContact SD-CB 4.32Å; M83-F305 HydrophobicContact CB-CD1 3.84Å; M83-F305 HydrophobicContact CB-CE1 4.33Å; M83-A306 HydrophobicContact CB-CB 4.01Å; M83-A306 HydrophobicContact CG-CB 4.39Å; M83-A306 HydrophobicContact SD-CB 4.03Å
84	L	97.1	Very high	93.8	Very high	70 Å²	70	42 Å²	42	37%	0.366	22%	0.215	S	C	.	.	H	α-helix	trans	-59.5	-49.2	175.9	-178.5	73.6	0	0	0	110.9	W80 V81 V82 I86 G87 L88 F305 V309	W80-L84 WeakPolarHBondContact O-CB 3.38Å; W80-L84 PolarHBondContact O-N 3.5Å; V81-L84 WeakPolarHBondContact O-CB 3.22Å; V81-L84 PolarHBondContact O-N 3.39Å; V82-L84 PolarHBondContact O-N 2.87Å; L84-I86 PolarHBondContact O-N 3.33Å; L84-G87 PolarHBondContact O-N 3.43Å; L84-L88 HydrophobicContact CD1-CD1 4.43Å; L84-L88 HydrophobicContact CG-CD1 4.04Å; L84-L88 WeakPolarHBondContact O-CB 3.47Å; L84-L88 VanDerWaalsContact O-CG 3.31Å; L84-L88 WeakPolarHBondContact O-CG 3.41Å; L84-L88 PolarHBondContact O-N 3.03Å; L84-F305 HydrophobicContact CB-CE1 4.12Å; L84-F305 HydrophobicContact CD1-CE1 4.49Å; L84-F305 HydrophobicContact CD1-CZ 4.23Å; L84-V309 HydrophobicContact CD1-CG1 3.98Å; L84-V309 HydrophobicContact CD1-CG2 3.96Å
85	L	97.2	Very high	94.2	Very high	57 Å²	57	36.4 Å²	36.4	30%	0.298	19%	0.186	S	C	.	.	H	α-helix	trans	-63.6	-39.8	179.8	-68.9	174.1	0	0	0	112.4	V81 V82 L89 F247 F251	V81-L85 HydrophobicContact CG1-CD1 4.23Å; V81-L85 WeakPolarHBondContact O-CG 3.49Å; V81-L85 PolarHBondContact O-N 3.02Å; V82-L85 PolarHBondContact O-N 2.82Å; L85-L89 WeakPolarHBondContact O-CB 3.46Å; L85-L89 PolarHBondContact O-N 3.44Å; L85-F247 HydrophobicContact CB-CD1 3.94Å; L85-F247 HydrophobicContact CB-CD2 4.12Å; L85-F247 HydrophobicContact CB-CE1 3.8Å; L85-F247 HydrophobicContact CB-CE2 3.94Å; L85-F247 HydrophobicContact CB-CG 4.12Å; L85-F247 HydrophobicContact CB-CZ 3.8Å; L85-F247 HydrophobicContact CD1-CD1 3.91Å; L85-F247 HydrophobicContact CD1-CE1 4.03Å; L85-F247 HydrophobicContact CG-CE1 4.34Å; L85-F247 WeakPolarHBondContact O-CE2 3.49Å; L85-F251 HydrophobicContact CD1-CE2 4.3Å
86	I	97	Very high	94.6	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-63.1	-46.5	175.1	-69.5	166.6	0	0	0	110.5	V82 M83 L84 S90 F247 V264 A268	V82-I86 HydrophobicContact CG1-CD1 3.63Å; V82-I86 HydrophobicContact CG1-CG1 4.37Å; V82-I86 WeakPolarHBondContact O-CD1 3.33Å; V82-I86 VanDerWaalsContact O-CG1 3.22Å; V82-I86 WeakPolarHBondContact O-CG1 3.22Å; V82-I86 PolarHBondContact O-N 2.84Å; M83-I86 PolarHBondContact O-N 2.94Å; L84-I86 PolarHBondContact O-N 3.33Å; I86-S90 VanDerWaalsContact O-CB 3.22Å; I86-S90 WeakPolarHBondContact O-CB 3.07Å; I86-S90 PolarHBondContact O-N 3.35Å; I86-S90 PolarHBondContact O-OG 2.84Å; I86-F247 HydrophobicContact CG1-CB 4.43Å; I86-F247 HydrophobicContact CG1-CD2 3.72Å; I86-F247 HydrophobicContact CG1-CG 4.47Å; I86-V264 HydrophobicContact CD1-CG1 3.27Å; I86-A268 HydrophobicContact CG2-CB 3.87Å
87	G	97.3	Very high	95.1	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.6	-48.5	179.3	0	0	0	0	0	112	M83 L84 S90 G91 A310	M83-G87 PolarHBondContact O-N 3.07Å; L84-G87 PolarHBondContact O-N 3.43Å; G87-S90 PolarHBondContact O-N 3.13Å; G87-G91 PolarHBondContact O-N 3.32Å; G87-A310 VanDerWaalsContact O-CA 3.3Å; G87-A310 WeakPolarHBondContact O-CA 3.4Å
88	L	97.9	Very high	95.2	Very high	73 Å²	73	30.1 Å²	30.1	38%	0.382	16%	0.16	S	C	.	.	H	α-helix	trans	-59.2	-49.9	177.8	-70.7	170.7	0	0	0	111.8	L84 T92 V309	L84-L88 HydrophobicContact CD1-CD1 4.43Å; L84-L88 HydrophobicContact CG-CD1 4.04Å; L84-L88 WeakPolarHBondContact O-CB 3.47Å; L84-L88 VanDerWaalsContact O-CG 3.31Å; L84-L88 WeakPolarHBondContact O-CG 3.41Å; L84-L88 PolarHBondContact O-N 3.03Å; L88-T92 WeakPolarHBondContact O-CG2 3.46Å; L88-T92 PolarHBondContact O-N 3.5Å; L88-T92 PolarHBondContact O-OG1 3.42Å; L88-T92 VanDerWaalsContact O-OG1 3.13Å; L88-V309 HydrophobicContact CD2-CG1 4.19Å; L88-V309 HydrophobicContact CG-CG1 4Å
89	L	97.1	Very high	95.2	Very high	46 Å²	46	32.9 Å²	32.9	24%	0.241	17%	0.174	C	C	.	.	H	α-helix	trans	-69.2	-39	-178.4	-176.9	61.2	0	0	0	112.5	L85 T92 L93 C243 L246 F247	L85-L89 WeakPolarHBondContact O-CB 3.46Å; L85-L89 PolarHBondContact O-N 3.44Å; L89-T92 PolarHBondContact O-OG1 3.18Å; L89-L93 HydrophobicContact CD1-CD1 4.13Å; L89-L93 HydrophobicContact CD1-CG 4.17Å; L89-L93 HydrophobicContact CG-CD1 4.03Å; L89-L93 HydrophobicContact CG-CG 4.47Å; L89-L93 WeakPolarHBondContact O-CB 3.47Å; L89-L93 VanDerWaalsContact O-CG 3.28Å; L89-L93 WeakPolarHBondContact O-CG 3.29Å; L89-L93 PolarHBondContact O-N 3.35Å; L89-C243 HydrophobicContact CD2-CB 3.92Å; L89-C243 HydrophobicContact CG-CB 4.36Å; L89-L246 HydrophobicContact CD2-CD2 4.2Å; L89-F247 HydrophobicContact CB-CE2 3.84Å; L89-F247 HydrophobicContact CB-CZ 4.13Å; L89-F247 HydrophobicContact CD2-CE2 3.54Å; L89-F247 HydrophobicContact CD2-CZ 3.75Å; L89-F247 HydrophobicContact CG-CE2 4.34Å
90	S	96.2	Very high	95.4	Very high	4 Å²	4	34.1 Å²	34.1	3%	0.028	18%	0.184	C	C	.	.	H	α-helix	trans	-69.2	-39.8	179.8	-52	0	0	0	0	110.9	I86 G87 A94	I86-S90 VanDerWaalsContact O-CB 3.22Å; I86-S90 WeakPolarHBondContact O-CB 3.07Å; I86-S90 PolarHBondContact O-N 3.35Å; I86-S90 PolarHBondContact O-OG 2.84Å; G87-S90 PolarHBondContact O-N 3.13Å; S90-A94 VanDerWaalsContact O-CB 3.3Å; S90-A94 WeakPolarHBondContact O-CB 3.38Å; S90-A94 PolarHBondContact O-N 3.4Å
91	G	96.2	Very high	95.3	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-66.1	-41	175.5	0	0	0	0	0	113.3	G87 G95	G87-G91 PolarHBondContact O-N 3.32Å; G91-G95 PolarHBondContact O-N 3.01Å
92	T	96.3	Very high	95	Very high	59 Å²	59	27.6 Å²	27.6	36%	0.362	16%	0.155	S	C	.	.	H	α-helix	trans	-66.8	-43.3	175.3	54.6	0	0	0	0	112.5	L88 L89 G95 V96 T313 I317	L88-T92 WeakPolarHBondContact O-CG2 3.46Å; L88-T92 PolarHBondContact O-N 3.5Å; L88-T92 PolarHBondContact O-OG1 3.42Å; L88-T92 VanDerWaalsContact O-OG1 3.13Å; L89-T92 PolarHBondContact O-OG1 3.18Å; T92-G95 PolarHBondContact O-N 3.3Å; T92-V96 WeakPolarHBondContact O-CG2 3.15Å; T92-V96 PolarHBondContact O-N 2.89Å; T92-T313 HydrophobicContact CG2-CG2 3.75Å; T92-I317 HydrophobicContact CG2-CD1 4.19Å
93	L	96.4	Very high	94.8	Very high	39 Å²	39	31.1 Å²	31.1	20%	0.204	17%	0.168	C	C	.	.	H	α-helix	trans	-64.5	-41.3	177	-72.8	174.5	0	0	0	112.1	L89 V96 I97 L213 V239 C243	L89-L93 HydrophobicContact CD1-CD1 4.13Å; L89-L93 HydrophobicContact CD1-CG 4.17Å; L89-L93 HydrophobicContact CG-CD1 4.03Å; L89-L93 HydrophobicContact CG-CG 4.47Å; L89-L93 WeakPolarHBondContact O-CB 3.47Å; L89-L93 VanDerWaalsContact O-CG 3.28Å; L89-L93 WeakPolarHBondContact O-CG 3.29Å; L89-L93 PolarHBondContact O-N 3.35Å; L93-V96 PolarHBondContact O-N 3.07Å; L93-I97 WeakPolarHBondContact O-CB 3.46Å; L93-I97 WeakPolarHBondContact O-CD1 3.16Å; L93-I97 WeakPolarHBondContact O-CG1 3.44Å; L93-I97 PolarHBondContact O-N 3.09Å; L93-L213 HydrophobicContact CD1-CD1 4.2Å; L93-V239 HydrophobicContact CD1-CG1 4.11Å; L93-C243 WeakPolarHBondContact CD1-SG 3.44Å
94	A	95.6	Very high	94.6	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.008	17%	0.174	C	C	.	.	H	α-helix	trans	-61.1	-47.8	175.2	0	0	0	0	0	111.3	S90 V96 I97 D98 L236 V275 L314	S90-A94 VanDerWaalsContact O-CB 3.3Å; S90-A94 WeakPolarHBondContact O-CB 3.38Å; S90-A94 PolarHBondContact O-N 3.4Å; A94-V96 PolarHBondContact O-N 3.3Å; A94-I97 WeakPolarHBondContact O-CB 3.45Å; A94-I97 PolarHBondContact O-N 3.03Å; A94-I97 VanDerWaalsContact O-N 3.11Å; A94-D98 VanDerWaalsContact O-CG 3.24Å; A94-D98 PolarHBondContact O-N 3.29Å; A94-L236 HydrophobicContact CB-CD2 4.27Å; A94-V275 HydrophobicContact CB-CB 3.73Å; A94-V275 HydrophobicContact CB-CG1 4.46Å; A94-V275 HydrophobicContact CB-CG2 3.64Å; A94-L314 HydrophobicContact CB-CD1 4.46Å
95	G	93.8	Very high	94.4	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-56.7	-47.1	175.4	0	0	0	0	0	112.3	G91 T92 I97 D98 L99	G91-G95 PolarHBondContact O-N 3.01Å; T92-G95 PolarHBondContact O-N 3.3Å; G95-I97 VanDerWaalsContact C-N 3.32Å; G95-I97 PolarHBondContact O-N 2.95Å; G95-D98 PolarHBondContact O-N 2.97Å; G95-L99 WeakPolarHBondContact O-CD1 3.33Å; G95-L99 PolarHBondContact O-N 3.41Å
96	V	94.4	Very high	94	Very high	95 Å²	95	27.8 Å²	27.8	58%	0.576	15%	0.151	S	C	*	.	H	α-helix	trans	-61.3	-39.8	176.7	171.8	0	0	0	0	112.1	T92 L93 A94 D98 A100	T92-V96 WeakPolarHBondContact O-CG2 3.15Å; T92-V96 PolarHBondContact O-N 2.89Å; L93-V96 PolarHBondContact O-N 3.07Å; A94-V96 PolarHBondContact O-N 3.3Å; V96-D98 VanDerWaalsContact C-N 3.34Å; V96-A100 WeakPolarHBondContact O-CB 3.15Å; V96-A100 PolarHBondContact O-N 2.87Å
97	I	95	Very high	93.7	Very high	4 Å²	4	28.3 Å²	28.3	2%	0.021	15%	0.154	C	C	.	.	H	α-helix	trans	-63.4	-42.5	176.2	-71.1	161.7	0	0	0	110.3	L93 A94 G95 A100 V101 T217 L220 V221 K232 L236	L93-I97 WeakPolarHBondContact O-CB 3.46Å; L93-I97 WeakPolarHBondContact O-CD1 3.16Å; L93-I97 WeakPolarHBondContact O-CG1 3.44Å; L93-I97 PolarHBondContact O-N 3.09Å; A94-I97 WeakPolarHBondContact O-CB 3.45Å; A94-I97 PolarHBondContact O-N 3.03Å; A94-I97 VanDerWaalsContact O-N 3.11Å; G95-I97 VanDerWaalsContact C-N 3.32Å; G95-I97 PolarHBondContact O-N 2.95Å; I97-A100 PolarHBondContact O-N 2.83Å; I97-V101 HydrophobicContact CG2-CG2 4.1Å; I97-V101 VanDerWaalsContact O-CB 3.31Å; I97-V101 WeakPolarHBondContact O-CB 3.37Å; I97-V101 WeakPolarHBondContact O-CG2 3.34Å; I97-V101 PolarHBondContact O-N 3.22Å; I97-T217 HydrophobicContact CD1-CG2 4.23Å; I97-L220 HydrophobicContact CD1-CD2 4.35Å; I97-L220 HydrophobicContact CG2-CD2 4.3Å; I97-V221 HydrophobicContact CB-CG2 4.5Å; I97-V221 HydrophobicContact CG1-CG2 4.35Å; I97-V221 HydrophobicContact CG2-CG2 4.25Å; I97-K232 HydrophobicContact CG2-CD 4.26Å; I97-L236 HydrophobicContact CD1-CD2 3.55Å
98	D	91.8	Very high	93.4	Very high	6 Å²	6	28.6 Å²	28.6	3%	0.032	16%	0.155	C	C	.	.	H	α-helix	trans	-62.8	-54.1	-179.4	-65.9	-8.2	0	0	0	111.3	A94 G95 V96 A100 V101 D102 K232 P319 F320	A94-D98 VanDerWaalsContact O-CG 3.24Å; A94-D98 PolarHBondContact O-N 3.29Å; G95-D98 PolarHBondContact O-N 2.97Å; V96-D98 VanDerWaalsContact C-N 3.34Å; D98-A100 VanDerWaalsContact C-N 3.27Å; D98-A100 PolarHBondContact O-N 3.31Å; D98-V101 PolarHBondContact O-N 3.29Å; D98-D102 VanDerWaalsContact O-CG 3.29Å; D98-D102 PolarHBondContact O-N 3.47Å; D98-K232 VanDerWaalsContact CG-NZ 3.26Å; D98-K232 VanDerWaalsContact OD1-CE 3.31Å; D98-K232 WeakPolarHBondContact OD1-CE 3.44Å; D98-K232 IonicContact OD1-NZ 3.15Å; D98-K232 PolarHBondContact OD1-NZ 3.48Å; D98-K232 IonicContact OD2-NZ 3.87Å; D98-P319 HydrophobicContact CB-CB 4.04Å; D98-P319 HydrophobicContact CB-CG 4.48Å; D98-F320 HydrophobicContact CB-CZ 4.36Å
99	L	90.7	Very high	92.8	Very high	70 Å²	70	28 Å²	28	37%	0.366	15%	0.15	S	C	.	.	H	α-helix	trans	-58	-41.5	177.6	-79.6	87.8	0	0	0	111.8	G95 W103 I317 P319	G95-L99 WeakPolarHBondContact O-CD1 3.33Å; G95-L99 PolarHBondContact O-N 3.41Å; L99-W103 WeakPolarHBondContact O-CB 3.45Å; L99-W103 PolarHBondContact O-N 3.48Å; L99-W103 VanDerWaalsContact O-N 3.16Å; L99-I317 HydrophobicContact CD1-CG2 4.11Å; L99-P319 HydrophobicContact CD1-CB 3.52Å; L99-P319 HydrophobicContact CG-CB 4.38Å
100	A	93.5	Very high	92.4	Very high	25 Å²	25	25.8 Å²	25.8	21%	0.207	14%	0.139	C	C	.	.	H	α-helix	trans	-70.6	-38.9	-178.6	0	0	0	0	0	112.1	V96 I97 D98 M104 V221	V96-A100 WeakPolarHBondContact O-CB 3.15Å; V96-A100 PolarHBondContact O-N 2.87Å; I97-A100 PolarHBondContact O-N 2.83Å; D98-A100 VanDerWaalsContact C-N 3.27Å; D98-A100 PolarHBondContact O-N 3.31Å; A100-M104 VanDerWaalsContact O-CB 3.24Å; A100-M104 WeakPolarHBondContact O-CB 3.48Å; A100-M104 VanDerWaalsContact O-CG 3.22Å; A100-M104 WeakPolarHBondContact O-CG 3.33Å; A100-M104 PolarHBondContact O-N 3.34Å; A100-V221 HydrophobicContact CB-CG1 3.77Å; A100-V221 HydrophobicContact CB-CG2 4.03Å
101	V	92.8	Very high	92.1	Very high	4 Å²	4	26.4 Å²	26.4	2%	0.024	14%	0.143	C	C	.	.	H	α-helix	trans	-64	-46.1	177.5	164.6	0	0	0	0	110.5	I97 D98 M104 T105 V221 V224 S225	I97-V101 HydrophobicContact CG2-CG2 4.1Å; I97-V101 VanDerWaalsContact O-CB 3.31Å; I97-V101 WeakPolarHBondContact O-CB 3.37Å; I97-V101 WeakPolarHBondContact O-CG2 3.34Å; I97-V101 PolarHBondContact O-N 3.22Å; D98-V101 PolarHBondContact O-N 3.29Å; V101-M104 PolarHBondContact O-N 2.62Å; V101-T105 VanDerWaalsContact O-CB 3.24Å; V101-T105 WeakPolarHBondContact O-CB 3.45Å; V101-T105 PolarHBondContact O-N 2.91Å; V101-T105 PolarHBondContact O-OG1 2.98Å; V101-V221 HydrophobicContact CG2-CB 4.23Å; V101-V221 HydrophobicContact CG2-CG1 4.06Å; V101-V221 HydrophobicContact CG2-CG2 4.19Å; V101-V224 HydrophobicContact CG1-CB 4.29Å; V101-V224 HydrophobicContact CG1-CG1 3.65Å; V101-V224 HydrophobicContact CG2-CB 4.32Å; V101-V224 HydrophobicContact CG2-CG1 4.48Å; V101-S225 PolarHBondContact O-OG 3.09Å
102	D	88.4	Confident	91.7	Very high	23 Å²	23	26.6 Å²	26.6	12%	0.123	14%	0.144	C	C	.	.	H	α-helix	trans	-62.7	-53.1	-178.3	-64.2	-12.5	0	0	0	109.9	D98 M104 T105 D106 F320	D98-D102 VanDerWaalsContact O-CG 3.29Å; D98-D102 PolarHBondContact O-N 3.47Å; D102-M104 PolarHBondContact O-N 2.92Å; D102-T105 PolarHBondContact O-N 2.66Å; D102-D106 PolarHBondContact O-N 3.48Å; D102-F320 WeakPolarHBondContact OD2-CE1 2.94Å
103	W	90.1	Very high	91.1	Very high	74 Å²	74	28.1 Å²	28.1	28%	0.28	15%	0.149	S	C	.	.	H	α-helix	trans	-56.8	-47.7	177.1	168.9	59.7	0	0	0	113.4	L99 T105 D106 L107 F116	L99-W103 WeakPolarHBondContact O-CB 3.45Å; L99-W103 PolarHBondContact O-N 3.48Å; L99-W103 VanDerWaalsContact O-N 3.16Å; W103-T105 VanDerWaalsContact C-N 3.31Å; W103-T105 PolarHBondContact O-N 3.44Å; W103-D106 PolarHBondContact O-N 3.19Å; W103-L107 PolarHBondContact O-N 3.31Å; W103-F116 HydrophobicContact CH2-CE1 4.34Å; W103-F116 HydrophobicContact CZ2-CD1 4.03Å; W103-F116 AromaticContact CZ2-CE1 3.54Å; W103-F116 HydrophobicContact CZ2-CE1 3.54Å; W103-F116 HydrophobicContact CZ2-CZ 4.14Å; W103-F116 PolarHBondContact NE1-O 3.04Å
104	M	92.6	Very high	90.5	Very high	28 Å²	28	29.5 Å²	29.5	14%	0.138	16%	0.162	C	C	.	.	H	α-helix	trans	-71.5	-27	-178.7	-70.7	-168.2	69.6	0	0	112.8	A100 V101 D102 F172 V221 L222 S225	A100-M104 VanDerWaalsContact O-CB 3.24Å; A100-M104 WeakPolarHBondContact O-CB 3.48Å; A100-M104 VanDerWaalsContact O-CG 3.22Å; A100-M104 WeakPolarHBondContact O-CG 3.33Å; A100-M104 PolarHBondContact O-N 3.34Å; V101-M104 PolarHBondContact O-N 2.62Å; D102-M104 PolarHBondContact O-N 2.92Å; M104-F172 HydrophobicContact CE-CD1 3.79Å; M104-F172 HydrophobicContact CE-CE1 3.41Å; M104-F172 VanDerWaalsContact CE-CE1 3.41Å; M104-F172 HydrophobicContact CE-CG 4.48Å; M104-F172 HydrophobicContact CE-CZ 3.8Å; M104-F172 VanDerWaalsContact O-CE2 3.25Å; M104-F172 WeakPolarHBondContact O-CE2 3.26Å; M104-V221 HydrophobicContact CG-CG1 4.29Å; M104-V221 HydrophobicContact SD-CG1 3.47Å; M104-V221 WeakPolarHBondContact SD-CG1 3.19Å; M104-L222 HydrophobicContact CE-CD2 3.43Å; M104-L222 VanDerWaalsContact CE-CD2 3.43Å; M104-L222 HydrophobicContact SD-CD2 4.41Å; M104-S225 VanDerWaalsContact CB-OG 3.27Å; M104-S225 WeakPolarHBondContact CB-OG 3.4Å
105	T	91.4	Very high	90	Very high	12 Å²	12	30.1 Å²	30.1	7%	0.074	17%	0.167	C	C	.	.	H	α-helix	trans	-69.7	-43.2	175.1	-59.4	0	0	0	0	110.4	V101 D102 W103 L107 K108 S225	V101-T105 VanDerWaalsContact O-CB 3.24Å; V101-T105 WeakPolarHBondContact O-CB 3.45Å; V101-T105 PolarHBondContact O-N 2.91Å; V101-T105 PolarHBondContact O-OG1 2.98Å; D102-T105 PolarHBondContact O-N 2.66Å; W103-T105 VanDerWaalsContact C-N 3.31Å; W103-T105 PolarHBondContact O-N 3.44Å; T105-L107 VanDerWaalsContact C-N 3.26Å; T105-L107 PolarHBondContact O-N 3.01Å; T105-K108 WeakPolarHBondContact O-CB 3.03Å; T105-K108 VanDerWaalsContact O-CE 3.26Å; T105-K108 WeakPolarHBondContact O-CE 3.43Å; T105-K108 PolarHBondContact O-N 3.49Å; T105-S225 PolarHBondContact OG1-OG 2.83Å
106	D	89.9	Confident	89.6	Confident	21 Å²	21	35.4 Å²	35.4	11%	0.112	19%	0.19	C	C	.	.	H	α-helix	trans	-65.1	-29.9	179.2	-67	-21.2	0	0	0	112.9	D102 W103 K108 E109 G110 S119 H120 W141	D102-D106 PolarHBondContact O-N 3.48Å; W103-D106 PolarHBondContact O-N 3.19Å; D106-K108 PolarHBondContact O-N 3.2Å; D106-E109 PolarHBondContact O-N 3.15Å; D106-G110 PolarHBondContact O-N 2.9Å; D106-S119 WeakPolarHBondContact OD2-CA 3.43Å; D106-S119 VanDerWaalsContact OD2-CB 3.24Å; D106-S119 WeakPolarHBondContact OD2-CB 3.04Å; D106-H120 PolarHBondContact OD2-N 3.28Å; D106-W141 HydrophobicContact CB-CH2 3.63Å; D106-W141 HydrophobicContact CB-CZ2 4.03Å
107	L	90.9	Very high	89	Confident	11 Å²	11	39.2 Å²	39.2	6%	0.058	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-20.6	176	-164.1	68.1	0	0	0	112.9	W103 T105 E109 G110 F116 W144 W168 F172	W103-L107 PolarHBondContact O-N 3.31Å; T105-L107 VanDerWaalsContact C-N 3.26Å; T105-L107 PolarHBondContact O-N 3.01Å; L107-E109 VanDerWaalsContact C-N 3.34Å; L107-G110 WeakPolarHBondContact CA-O 3.33Å; L107-F116 HydrophobicContact CD1-CE2 3.94Å; L107-F116 HydrophobicContact CD1-CZ 4.14Å; L107-W144 HydrophobicContact CD1-CH2 4.35Å; L107-W144 HydrophobicContact CD1-CZ2 3.77Å; L107-W144 HydrophobicContact CG-CZ2 4.13Å; L107-W144 PolarHBondContact O-NE1 3.34Å; L107-W168 HydrophobicContact CD2-CD2 4.41Å; L107-W168 HydrophobicContact CD2-CE3 4.02Å; L107-W168 HydrophobicContact CD2-CH2 3.56Å; L107-W168 HydrophobicContact CD2-CZ2 3.97Å; L107-W168 HydrophobicContact CD2-CZ3 3.58Å; L107-W168 HydrophobicContact CG-CD2 4.48Å; L107-W168 HydrophobicContact CG-CH2 4.26Å; L107-W168 HydrophobicContact CG-CZ2 4.16Å; L107-W168 HydrophobicContact CG-CZ3 4.45Å; L107-F172 HydrophobicContact CD2-CZ 4.04Å
108	K	90.6	Very high	88.4	Confident	6 Å²	6	42.8 Å²	42.8	3%	0.026	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-28.5	173.3	-64.4	-177.3	-64	-168.9	0	113.1	T105 D106 Y165 W168 A169 F172 S225	T105-K108 WeakPolarHBondContact O-CB 3.03Å; T105-K108 VanDerWaalsContact O-CE 3.26Å; T105-K108 WeakPolarHBondContact O-CE 3.43Å; T105-K108 PolarHBondContact O-N 3.49Å; D106-K108 PolarHBondContact O-N 3.2Å; K108-Y165 HydrophobicContact CB-CD2 3.71Å; K108-Y165 HydrophobicContact CB-CE2 3.96Å; K108-Y165 HydrophobicContact CD-CD2 4.48Å; K108-Y165 HydrophobicContact CD-CE2 4.13Å; K108-W168 HydrophobicContact CG-CB 3.95Å; K108-A169 HydrophobicContact CD-CB 4.49Å; K108-F172 HydrophobicContact CG-CE2 4.14Å; K108-S225 VanDerWaalsContact CD-O 3.27Å; K108-S225 WeakPolarHBondContact CD-O 3.41Å; K108-S225 WeakPolarHBondContact CE-O 3.19Å; K108-S225 PolarHBondContact NZ-O 2.95Å
109	E	86.3	Confident	88	Confident	60 Å²	60	43 Å²	43	28%	0.28	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-36.5	-176.7	-60.9	-156.1	156.6	0	0	112.4	D106 L107 K143 R400	D106-E109 PolarHBondContact O-N 3.15Å; L107-E109 VanDerWaalsContact C-N 3.34Å; E109-K143 WeakPolarHBondContact O-CA 3.49Å; E109-R400 IonicContact OE1-CZ 2.71Å; E109-R400 IonicContact OE1-NE 3.34Å; E109-R400 PolarHBondContact OE1-NE 3.18Å; E109-R400 IonicContact OE1-NH2 2.71Å
110	G	88.6	Confident	87.5	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.1	-163.9	-177.6	0	0	0	0	0	113.8	D106 L107 W141 Q142	D106-G110 PolarHBondContact O-N 2.9Å; L107-G110 WeakPolarHBondContact CA-O 3.33Å; G110-W141 WeakPolarHBondContact O-CZ2 3.24Å; G110-Q142 CarbonylContact C-O 3.58Å; G110-Q142 WeakPolarHBondContact CA-O 3.42Å
111	V	90.1	Very high	86.7	Confident	17 Å²	17	46 Å²	46	10%	0.103	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	149.7	179.7	69.6	0	0	0	0	110.8	F116 Q142 L147	V111-F116 HydrophobicContact CG2-CD2 3.56Å; V111-F116 HydrophobicContact CG2-CE2 3.94Å; V111-Q142 PolarHBondContact N-O 3.37Å; V111-Q142 PolarHBondContact O-N 3.49Å; V111-L147 HydrophobicContact CG1-CD2 4.02Å
112	C	87.2	Confident	86	Confident	4 Å²	4	48.4 Å²	48.4	3%	0.027	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	130.5	173.1	-170.9	0	0	0	0	110.9	S114 A115 C123 W141	C112-S114 PolarHBondContact SG-OG 3.27Å; C112-A115 WeakPolarHBondContact CB-O 3.47Å; C112-C123 HydrophobicContact CB-CB 3.64Å; C112-C123 WeakPolarHBondContact CB-SG 3.4Å; C112-C123 WeakPolarHBondContact SG-CB 3.36Å; C112-C123 CovalentContact SG-SG 2.03Å; C112-C123 PolarHBondContact SG-SG 3.15Å; C112-W141 HydrophobicContact CB-CE3 3.94Å; C112-W141 HydrophobicContact CB-CZ3 4Å
113	L	84.3	Confident	85.6	Confident	90 Å²	90	47.3 Å²	47.3	47%	0.471	22%	0.223	S	C	.	.	S	Bend	trans	-73.5	-28.7	180	-69.2	178.7	0	0	0	113.7	Q140 Q142 L147	L113-Q140 PolarHBondContact N-O 3.41Å; L113-Q142 HydrophobicContact CD1-CG 3.96Å; L113-Q142 HydrophobicContact CG-CG 4.21Å; L113-L147 HydrophobicContact CD2-CD1 4.18Å
114	S	83.3	Confident	84.9	Confident	69 Å²	69	44.8 Å²	44.8	48%	0.483	22%	0.217	S	C	.	.	S	Bend	trans	-73.1	-43.6	-177.2	64.3	0	0	0	0	112.1	C112	C112-S114 PolarHBondContact SG-OG 3.27Å
115	A	83.9	Confident	83.8	Confident	13 Å²	13	51 Å²	51	11%	0.107	24%	0.238	C	C	.	.			trans	-150.5	130.7	174.6	0	0	0	0	0	111	C112 W117 Y118	C112-A115 WeakPolarHBondContact CB-O 3.47Å; A115-W117 HydrophobicContact CB-CD2 4.34Å; A115-W117 HydrophobicContact CB-CZ2 4.09Å; A115-W117 PolarHBondContact O-N 2.8Å; A115-Y118 HydrophobicContact CB-CD1 4.35Å; A115-Y118 HydrophobicContact CB-CD2 3.7Å; A115-Y118 HydrophobicContact CB-CE1 4.45Å; A115-Y118 HydrophobicContact CB-CE2 3.82Å; A115-Y118 HydrophobicContact CB-CG 3.97Å; A115-Y118 PolarHBondContact O-N 2.8Å
116	F	85.1	Confident	82.6	Confident	111 Å²	111	54.1 Å²	54.1	49%	0.487	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-29.4	-177.1	178.4	-108.6	0	0	0	114	W103 L107 V111	W103-F116 HydrophobicContact CH2-CE1 4.34Å; W103-F116 HydrophobicContact CZ2-CD1 4.03Å; W103-F116 AromaticContact CZ2-CE1 3.54Å; W103-F116 HydrophobicContact CZ2-CE1 3.54Å; W103-F116 HydrophobicContact CZ2-CZ 4.14Å; W103-F116 PolarHBondContact NE1-O 3.04Å; L107-F116 HydrophobicContact CD1-CE2 3.94Å; L107-F116 HydrophobicContact CD1-CZ 4.14Å; V111-F116 HydrophobicContact CG2-CD2 3.56Å; V111-F116 HydrophobicContact CG2-CE2 3.94Å
117	W	83.1	Confident	81.2	Confident	176 Å²	176	53.7 Å²	53.7	67%	0.667	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	4	-176.7	55.6	75.4	0	0	0	114.1	A115	A115-W117 HydrophobicContact CB-CD2 4.34Å; A115-W117 HydrophobicContact CB-CZ2 4.09Å; A115-W117 PolarHBondContact O-N 2.8Å
118	Y	82.7	Confident	79.7	Confident	78 Å²	78	61.4 Å²	61.4	31%	0.306	30%	0.298	S	S	.	.			trans	-85.2	133.5	175.1	-71.9	-14.6	0	0	0	111.3	A115 Q122 T126	A115-Y118 HydrophobicContact CB-CD1 4.35Å; A115-Y118 HydrophobicContact CB-CD2 3.7Å; A115-Y118 HydrophobicContact CB-CE1 4.45Å; A115-Y118 HydrophobicContact CB-CE2 3.82Å; A115-Y118 HydrophobicContact CB-CG 3.97Å; A115-Y118 PolarHBondContact O-N 2.8Å; Y118-Q122 HydrophobicContact CG-CB 4.34Å; Y118-T126 HydrophobicContact CE2-CG2 4.41Å
119	S	83.1	Confident	78	Confident	11 Å²	11	67.5 Å²	67.5	8%	0.077	33%	0.326	C	S	.	.			trans	-65.5	165	165.7	63.8	0	0	0	0	110.5	D106 E121 Q122 C123	D106-S119 WeakPolarHBondContact OD2-CA 3.43Å; D106-S119 VanDerWaalsContact OD2-CB 3.24Å; D106-S119 WeakPolarHBondContact OD2-CB 3.04Å; S119-E121 VanDerWaalsContact C-N 3.34Å; S119-E121 PolarHBondContact O-N 2.8Å; S119-Q122 PolarHBondContact O-N 3.46Å; S119-Q122 VanDerWaalsContact OG-CG 3.25Å; S119-Q122 WeakPolarHBondContact OG-CG 3.36Å; S119-Q122 PolarHBondContact OG-N 2.71Å; S119-C123 VanDerWaalsContact O-CB 3.3Å; S119-C123 WeakPolarHBondContact O-CB 3.35Å; S119-C123 PolarHBondContact O-N 3.36Å
120	H	80.6	Confident	76.3	Confident	71 Å²	71	67.8 Å²	67.8	33%	0.329	33%	0.332	S	S	.	.	H	α-helix	trans	-53.2	-50.9	177.5	177	-88.1	0	0	0	110.9	D106 Q122 C123 C124 W141	D106-H120 PolarHBondContact OD2-N 3.28Å; H120-Q122 PolarHBondContact O-N 3.48Å; H120-C123 WeakPolarHBondContact O-CB 3.33Å; H120-C123 PolarHBondContact O-N 2.75Å; H120-C124 PolarHBondContact O-N 3.38Å; H120-C124 PolarHBondContact O-SG 3.43Å; H120-W141 HydrophobicContact CB-CD2 4.29Å; H120-W141 HydrophobicContact CB-CE3 4.14Å; H120-W141 HydrophobicContact CB-CH2 4.12Å; H120-W141 HydrophobicContact CB-CZ2 4.21Å; H120-W141 HydrophobicContact CB-CZ3 4.06Å; H120-W141 AromaticContact CD2-CD1 3.58Å; H120-W141 AromaticContact CD2-CD2 3.49Å; H120-W141 VanDerWaalsContact CD2-CD2 3.49Å; H120-W141 AromaticContact CD2-CE2 3.62Å; H120-W141 AromaticContact CD2-CG 3.48Å; H120-W141 VanDerWaalsContact CD2-CG 3.48Å; H120-W141 AromaticContact CD2-NE1 3.63Å
121	E	75.6	Confident	74.5	Confident	86 Å²	86	71.8 Å²	71.8	40%	0.402	36%	0.357	S	S	.	.	H	α-helix	trans	-60.8	-44.7	179.4	-64.3	-166.8	160.4	0	0	112.9	S119 C123 C124 W125	S119-E121 VanDerWaalsContact C-N 3.34Å; S119-E121 PolarHBondContact O-N 2.8Å; E121-C123 VanDerWaalsContact C-N 3.32Å; E121-C123 PolarHBondContact O-N 2.96Å; E121-C124 PolarHBondContact O-N 3.34Å; E121-W125 PolarHBondContact O-N 3.15Å
122	Q	78.6	Confident	72.5	Confident	56 Å²	56	80 Å²	80	26%	0.262	39%	0.392	S	S	.	.	H	α-helix	trans	-64.1	-38.2	178	-70.8	172.9	-3.4	0	0	112	Y118 S119 H120 C124 T126	Y118-Q122 HydrophobicContact CG-CB 4.34Å; S119-Q122 PolarHBondContact O-N 3.46Å; S119-Q122 VanDerWaalsContact OG-CG 3.25Å; S119-Q122 WeakPolarHBondContact OG-CG 3.36Å; S119-Q122 PolarHBondContact OG-N 2.71Å; H120-Q122 PolarHBondContact O-N 3.48Å; Q122-C124 VanDerWaalsContact C-N 3.32Å; Q122-T126 PolarHBondContact O-N 2.89Å; Q122-T126 PolarHBondContact O-OG1 3.36Å
123	C	79.8	Confident	70.5	Confident	0 Å²	0	84.2 Å²	84.2	0%	0	43%	0.426	C	S	.	.	H	α-helix	trans	-62.1	-41.3	175.7	-169.8	0	0	0	0	111.3	C112 S119 H120 E121 T126 W141	C112-C123 HydrophobicContact CB-CB 3.64Å; C112-C123 WeakPolarHBondContact CB-SG 3.4Å; C112-C123 WeakPolarHBondContact SG-CB 3.36Å; C112-C123 CovalentContact SG-SG 2.03Å; C112-C123 PolarHBondContact SG-SG 3.15Å; S119-C123 VanDerWaalsContact O-CB 3.3Å; S119-C123 WeakPolarHBondContact O-CB 3.35Å; S119-C123 PolarHBondContact O-N 3.36Å; H120-C123 WeakPolarHBondContact O-CB 3.33Å; H120-C123 PolarHBondContact O-N 2.75Å; E121-C123 VanDerWaalsContact C-N 3.32Å; E121-C123 PolarHBondContact O-N 2.96Å; C123-T126 PolarHBondContact O-OG1 2.73Å; C123-W141 HydrophobicContact CB-CE3 4.07Å
124	C	76.1	Confident	68.8	Low	21 Å²	21	83 Å²	83	14%	0.142	42%	0.42	C	S	.	.	H	α-helix	trans	-76.2	-33.9	-178	-53.8	0	0	0	0	112.7	H120 E121 Q122 C138	H120-C124 PolarHBondContact O-N 3.38Å; H120-C124 PolarHBondContact O-SG 3.43Å; E121-C124 PolarHBondContact O-N 3.34Å; Q122-C124 VanDerWaalsContact C-N 3.32Å; C124-C138 WeakPolarHBondContact CA-SG 3.24Å; C124-C138 HydrophobicContact CB-CB 4Å; C124-C138 WeakPolarHBondContact CB-SG 3.16Å; C124-C138 WeakPolarHBondContact SG-CB 3.46Å; C124-C138 CovalentContact SG-SG 2.03Å; C124-C138 PolarHBondContact SG-SG 3.01Å
125	W	69.6	Low	67.1	Low	157 Å²	157	88.1 Å²	88.1	60%	0.595	43%	0.429	S	S	*	.	H	α-helix	trans	-70.1	-31.4	175.1	-76.3	-19	0	0	0	114.7	E121 S127 F320	E121-W125 PolarHBondContact O-N 3.15Å; W125-S127 VanDerWaalsContact C-N 3.28Å; W125-S127 PolarHBondContact O-N 2.77Å; W125-F320 WeakPolarHBondContact CH2-O 3.23Å; W125-F320 WeakPolarHBondContact CZ3-O 3.35Å
126	T	65	Low	65.6	Low	78 Å²	78	93.4 Å²	93.4	48%	0.479	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-3.5	-178.6	41.9	0	0	0	0	113.7	Y118 Q122 C123 N128	Y118-T126 HydrophobicContact CE2-CG2 4.41Å; Q122-T126 PolarHBondContact O-N 2.89Å; Q122-T126 PolarHBondContact O-OG1 3.36Å; C123-T126 PolarHBondContact O-OG1 2.73Å; T126-N128 PolarHBondContact O-N 3.39Å
127	S	62.1	Low	64.2	Low	12 Å²	12	95.4 Å²	95.4	8%	0.084	46%	0.464	C	S	.	.			trans	-80.9	114.4	179.6	179.2	0	0	0	0	111.9	W125 Q129	W125-S127 VanDerWaalsContact C-N 3.28Å; W125-S127 PolarHBondContact O-N 2.77Å; S127-Q129 PolarHBondContact O-N 2.98Å; S127-Q129 VanDerWaalsContact O-N 3.12Å; S127-Q129 PolarHBondContact OG-N 3.06Å
128	N	59.1	Low	63.5	Low	174 Å²	174	87.6 Å²	87.6	93%	0.93	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-3.1	172.2	-79.3	-18.9	0	0	0	114	T126	T126-N128 PolarHBondContact O-N 3.39Å
129	Q	53.8	Low	62.9	Low	133 Å²	133	87 Å²	87	62%	0.621	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.1	3.8	-171.1	-68.1	-177.6	-15.2	0	0	114.1	S127 T131	S127-Q129 PolarHBondContact O-N 2.98Å; S127-Q129 VanDerWaalsContact O-N 3.12Å; S127-Q129 PolarHBondContact OG-N 3.06Å; Q129-T131 PolarHBondContact O-N 3.21Å
130	T	51.1	Low	62.7	Low	66 Å²	66	89.3 Å²	89.3	41%	0.405	45%	0.452	S	S	.	.			trans	-75.7	97.7	-179.4	56.9	0	0	0	0	111.1
131	T	50.3	Low	62.9	Low	84 Å²	84	87.1 Å²	87.1	52%	0.515	44%	0.44	S	S	.	.			trans	-69.6	151.3	164.7	24.7	0	0	0	0	110.8	Q129 A133 D134 R135	Q129-T131 PolarHBondContact O-N 3.21Å; T131-A133 PolarHBondContact O-N 3.08Å; T131-D134 PolarHBondContact O-N 3.12Å; T131-D134 PolarHBondContact OG1-OD2 3.08Å; T131-R135 PolarHBondContact O-N 2.61Å
132	F	47.7	Very low	63.5	Low	191 Å²	191	85 Å²	85	84%	0.838	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-22.8	-178.1	-129.7	-91.6	0	0	0	114	L417	F132-L417 HydrophobicContact CE1-CD2 3.81Å; F132-L417 HydrophobicContact CZ-CD2 4.33Å
133	A	45.2	Very low	63.9	Low	91 Å²	91	87.3 Å²	87.3	75%	0.752	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-15.3	178.9	0	0	0	0	0	114.5	T131	T131-A133 PolarHBondContact O-N 3.08Å
134	D	49	Very low	64.3	Low	65 Å²	65	89.1 Å²	89.1	35%	0.348	45%	0.447	S	S	.	.			trans	-117.9	18.6	-175.5	-65	-61.9	0	0	0	112.5	T131 D136 K137	T131-D134 PolarHBondContact O-N 3.12Å; T131-D134 PolarHBondContact OG1-OD2 3.08Å; D134-D136 PolarHBondContact O-N 3.14Å; D134-D136 VanDerWaalsContact O-N 3.13Å; D134-K137 HydrophobicContact CB-CB 4.46Å; D134-K137 CarbonylContact O-C 3.45Å; D134-K137 PolarHBondContact O-N 3.15Å
135	R	48.8	Very low	64.8	Low	176 Å²	176	88.1 Å²	88.1	66%	0.664	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-30	-179.9	-164.8	-180	177	-169.9	-3.1	112.6	T131	T131-R135 PolarHBondContact O-N 2.61Å
136	D	51.2	Low	65.6	Low	124 Å²	124	83.6 Å²	83.6	66%	0.663	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-18.5	176.4	-68	-16.9	0	0	0	113.5	D134 S419	D134-D136 PolarHBondContact O-N 3.14Å; D134-D136 VanDerWaalsContact O-N 3.13Å; D136-S419 WeakPolarHBondContact OD2-CB 3.48Å; D136-S419 PolarHBondContact OD2-OG 3.22Å
137	K	56.5	Low	66.6	Low	153 Å²	153	83.6 Å²	83.6	67%	0.665	42%	0.422	S	S	*	.			trans	-103.1	80.2	179	-68.7	-178.7	-176.3	173.2	0	108.7	D134 P139	D134-K137 HydrophobicContact CB-CB 4.46Å; D134-K137 CarbonylContact O-C 3.45Å; D134-K137 PolarHBondContact O-N 3.15Å; K137-P139 WeakPolarHBondContact O-CD 3.37Å
138	C	68.4	Low	67.7	Low	13 Å²	13	88 Å²	88	9%	0.088	44%	0.442	C	S	.	.			trans	-65	98.5	174.9	-169.8	0	0	0	0	110.3	C124 Q140 W141	C124-C138 WeakPolarHBondContact CA-SG 3.24Å; C124-C138 HydrophobicContact CB-CB 4Å; C124-C138 WeakPolarHBondContact CB-SG 3.16Å; C124-C138 WeakPolarHBondContact SG-CB 3.46Å; C124-C138 CovalentContact SG-SG 2.03Å; C124-C138 PolarHBondContact SG-SG 3.01Å; C138-Q140 PolarHBondContact O-N 2.99Å; C138-W141 HydrophobicContact CB-CB 4.05Å; C138-W141 PolarHBondContact O-N 2.92Å; C138-W141 VanDerWaalsContact O-N 3.09Å
139	P	69.7	Low	68.8	Low	66 Å²	66	82.9 Å²	82.9	43%	0.429	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-17.5	-165.1	31.3	-33.1	0	0	0	112.7	K137	K137-P139 WeakPolarHBondContact O-CD 3.37Å
140	Q	79.4	Confident	70	Confident	59 Å²	59	79.6 Å²	79.6	28%	0.276	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-13.2	176.8	-64.8	-64.3	-50.9	0	0	112.8	L113 C138	L113-Q140 PolarHBondContact N-O 3.41Å; C138-Q140 PolarHBondContact O-N 2.99Å
141	W	84.8	Confident	71.2	Confident	24 Å²	24	82.7 Å²	82.7	9%	0.091	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	119	177.8	-174.2	-96.1	0	0	0	110.1	D106 G110 C112 H120 C123 C138	D106-W141 HydrophobicContact CB-CH2 3.63Å; D106-W141 HydrophobicContact CB-CZ2 4.03Å; G110-W141 WeakPolarHBondContact O-CZ2 3.24Å; C112-W141 HydrophobicContact CB-CE3 3.94Å; C112-W141 HydrophobicContact CB-CZ3 4Å; H120-W141 HydrophobicContact CB-CD2 4.29Å; H120-W141 HydrophobicContact CB-CE3 4.14Å; H120-W141 HydrophobicContact CB-CH2 4.12Å; H120-W141 HydrophobicContact CB-CZ2 4.21Å; H120-W141 HydrophobicContact CB-CZ3 4.06Å; H120-W141 AromaticContact CD2-CD1 3.58Å; H120-W141 AromaticContact CD2-CD2 3.49Å; H120-W141 VanDerWaalsContact CD2-CD2 3.49Å; H120-W141 AromaticContact CD2-CE2 3.62Å; H120-W141 AromaticContact CD2-CG 3.48Å; H120-W141 VanDerWaalsContact CD2-CG 3.48Å; H120-W141 AromaticContact CD2-NE1 3.63Å; C123-W141 HydrophobicContact CB-CE3 4.07Å; C138-W141 HydrophobicContact CB-CB 4.05Å; C138-W141 PolarHBondContact O-N 2.92Å; C138-W141 VanDerWaalsContact O-N 3.09Å
142	Q	86.6	Confident	72.1	Confident	41 Å²	41	81.6 Å²	81.6	19%	0.192	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	130.4	177.1	-71.5	-165	-23.1	0	0	111.1	G110 V111 L113	G110-Q142 CarbonylContact C-O 3.58Å; G110-Q142 WeakPolarHBondContact CA-O 3.42Å; V111-Q142 PolarHBondContact N-O 3.37Å; V111-Q142 PolarHBondContact O-N 3.49Å; L113-Q142 HydrophobicContact CD1-CG 3.96Å; L113-Q142 HydrophobicContact CG-CG 4.21Å
143	K	87.4	Confident	73.2	Confident	106 Å²	106	81 Å²	81	46%	0.461	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	153.1	168	-66.6	175.8	-175.8	165.5	0	109.3	E109 A145 E146 L147	E109-K143 WeakPolarHBondContact O-CA 3.49Å; K143-A145 VanDerWaalsContact C-N 3.26Å; K143-A145 PolarHBondContact O-N 2.67Å; K143-E146 WeakPolarHBondContact O-CB 3.38Å; K143-E146 PolarHBondContact O-N 2.99Å; K143-L147 PolarHBondContact O-N 3.32Å
144	W	88.9	Confident	75.1	Confident	38 Å²	38	79 Å²	79	14%	0.144	42%	0.416	C	S	.	.	H	α-helix	trans	-56.6	-38.1	-177.2	-72	108.7	0	0	0	114.6	L107 E146 L147 M148 N161 L164 W168	L107-W144 HydrophobicContact CD1-CH2 4.35Å; L107-W144 HydrophobicContact CD1-CZ2 3.77Å; L107-W144 HydrophobicContact CG-CZ2 4.13Å; L107-W144 PolarHBondContact O-NE1 3.34Å; W144-E146 VanDerWaalsContact C-N 3.34Å; W144-L147 HydrophobicContact CE3-CD2 4.19Å; W144-L147 HydrophobicContact CZ3-CD2 4.15Å; W144-L147 PolarHBondContact O-N 3.45Å; W144-M148 HydrophobicContact CB-CE 4.21Å; W144-M148 VanDerWaalsContact O-CE 3.23Å; W144-M148 WeakPolarHBondContact O-CE 3.42Å; W144-M148 PolarHBondContact O-N 2.71Å; W144-M148 VanDerWaalsContact O-N 3.12Å; W144-N161 PolarHBondContact N-OD1 3.29Å; W144-L164 HydrophobicContact CB-CB 4.49Å; W144-L164 HydrophobicContact CB-CD1 3.26Å; W144-L164 HydrophobicContact CD2-CD1 4.21Å; W144-L164 HydrophobicContact CG-CD1 3.68Å; W144-W168 AromaticContact CE2-NE1 3.49Å; W144-W168 HydrophobicContact CH2-CZ2 4.06Å; W144-W168 AromaticContact CZ2-CE2 3.84Å; W144-W168 AromaticContact CZ2-CZ2 3.83Å; W144-W168 HydrophobicContact CZ2-CZ2 3.83Å; W144-W168 AromaticContact CZ2-NE1 3.43Å; W144-W168 AromaticContact NE1-CD1 3.91Å; W144-W168 AromaticContact NE1-NE1 3.6Å
145	A	86.6	Confident	76.8	Confident	0 Å²	0	79.7 Å²	79.7	0%	0	43%	0.431	C	S	.	.	H	α-helix	trans	-65.6	-38.4	177.2	0	0	0	0	0	112.6	K143 M148 T149 A157 L160 N161	K143-A145 VanDerWaalsContact C-N 3.26Å; K143-A145 PolarHBondContact O-N 2.67Å; A145-M148 PolarHBondContact O-N 2.87Å; A145-T149 WeakPolarHBondContact O-CB 3.4Å; A145-T149 PolarHBondContact O-N 3.14Å; A145-T149 PolarHBondContact O-OG1 3.39Å; A145-A157 HydrophobicContact CB-CB 3.84Å; A145-A157 VanDerWaalsContact CB-O 3.29Å; A145-A157 WeakPolarHBondContact CB-O 3.4Å; A145-L160 HydrophobicContact CB-CB 4.12Å; A145-L160 HydrophobicContact CB-CD2 4.05Å; A145-L160 HydrophobicContact CB-CG 4.25Å; A145-N161 VanDerWaalsContact CB-CG 3.48Å; A145-N161 WeakPolarHBondContact CB-ND2 3.29Å; A145-N161 VanDerWaalsContact CB-OD1 3.25Å; A145-N161 WeakPolarHBondContact CB-OD1 3.22Å; A145-N161 PolarHBondContact N-OD1 2.88Å
146	E	85.5	Confident	78.5	Confident	62 Å²	62	73.9 Å²	73.9	29%	0.29	43%	0.426	S	S	.	.	H	α-helix	trans	-66	-42.3	178.1	-171.2	179.1	175.6	0	0	110.6	K143 W144 M148 G150 A152	K143-E146 WeakPolarHBondContact O-CB 3.38Å; K143-E146 PolarHBondContact O-N 2.99Å; W144-E146 VanDerWaalsContact C-N 3.34Å; E146-M148 PolarHBondContact O-N 3.14Å; E146-G150 VanDerWaalsContact O-CA 3.24Å; E146-G150 WeakPolarHBondContact O-CA 3.16Å; E146-G150 PolarHBondContact O-N 2.92Å; E146-A152 HydrophobicContact CG-CB 4.22Å
147	L	86.4	Confident	80.2	Confident	77 Å²	77	68.4 Å²	68.4	40%	0.403	40%	0.398	S	S	.	.	H	α-helix	trans	-62.6	-40.2	177	-174.5	68.4	0	0	0	112.9	V111 L113 K143 W144	V111-L147 HydrophobicContact CG1-CD2 4.02Å; L113-L147 HydrophobicContact CD2-CD1 4.18Å; K143-L147 PolarHBondContact O-N 3.32Å; W144-L147 HydrophobicContact CE3-CD2 4.19Å; W144-L147 HydrophobicContact CZ3-CD2 4.15Å; W144-L147 PolarHBondContact O-N 3.45Å
148	M	86.4	Confident	81.8	Confident	104 Å²	104	66.2 Å²	66.2	51%	0.512	39%	0.386	S	S	.	.	H	α-helix	trans	-87	-34.4	-176.7	-70.6	-176.5	-73.9	0	0	114.5	W144 A145 E146 L160 L164	W144-M148 HydrophobicContact CB-CE 4.21Å; W144-M148 VanDerWaalsContact O-CE 3.23Å; W144-M148 WeakPolarHBondContact O-CE 3.42Å; W144-M148 PolarHBondContact O-N 2.71Å; W144-M148 VanDerWaalsContact O-N 3.12Å; A145-M148 PolarHBondContact O-N 2.87Å; E146-M148 PolarHBondContact O-N 3.14Å; M148-L160 HydrophobicContact CB-CD2 4.5Å; M148-L160 HydrophobicContact CE-CD1 3.86Å; M148-L160 HydrophobicContact CE-CD2 3.57Å; M148-L160 HydrophobicContact CE-CG 3.66Å; M148-L164 HydrophobicContact CE-CD1 3.16Å; M148-L164 HydrophobicContact CE-CG 4.3Å; M148-L164 HydrophobicContact SD-CD1 4.38Å
149	T	81.9	Confident	82.9	Confident	67 Å²	67	70.9 Å²	70.9	41%	0.411	41%	0.41	S	S	.	.	H	α-helix	trans	-110.6	-9	-171.8	67.7	0	0	0	0	113.6	A145 H151 L160	A145-T149 WeakPolarHBondContact O-CB 3.4Å; A145-T149 PolarHBondContact O-N 3.14Å; A145-T149 PolarHBondContact O-OG1 3.39Å; T149-H151 PolarHBondContact O-N 3.34Å; T149-H151 PolarHBondContact O-ND1 3.29Å; T149-L160 HydrophobicContact CG2-CD2 3.7Å
150	G	77.9	Confident	83.9	Confident	64 Å²	64	70 Å²	70	66%	0.66	40%	0.401	S	S	*	.	S	Bend	trans	68.9	3.1	-176.6	0	0	0	0	0	114.7	E146	E146-G150 VanDerWaalsContact O-CA 3.24Å; E146-G150 WeakPolarHBondContact O-CA 3.16Å; E146-G150 PolarHBondContact O-N 2.92Å
151	H	77.3	Confident	84.4	Confident	132 Å²	132	68.1 Å²	68.1	61%	0.611	39%	0.393	S	S	*	.			trans	-116.4	124.7	-179.9	-65.5	75.2	0	0	0	110.1	T149	T149-H151 PolarHBondContact O-N 3.34Å; T149-H151 PolarHBondContact O-ND1 3.29Å
152	A	68.4	Low	84.8	Confident	60 Å²	60	69.1 Å²	69.1	50%	0.496	40%	0.397	S	S	.	.	S	Bend	trans	-81.7	-25.4	179.8	0	0	0	0	0	113.3	E146	E146-A152 HydrophobicContact CG-CB 4.22Å
153	E	71.5	Confident	85.2	Confident	178 Å²	178	73.2 Å²	73.2	83%	0.832	42%	0.415	S	S	*	.	S	Bend	trans	-126.8	137.8	-170.8	-62.6	-173.2	174.3	0	0	112.1
154	G	83.9	Confident	85.4	Confident	49 Å²	49	69 Å²	69	51%	0.505	40%	0.397	S	S	.	.	S	Bend	trans	142.5	161.6	176.8	0	0	0	0	0	113.7	G156 A157 Y158	G154-G156 VanDerWaalsContact C-N 3.3Å; G154-G156 PolarHBondContact O-N 3.01Å; G154-A157 PolarHBondContact O-N 2.85Å; G154-Y158 PolarHBondContact O-N 3.03Å
155	A	84.6	Confident	85.7	Confident	80 Å²	80	67.5 Å²	67.5	66%	0.661	39%	0.391	S	S	*	.	H	α-helix	trans	-61.6	-37.8	179	0	0	0	0	0	112.4	Y158 L159	A155-Y158 PolarHBondContact O-N 3.18Å; A155-L159 VanDerWaalsContact O-CG 3.31Å; A155-L159 WeakPolarHBondContact O-CG 3.12Å; A155-L159 PolarHBondContact O-N 2.93Å
156	G	86.2	Confident	86.1	Confident	54 Å²	54	69 Å²	69	56%	0.557	40%	0.399	S	S	*	.	H	α-helix	trans	-64.2	-42.3	175.8	0	0	0	0	0	113	G154 L159 L160	G154-G156 VanDerWaalsContact C-N 3.3Å; G154-G156 PolarHBondContact O-N 3.01Å; G156-L159 PolarHBondContact O-N 3.14Å; G156-L160 WeakPolarHBondContact O-CB 3.22Å; G156-L160 PolarHBondContact O-N 3.49Å
157	A	86.8	Confident	86.6	Confident	9 Å²	9	70.2 Å²	70.2	7%	0.074	41%	0.407	C	S	.	.	H	α-helix	trans	-66.5	-39.4	177.4	0	0	0	0	0	112	A145 G154 L160 N161	A145-A157 HydrophobicContact CB-CB 3.84Å; A145-A157 VanDerWaalsContact CB-O 3.29Å; A145-A157 WeakPolarHBondContact CB-O 3.4Å; G154-A157 PolarHBondContact O-N 2.85Å; A157-L160 PolarHBondContact O-N 3.49Å; A157-N161 WeakPolarHBondContact O-CB 3.32Å; A157-N161 PolarHBondContact O-N 3.06Å; A157-N161 PolarHBondContact O-ND2 3.11Å; A157-N161 VanDerWaalsContact O-ND2 3.11Å
158	Y	88.9	Confident	87	Confident	107 Å²	107	69.3 Å²	69.3	42%	0.42	40%	0.398	S	S	.	.	H	α-helix	trans	-61.9	-48.6	174.1	-178.3	-94.8	0	0	0	112	G154 A155 L160 N161 Y162 Y394	G154-Y158 PolarHBondContact O-N 3.03Å; A155-Y158 PolarHBondContact O-N 3.18Å; Y158-L160 VanDerWaalsContact C-N 3.31Å; Y158-L160 PolarHBondContact O-N 3.4Å; Y158-N161 PolarHBondContact O-N 2.96Å; Y158-Y162 WeakPolarHBondContact O-CB 3.38Å; Y158-Y162 PolarHBondContact O-N 2.79Å; Y158-Y394 HydrophobicContact CD2-CE1 4.27Å; Y158-Y394 HydrophobicContact CE1-CE1 4.22Å; Y158-Y394 HydrophobicContact CE2-CD1 4.44Å; Y158-Y394 AromaticContact CE2-CE1 3.65Å; Y158-Y394 HydrophobicContact CE2-CE1 3.65Å; Y158-Y394 AromaticContact CZ-CE1 3.62Å
159	L	90.9	Very high	87.4	Confident	111 Å²	111	64.3 Å²	64.3	58%	0.581	37%	0.374	S	S	*	.	H	α-helix	trans	-61.9	-38.5	178.3	-71.7	171.5	0	0	0	112.3	A155 G156 Y162 F163	A155-L159 VanDerWaalsContact O-CG 3.31Å; A155-L159 WeakPolarHBondContact O-CG 3.12Å; A155-L159 PolarHBondContact O-N 2.93Å; G156-L159 PolarHBondContact O-N 3.14Å; L159-Y162 PolarHBondContact O-N 3.45Å; L159-F163 WeakPolarHBondContact O-CB 3.3Å; L159-F163 PolarHBondContact O-N 3.43Å
160	L	91.1	Very high	88.2	Confident	48 Å²	48	63.5 Å²	63.5	25%	0.251	37%	0.367	S	S	.	.	H	α-helix	trans	-68.3	-45.2	178.4	-175	57.4	0	0	0	112.1	A145 M148 T149 G156 A157 Y158 Y162 F163 L164	A145-L160 HydrophobicContact CB-CB 4.12Å; A145-L160 HydrophobicContact CB-CD2 4.05Å; A145-L160 HydrophobicContact CB-CG 4.25Å; M148-L160 HydrophobicContact CB-CD2 4.5Å; M148-L160 HydrophobicContact CE-CD1 3.86Å; M148-L160 HydrophobicContact CE-CD2 3.57Å; M148-L160 HydrophobicContact CE-CG 3.66Å; T149-L160 HydrophobicContact CG2-CD2 3.7Å; G156-L160 WeakPolarHBondContact O-CB 3.22Å; G156-L160 PolarHBondContact O-N 3.49Å; A157-L160 PolarHBondContact O-N 3.49Å; Y158-L160 VanDerWaalsContact C-N 3.31Å; Y158-L160 PolarHBondContact O-N 3.4Å; L160-Y162 VanDerWaalsContact C-N 3.28Å; L160-Y162 PolarHBondContact O-N 2.97Å; L160-F163 PolarHBondContact O-N 2.95Å; L160-L164 PolarHBondContact O-N 3.2Å
161	N	90.8	Very high	89.1	Confident	20 Å²	20	64.1 Å²	64.1	11%	0.107	36%	0.355	C	S	.	.	H	α-helix	trans	-61.5	-39.3	173.8	-74.2	-38.8	0	0	0	111.4	W144 A145 A157 Y158 L164 Y165 Y394	W144-N161 PolarHBondContact N-OD1 3.29Å; A145-N161 VanDerWaalsContact CB-CG 3.48Å; A145-N161 WeakPolarHBondContact CB-ND2 3.29Å; A145-N161 VanDerWaalsContact CB-OD1 3.25Å; A145-N161 WeakPolarHBondContact CB-OD1 3.22Å; A145-N161 PolarHBondContact N-OD1 2.88Å; A157-N161 WeakPolarHBondContact O-CB 3.32Å; A157-N161 PolarHBondContact O-N 3.06Å; A157-N161 PolarHBondContact O-ND2 3.11Å; A157-N161 VanDerWaalsContact O-ND2 3.11Å; Y158-N161 PolarHBondContact O-N 2.96Å; N161-L164 PolarHBondContact O-N 2.98Å; N161-Y165 VanDerWaalsContact O-CB 3.32Å; N161-Y165 WeakPolarHBondContact O-CB 3.17Å; N161-Y165 PolarHBondContact O-N 3.19Å; N161-Y394 WeakPolarHBondContact CB-OH 3.45Å
162	Y	93.1	Very high	90	Very high	44 Å²	44	58.1 Å²	58.1	17%	0.173	33%	0.327	C	S	.	.	H	α-helix	trans	-63.4	-47.7	176.7	-172.9	-169.6	0	0	0	111.8	Y158 L159 L160 L164 Y165 I166 L391 Y394	Y158-Y162 WeakPolarHBondContact O-CB 3.38Å; Y158-Y162 PolarHBondContact O-N 2.79Å; L159-Y162 PolarHBondContact O-N 3.45Å; L160-Y162 VanDerWaalsContact C-N 3.28Å; L160-Y162 PolarHBondContact O-N 2.97Å; Y162-L164 PolarHBondContact O-N 3.2Å; Y162-Y165 PolarHBondContact O-N 2.87Å; Y162-I166 HydrophobicContact CD2-CD1 3.81Å; Y162-I166 HydrophobicContact CD2-CG1 4.14Å; Y162-I166 HydrophobicContact CE2-CD1 3.55Å; Y162-I166 HydrophobicContact CE2-CG1 4.08Å; Y162-I166 WeakPolarHBondContact O-CG1 3.38Å; Y162-I166 PolarHBondContact O-N 3.43Å; Y162-I166 VanDerWaalsContact O-N 3.16Å; Y162-L391 HydrophobicContact CE2-CD1 4.41Å; Y162-L391 WeakPolarHBondContact OH-CD1 2.92Å; Y162-L391 PolarHBondContact OH-O 3.47Å; Y162-Y394 HydrophobicContact CD1-CD1 4.17Å; Y162-Y394 AromaticContact CD2-CD1 3.37Å; Y162-Y394 HydrophobicContact CD2-CD1 3.37Å; Y162-Y394 HydrophobicContact CD2-CD2 4.01Å; Y162-Y394 HydrophobicContact CD2-CE1 4.06Å; Y162-Y394 AromaticContact CD2-CG 3.35Å; Y162-Y394 HydrophobicContact CD2-CG 3.35Å; Y162-Y394 AromaticContact CE2-CD1 3.91Å; Y162-Y394 HydrophobicContact CE2-CD1 3.91Å; Y162-Y394 AromaticContact CE2-CG 3.77Å; Y162-Y394 HydrophobicContact CE2-CG 3.77Å; Y162-Y394 AromaticContact CG-CD1 3.51Å; Y162-Y394 HydrophobicContact CG-CD1 3.51Å; Y162-Y394 AromaticContact CG-CE1 3.83Å; Y162-Y394 HydrophobicContact CG-CE1 3.83Å; Y162-Y394 AromaticContact CG-CG 4Å; Y162-Y394 HydrophobicContact CG-CG 4Å
163	F	93.9	Very high	91.3	Very high	127 Å²	127	55.3 Å²	55.3	56%	0.557	30%	0.304	S	S	*	.	H	α-helix	trans	-59.9	-44.9	177.3	176	-101.6	0	0	0	112	L159 L160 I166 L167	L159-F163 WeakPolarHBondContact O-CB 3.3Å; L159-F163 PolarHBondContact O-N 3.43Å; L160-F163 PolarHBondContact O-N 2.95Å; F163-I166 PolarHBondContact O-N 3.34Å; F163-L167 HydrophobicContact CE1-CD2 4.46Å; F163-L167 WeakPolarHBondContact O-CB 3.36Å; F163-L167 PolarHBondContact O-N 3.01Å
164	L	93.1	Very high	92.5	Very high	19 Å²	19	51.4 Å²	51.4	10%	0.099	28%	0.284	C	S	.	.	H	α-helix	trans	-69.6	-35.7	179.8	-74.6	-176.5	0	0	0	113.6	W144 M148 L160 N161 Y162 I166 L167 W168	W144-L164 HydrophobicContact CB-CB 4.49Å; W144-L164 HydrophobicContact CB-CD1 3.26Å; W144-L164 HydrophobicContact CD2-CD1 4.21Å; W144-L164 HydrophobicContact CG-CD1 3.68Å; M148-L164 HydrophobicContact CE-CD1 3.16Å; M148-L164 HydrophobicContact CE-CG 4.3Å; M148-L164 HydrophobicContact SD-CD1 4.38Å; L160-L164 PolarHBondContact O-N 3.2Å; N161-L164 PolarHBondContact O-N 2.98Å; Y162-L164 PolarHBondContact O-N 3.2Å; L164-I166 VanDerWaalsContact C-N 3.3Å; L164-I166 PolarHBondContact O-N 3.28Å; L164-L167 HydrophobicContact CD2-CD2 3.91Å; L164-L167 PolarHBondContact O-N 3.06Å; L164-W168 VanDerWaalsContact O-CD1 3.29Å; L164-W168 PolarHBondContact O-N 3.02Å
165	Y	93.8	Very high	93.1	Very high	5 Å²	5	52.5 Å²	52.5	2%	0.02	28%	0.278	C	S	.	.	H	α-helix	trans	-57	-46.5	172.1	-178.7	-87.5	0	0	0	110.9	K108 N161 Y162 A169 A390 Y394 R400	K108-Y165 HydrophobicContact CB-CD2 3.71Å; K108-Y165 HydrophobicContact CB-CE2 3.96Å; K108-Y165 HydrophobicContact CD-CD2 4.48Å; K108-Y165 HydrophobicContact CD-CE2 4.13Å; N161-Y165 VanDerWaalsContact O-CB 3.32Å; N161-Y165 WeakPolarHBondContact O-CB 3.17Å; N161-Y165 PolarHBondContact O-N 3.19Å; Y162-Y165 PolarHBondContact O-N 2.87Å; Y165-A169 WeakPolarHBondContact O-CB 3.41Å; Y165-A169 PolarHBondContact O-N 3.31Å; Y165-A390 HydrophobicContact CD1-CB 4.23Å; Y165-A390 HydrophobicContact CE1-CB 4.04Å; Y165-Y394 AromaticContact CD1-CD2 3.8Å; Y165-Y394 HydrophobicContact CD1-CD2 3.8Å; Y165-Y394 AromaticContact CD2-CD2 4Å; Y165-Y394 HydrophobicContact CD2-CD2 4Å; Y165-Y394 HydrophobicContact CD2-CE2 4.26Å; Y165-Y394 HydrophobicContact CE1-CD2 4.43Å; Y165-Y394 AromaticContact CG-CD2 3.57Å; Y165-Y394 HydrophobicContact CG-CD2 3.57Å; Y165-Y394 HydrophobicContact CG-CE2 4.02Å; Y165-R400 HydrophobicContact CD2-CG 4.47Å; Y165-R400 HydrophobicContact CE2-CG 3.76Å; Y165-R400 PolarHBondContact OH-O 3.18Å
166	I	95.3	Very high	93.6	Very high	33 Å²	33	48.7 Å²	48.7	17%	0.169	25%	0.247	C	C	.	.	H	α-helix	trans	-64.2	-45.3	176.4	-64.4	170.1	0	0	0	110.6	Y162 F163 L164 W168 A169 L170 A390 L391	Y162-I166 HydrophobicContact CD2-CD1 3.81Å; Y162-I166 HydrophobicContact CD2-CG1 4.14Å; Y162-I166 HydrophobicContact CE2-CD1 3.55Å; Y162-I166 HydrophobicContact CE2-CG1 4.08Å; Y162-I166 WeakPolarHBondContact O-CG1 3.38Å; Y162-I166 PolarHBondContact O-N 3.43Å; Y162-I166 VanDerWaalsContact O-N 3.16Å; F163-I166 PolarHBondContact O-N 3.34Å; L164-I166 VanDerWaalsContact C-N 3.3Å; L164-I166 PolarHBondContact O-N 3.28Å; I166-W168 PolarHBondContact O-N 3.21Å; I166-A169 PolarHBondContact O-N 2.85Å; I166-L170 HydrophobicContact CG2-CD1 3.84Å; I166-L170 HydrophobicContact CG2-CG 4.17Å; I166-L170 WeakPolarHBondContact O-CB 3.48Å; I166-L170 VanDerWaalsContact O-CG 3.28Å; I166-L170 WeakPolarHBondContact O-CG 3.38Å; I166-L170 PolarHBondContact O-N 3.27Å; I166-A390 HydrophobicContact CB-CB 4.5Å; I166-A390 HydrophobicContact CG1-CB 4.03Å; I166-L391 HydrophobicContact CD1-CD1 3.96Å
167	L	95.6	Very high	94	Very high	86 Å²	86	46.2 Å²	46.2	45%	0.45	22%	0.22	S	C	.	.	H	α-helix	trans	-59.2	-47.7	-178.8	-175.3	71.1	0	0	0	112	F163 L164 L170 L171	F163-L167 HydrophobicContact CE1-CD2 4.46Å; F163-L167 WeakPolarHBondContact O-CB 3.36Å; F163-L167 PolarHBondContact O-N 3.01Å; L164-L167 HydrophobicContact CD2-CD2 3.91Å; L164-L167 PolarHBondContact O-N 3.06Å; L167-L170 PolarHBondContact O-N 3.05Å; L167-L171 WeakPolarHBondContact O-CB 3.28Å; L167-L171 PolarHBondContact O-N 2.71Å
168	W	95.6	Very high	94.4	Very high	58 Å²	58	47.3 Å²	47.3	22%	0.22	23%	0.228	C	C	.	.	H	α-helix	trans	-64.6	-42.9	177.4	-81.7	114.7	0	0	0	112.2	L107 K108 W144 L164 I166 L170 L171 F172	L107-W168 HydrophobicContact CD2-CD2 4.41Å; L107-W168 HydrophobicContact CD2-CE3 4.02Å; L107-W168 HydrophobicContact CD2-CH2 3.56Å; L107-W168 HydrophobicContact CD2-CZ2 3.97Å; L107-W168 HydrophobicContact CD2-CZ3 3.58Å; L107-W168 HydrophobicContact CG-CD2 4.48Å; L107-W168 HydrophobicContact CG-CH2 4.26Å; L107-W168 HydrophobicContact CG-CZ2 4.16Å; L107-W168 HydrophobicContact CG-CZ3 4.45Å; K108-W168 HydrophobicContact CG-CB 3.95Å; W144-W168 AromaticContact CE2-NE1 3.49Å; W144-W168 HydrophobicContact CH2-CZ2 4.06Å; W144-W168 AromaticContact CZ2-CE2 3.84Å; W144-W168 AromaticContact CZ2-CZ2 3.83Å; W144-W168 HydrophobicContact CZ2-CZ2 3.83Å; W144-W168 AromaticContact CZ2-NE1 3.43Å; W144-W168 AromaticContact NE1-CD1 3.91Å; W144-W168 AromaticContact NE1-NE1 3.6Å; L164-W168 VanDerWaalsContact O-CD1 3.29Å; L164-W168 PolarHBondContact O-N 3.02Å; I166-W168 PolarHBondContact O-N 3.21Å; W168-L170 VanDerWaalsContact C-N 3.35Å; W168-L170 PolarHBondContact O-N 3.28Å; W168-L171 HydrophobicContact CE3-CD2 3.7Å; W168-L171 HydrophobicContact CZ3-CD2 3.58Å; W168-L171 PolarHBondContact O-N 2.71Å; W168-F172 HydrophobicContact CB-CE2 4.48Å; W168-F172 HydrophobicContact CD2-CZ 4.48Å; W168-F172 HydrophobicContact CE3-CD1 4.48Å; W168-F172 AromaticContact CE3-CE1 3.66Å; W168-F172 HydrophobicContact CE3-CE1 3.66Å; W168-F172 HydrophobicContact CE3-CE2 4.33Å; W168-F172 AromaticContact CE3-CZ 3.59Å; W168-F172 HydrophobicContact CE3-CZ 3.59Å; W168-F172 AromaticContact CZ3-CE1 3.89Å; W168-F172 HydrophobicContact CZ3-CE1 3.89Å; W168-F172 HydrophobicContact CZ3-CZ 4.07Å; W168-F172 WeakPolarHBondContact O-CD2 3.26Å; W168-F172 WeakPolarHBondContact O-CG 3.46Å; W168-F172 PolarHBondContact O-N 3.34Å
169	A	95.8	Very high	94.6	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-58	-47.1	175.6	0	0	0	0	0	111.7	K108 Y165 I166 F172 S173 S226 T386 A390	K108-A169 HydrophobicContact CD-CB 4.49Å; Y165-A169 WeakPolarHBondContact O-CB 3.41Å; Y165-A169 PolarHBondContact O-N 3.31Å; I166-A169 PolarHBondContact O-N 2.85Å; A169-F172 PolarHBondContact O-N 3.21Å; A169-S173 WeakPolarHBondContact O-CB 3.32Å; A169-S173 PolarHBondContact O-N 2.95Å; A169-S173 PolarHBondContact O-OG 3.35Å; A169-S226 WeakPolarHBondContact CB-O 3.37Å; A169-T386 HydrophobicContact CB-CG2 4.02Å; A169-A390 HydrophobicContact CB-CB 3.97Å
170	L	96.9	Very high	94.7	Very high	50 Å²	50	39.2 Å²	39.2	26%	0.262	19%	0.192	S	C	.	.	H	α-helix	trans	-63.1	-44.1	177	-69.7	178.9	0	0	0	111.9	I166 L167 W168 F172 S173 F174 I383 T386	I166-L170 HydrophobicContact CG2-CD1 3.84Å; I166-L170 HydrophobicContact CG2-CG 4.17Å; I166-L170 WeakPolarHBondContact O-CB 3.48Å; I166-L170 VanDerWaalsContact O-CG 3.28Å; I166-L170 WeakPolarHBondContact O-CG 3.38Å; I166-L170 PolarHBondContact O-N 3.27Å; L167-L170 PolarHBondContact O-N 3.05Å; W168-L170 VanDerWaalsContact C-N 3.35Å; W168-L170 PolarHBondContact O-N 3.28Å; L170-F172 PolarHBondContact O-N 3.37Å; L170-S173 PolarHBondContact O-N 3.47Å; L170-S173 PolarHBondContact O-OG 3Å; L170-F174 VanDerWaalsContact O-CB 3.29Å; L170-F174 WeakPolarHBondContact O-CB 3.47Å; L170-F174 PolarHBondContact O-N 3.4Å; L170-I383 HydrophobicContact CD2-CG2 3.97Å; L170-I383 WeakPolarHBondContact CD2-O 3.38Å; L170-T386 HydrophobicContact CD2-CG2 4.26Å
171	L	96.9	Very high	94.6	Very high	77 Å²	77	42.7 Å²	42.7	40%	0.403	20%	0.202	S	C	.	.	H	α-helix	trans	-58	-49.8	177.6	-175.9	77.3	0	0	0	111.7	L167 W168 F174 L175	L167-L171 WeakPolarHBondContact O-CB 3.28Å; L167-L171 PolarHBondContact O-N 2.71Å; W168-L171 HydrophobicContact CE3-CD2 3.7Å; W168-L171 HydrophobicContact CZ3-CD2 3.58Å; W168-L171 PolarHBondContact O-N 2.71Å; L171-F174 PolarHBondContact O-N 3.29Å; L171-L175 HydrophobicContact CG-CD1 4.17Å; L171-L175 WeakPolarHBondContact O-CG 3.34Å; L171-L175 PolarHBondContact O-N 3.05Å
172	F	96.9	Very high	94.6	Very high	6 Å²	6	46.8 Å²	46.8	3%	0.026	23%	0.228	C	C	.	.	H	α-helix	trans	-63.5	-44	179.8	-64.6	-28.2	0	0	0	112.1	M104 L107 K108 W168 A169 L170 F174 L175 A176 L222	M104-F172 HydrophobicContact CE-CD1 3.79Å; M104-F172 HydrophobicContact CE-CE1 3.41Å; M104-F172 VanDerWaalsContact CE-CE1 3.41Å; M104-F172 HydrophobicContact CE-CG 4.48Å; M104-F172 HydrophobicContact CE-CZ 3.8Å; M104-F172 VanDerWaalsContact O-CE2 3.25Å; M104-F172 WeakPolarHBondContact O-CE2 3.26Å; L107-F172 HydrophobicContact CD2-CZ 4.04Å; K108-F172 HydrophobicContact CG-CE2 4.14Å; W168-F172 HydrophobicContact CB-CE2 4.48Å; W168-F172 HydrophobicContact CD2-CZ 4.48Å; W168-F172 HydrophobicContact CE3-CD1 4.48Å; W168-F172 AromaticContact CE3-CE1 3.66Å; W168-F172 HydrophobicContact CE3-CE1 3.66Å; W168-F172 HydrophobicContact CE3-CE2 4.33Å; W168-F172 AromaticContact CE3-CZ 3.59Å; W168-F172 HydrophobicContact CE3-CZ 3.59Å; W168-F172 AromaticContact CZ3-CE1 3.89Å; W168-F172 HydrophobicContact CZ3-CE1 3.89Å; W168-F172 HydrophobicContact CZ3-CZ 4.07Å; W168-F172 WeakPolarHBondContact O-CD2 3.26Å; W168-F172 WeakPolarHBondContact O-CG 3.46Å; W168-F172 PolarHBondContact O-N 3.34Å; A169-F172 PolarHBondContact O-N 3.21Å; L170-F172 PolarHBondContact O-N 3.37Å; F172-F174 PolarHBondContact O-N 2.94Å; F172-L175 PolarHBondContact O-N 3.16Å; F172-A176 WeakPolarHBondContact O-CB 3.27Å; F172-A176 PolarHBondContact O-N 3.44Å; F172-L222 HydrophobicContact CB-CD2 4.44Å; F172-L222 HydrophobicContact CD1-CD2 3.99Å; F172-L222 HydrophobicContact CG-CD2 4.48Å
173	S	96.3	Very high	94.5	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.007	25%	0.246	C	C	.	.	H	α-helix	trans	-64.8	-38.5	178.3	73	0	0	0	0	112.5	A169 L170 A176 V177 T386	A169-S173 WeakPolarHBondContact O-CB 3.32Å; A169-S173 PolarHBondContact O-N 2.95Å; A169-S173 PolarHBondContact O-OG 3.35Å; L170-S173 PolarHBondContact O-N 3.47Å; L170-S173 PolarHBondContact O-OG 3Å; S173-A176 PolarHBondContact O-N 3.47Å; S173-V177 WeakPolarHBondContact O-CG1 3.04Å; S173-V177 PolarHBondContact O-N 2.97Å; S173-T386 WeakPolarHBondContact CB-OG1 3.29Å; S173-T386 PolarHBondContact OG-OG1 3.24Å
174	F	96.4	Very high	94.3	Very high	95 Å²	95	44.8 Å²	44.8	42%	0.417	22%	0.22	S	C	.	.	H	α-helix	trans	-64.5	-46.2	176.6	174.3	-106.9	0	0	0	111.9	L170 L171 F172 V177 S178 V379 I383	L170-F174 VanDerWaalsContact O-CB 3.29Å; L170-F174 WeakPolarHBondContact O-CB 3.47Å; L170-F174 PolarHBondContact O-N 3.4Å; L171-F174 PolarHBondContact O-N 3.29Å; F172-F174 PolarHBondContact O-N 2.94Å; F174-V177 WeakPolarHBondContact O-CG1 3.33Å; F174-S178 VanDerWaalsContact O-CB 3.24Å; F174-S178 WeakPolarHBondContact O-CB 3.46Å; F174-S178 PolarHBondContact O-N 2.95Å; F174-S178 PolarHBondContact O-OG 2.82Å; F174-V379 HydrophobicContact CD2-CG1 4.21Å; F174-V379 HydrophobicContact CE2-CG1 4.27Å; F174-I383 HydrophobicContact CD2-CD1 3.88Å
175	L	96.1	Very high	94	Very high	72 Å²	72	47.1 Å²	47.1	38%	0.377	24%	0.236	S	C	.	.	H	α-helix	trans	-63.2	-43.7	176.2	-71	171.4	0	0	0	111.1	L171 F172 S178 L179 L222	L171-L175 HydrophobicContact CG-CD1 4.17Å; L171-L175 WeakPolarHBondContact O-CG 3.34Å; L171-L175 PolarHBondContact O-N 3.05Å; F172-L175 PolarHBondContact O-N 3.16Å; L175-S178 PolarHBondContact O-N 3.49Å; L175-L179 WeakPolarHBondContact O-CB 3.41Å; L175-L179 VanDerWaalsContact O-CG 3.31Å; L175-L179 WeakPolarHBondContact O-CG 3.27Å; L175-L179 PolarHBondContact O-N 3.07Å; L175-L222 HydrophobicContact CB-CD1 4.07Å
176	A	95.6	Very high	93.7	Very high	1 Å²	1	51.8 Å²	51.8	1%	0.008	26%	0.255	C	S	.	.	H	α-helix	trans	-58.5	-53.7	178.9	0	0	0	0	0	111.9	F172 S173 S178 L179 V180 L222	F172-A176 WeakPolarHBondContact O-CB 3.27Å; F172-A176 PolarHBondContact O-N 3.44Å; S173-A176 PolarHBondContact O-N 3.47Å; A176-S178 VanDerWaalsContact C-N 3.35Å; A176-S178 PolarHBondContact O-N 3.35Å; A176-L179 PolarHBondContact O-N 2.96Å; A176-V180 WeakPolarHBondContact O-CG2 3.18Å; A176-V180 PolarHBondContact O-N 3.5Å; A176-V180 VanDerWaalsContact O-N 3.13Å; A176-L222 HydrophobicContact CB-CB 3.81Å
177	V	94.9	Very high	93.4	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.006	25%	0.247	C	C	.	.	H	α-helix	trans	-67.6	-35.1	-177.9	70.2	0	0	0	0	112.4	S173 F174 R181 V379 V382 I473	S173-V177 WeakPolarHBondContact O-CG1 3.04Å; S173-V177 PolarHBondContact O-N 2.97Å; F174-V177 WeakPolarHBondContact O-CG1 3.33Å; V177-R181 VanDerWaalsContact O-CB 3.3Å; V177-R181 WeakPolarHBondContact O-CB 3.27Å; V177-R181 PolarHBondContact O-N 3.26Å; V177-V379 HydrophobicContact CG1-CB 4.19Å; V177-V379 HydrophobicContact CG1-CG1 3.83Å; V177-V379 HydrophobicContact CG1-CG2 4.11Å; V177-V379 HydrophobicContact CG2-CG2 4.03Å; V177-V382 HydrophobicContact CB-CB 4.31Å; V177-V382 HydrophobicContact CB-CG1 4.25Å; V177-V382 HydrophobicContact CB-CG2 4.25Å; V177-V382 HydrophobicContact CG1-CB 4.42Å; V177-V382 HydrophobicContact CG1-CG1 4.43Å; V177-V382 HydrophobicContact CG2-CB 4.37Å; V177-V382 HydrophobicContact CG2-CG2 3.92Å; V177-I473 HydrophobicContact CB-CG2 3.86Å; V177-I473 HydrophobicContact CG2-CG2 4.22Å
178	S	94	Very high	93.2	Very high	33 Å²	33	47.4 Å²	47.4	23%	0.231	23%	0.234	C	C	.	.	H	α-helix	trans	-66.2	-45.2	178.6	-60.5	0	0	0	0	111.5	F174 L175 A176 R181 V182	F174-S178 VanDerWaalsContact O-CB 3.24Å; F174-S178 WeakPolarHBondContact O-CB 3.46Å; F174-S178 PolarHBondContact O-N 2.95Å; F174-S178 PolarHBondContact O-OG 2.82Å; L175-S178 PolarHBondContact O-N 3.49Å; A176-S178 VanDerWaalsContact C-N 3.35Å; A176-S178 PolarHBondContact O-N 3.35Å; S178-R181 PolarHBondContact O-N 3.11Å; S178-V182 WeakPolarHBondContact O-CB 3.36Å; S178-V182 VanDerWaalsContact O-CG2 3.31Å; S178-V182 WeakPolarHBondContact O-CG2 3.09Å; S178-V182 PolarHBondContact O-N 3.26Å
179	L	93.9	Very high	93	Very high	47 Å²	47	45.4 Å²	45.4	25%	0.246	23%	0.232	C	C	.	.	H	α-helix	trans	-63.4	-43.7	177.2	-73.8	174.9	0	0	0	112.2	L175 A176 F183 V218 T219 L222	L175-L179 WeakPolarHBondContact O-CB 3.41Å; L175-L179 VanDerWaalsContact O-CG 3.31Å; L175-L179 WeakPolarHBondContact O-CG 3.27Å; L175-L179 PolarHBondContact O-N 3.07Å; A176-L179 PolarHBondContact O-N 2.96Å; L179-F183 HydrophobicContact CD2-CD2 3.78Å; L179-F183 HydrophobicContact CD2-CE2 3.71Å; L179-F183 WeakPolarHBondContact O-CB 3.21Å; L179-F183 PolarHBondContact O-N 3.33Å; L179-V218 HydrophobicContact CD1-CG1 4.16Å; L179-T219 HydrophobicContact CB-CG2 3.5Å; L179-T219 HydrophobicContact CD1-CG2 3.97Å; L179-T219 HydrophobicContact CG-CG2 4.4Å; L179-L222 HydrophobicContact CD1-CD1 3.98Å
180	V	92.8	Very high	92.8	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.006	23%	0.233	C	C	.	.	H	α-helix	trans	-62.8	-44.6	177.1	172	0	0	0	0	111.2	A176 A184 P185 A187 C188 T219 P474	A176-V180 WeakPolarHBondContact O-CG2 3.18Å; A176-V180 PolarHBondContact O-N 3.5Å; A176-V180 VanDerWaalsContact O-N 3.13Å; V180-A184 CarbonylContact O-C 3.57Å; V180-A184 PolarHBondContact O-N 3.32Å; V180-P185 WeakPolarHBondContact O-CA 3.3Å; V180-P185 VanDerWaalsContact O-N 3.15Å; V180-A187 HydrophobicContact CG1-CB 4.42Å; V180-A187 HydrophobicContact CG2-CB 4.29Å; V180-C188 WeakPolarHBondContact CG1-SG 3.35Å; V180-T219 HydrophobicContact CG2-CG2 3.76Å; V180-P474 HydrophobicContact CG2-CG 4.2Å
181	R	90.2	Very high	92.5	Very high	120 Å²	120	43.2 Å²	43.2	45%	0.453	22%	0.22	S	C	.	.	H	α-helix	trans	-67.3	-42.3	-177.8	-173.4	177.5	-179	165	3.1	112.7	V177 S178	V177-R181 VanDerWaalsContact O-CB 3.3Å; V177-R181 WeakPolarHBondContact O-CB 3.27Å; V177-R181 PolarHBondContact O-N 3.26Å; S178-R181 PolarHBondContact O-N 3.11Å
182	V	90.4	Very high	92.4	Very high	107 Å²	107	39.7 Å²	39.7	65%	0.648	20%	0.202	S	C	*	.	H	α-helix	trans	-80.8	-43	-173.9	174.9	0	0	0	0	112	S178	S178-V182 WeakPolarHBondContact O-CB 3.36Å; S178-V182 VanDerWaalsContact O-CG2 3.31Å; S178-V182 WeakPolarHBondContact O-CG2 3.09Å; S178-V182 PolarHBondContact O-N 3.26Å
183	F	90.6	Very high	92.1	Very high	126 Å²	126	39.7 Å²	39.7	55%	0.553	20%	0.203	S	C	*	.	H	α-helix	trans	-103	-37.1	-169.1	-66.1	-75.9	0	0	0	114.6	L179 I215	L179-F183 HydrophobicContact CD2-CD2 3.78Å; L179-F183 HydrophobicContact CD2-CE2 3.71Å; L179-F183 WeakPolarHBondContact O-CB 3.21Å; L179-F183 PolarHBondContact O-N 3.33Å; F183-I215 HydrophobicContact CB-CD1 3.62Å; F183-I215 HydrophobicContact CB-CG1 3.76Å; F183-I215 HydrophobicContact CD2-CD1 4.25Å; F183-I215 HydrophobicContact CG-CD1 4.03Å
184	A	88.9	Confident	91.9	Very high	3 Å²	3	40.8 Å²	40.8	3%	0.025	21%	0.207	C	C	.	.			trans	-154.3	83.3	-172.5	0	0	0	0	0	112.5	V180 Y186 A187 T212 I215	V180-A184 CarbonylContact O-C 3.57Å; V180-A184 PolarHBondContact O-N 3.32Å; A184-Y186 PolarHBondContact O-N 2.9Å; A184-A187 HydrophobicContact CB-CB 4.31Å; A184-A187 WeakPolarHBondContact O-CB 3.42Å; A184-A187 PolarHBondContact O-N 3.43Å; A184-T212 HydrophobicContact CB-CG2 4.36Å; A184-I215 HydrophobicContact CB-CB 3.76Å; A184-I215 HydrophobicContact CB-CG1 3.9Å; A184-I215 HydrophobicContact CB-CG2 3.9Å
185	P	86.7	Confident	91.7	Very high	67 Å²	67	36.5 Å²	36.5	44%	0.435	19%	0.189	S	C	.	.	G	3₁₀ helix	trans	-61.8	-29	-178.7	22.8	-33.5	0	0	0	112.9	V180 A187 C188	V180-P185 WeakPolarHBondContact O-CA 3.3Å; V180-P185 VanDerWaalsContact O-N 3.15Å; P185-A187 PolarHBondContact O-N 3.35Å; P185-A187 VanDerWaalsContact O-N 3.14Å; P185-C188 PolarHBondContact O-N 3Å; P185-C188 PolarHBondContact O-SG 3.49Å
186	Y	88.1	Confident	91.4	Very high	104 Å²	104	33.5 Å²	33.5	41%	0.408	17%	0.173	S	C	.	.	G	3₁₀ helix	trans	-65	-9.8	174.1	-66.4	-61.9	0	0	0	114.4	A184 C188 Y207	A184-Y186 PolarHBondContact O-N 2.9Å; Y186-C188 VanDerWaalsContact C-N 3.27Å; Y186-C188 PolarHBondContact O-N 3.38Å; Y186-Y207 AromaticContact CD1-CD2 3.94Å; Y186-Y207 HydrophobicContact CD1-CD2 3.94Å; Y186-Y207 HydrophobicContact CG-CD2 4.23Å
187	A	89.3	Confident	91	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-73.8	-17.7	175.7	0	0	0	0	0	113.2	V180 A184 P185 I215 K216	V180-A187 HydrophobicContact CG1-CB 4.42Å; V180-A187 HydrophobicContact CG2-CB 4.29Å; A184-A187 HydrophobicContact CB-CB 4.31Å; A184-A187 WeakPolarHBondContact O-CB 3.42Å; A184-A187 PolarHBondContact O-N 3.43Å; P185-A187 PolarHBondContact O-N 3.35Å; P185-A187 VanDerWaalsContact O-N 3.14Å; A187-I215 HydrophobicContact CB-CG2 4.42Å; A187-K216 HydrophobicContact CB-CB 3.92Å; A187-K216 HydrophobicContact CB-CD 4.48Å; A187-K216 HydrophobicContact CB-CG 4.29Å; A187-K216 WeakPolarHBondContact O-CE 3.45Å; A187-K216 PolarHBondContact O-NZ 3.45Å
188	C	90.4	Very high	90.7	Very high	26 Å²	26	34.1 Å²	34.1	18%	0.176	18%	0.176	C	C	.	.			trans	-54.5	152.5	179.3	-66.4	0	0	0	0	113.3	V180 P185 Y186	V180-C188 WeakPolarHBondContact CG1-SG 3.35Å; P185-C188 PolarHBondContact O-N 3Å; P185-C188 PolarHBondContact O-SG 3.49Å; Y186-C188 VanDerWaalsContact C-N 3.27Å; Y186-C188 PolarHBondContact O-N 3.38Å
189	G	91.3	Very high	90.4	Very high	17 Å²	17	33 Å²	33	18%	0.175	17%	0.167	C	C	.	.	S	Bend	trans	70.7	-173.6	171.8	0	0	0	0	0	114.6	K216 I473 S475	G189-K216 PolarHBondContact O-NZ 3.08Å; G189-I473 PolarHBondContact N-O 3.39Å; G189-S475 CarbonylContact C-O 3.55Å; G189-S475 PolarHBondContact O-N 3.23Å
190	S	91.4	Very high	89.8	Confident	4 Å²	4	30.9 Å²	30.9	3%	0.028	16%	0.157	C	C	.	.			trans	-69.4	-43.5	180	-174.2	0	0	0	0	111.7	K216 G234 P235 S475	S190-K216 PolarHBondContact O-NZ 2.78Å; S190-G234 WeakPolarHBondContact OG-CA 3.3Å; S190-P235 WeakPolarHBondContact O-CA 2.87Å; S190-S475 WeakPolarHBondContact CA-O 3.05Å; S190-S475 VanDerWaalsContact CB-O 3.29Å; S190-S475 WeakPolarHBondContact CB-O 3.15Å; S190-S475 PolarHBondContact N-O 2.95Å
191	G	91.9	Very high	89.1	Confident	0 Å²	0	31 Å²	31	0%	0	16%	0.158	C	C	.	.	S	Bend	trans	90.1	-7.7	-174.7	0	0	0	0	0	116.3	E194 I195 Y207	G191-E194 VanDerWaalsContact CA-OE2 3.22Å; G191-E194 WeakPolarHBondContact CA-OE2 3.44Å; G191-I195 WeakPolarHBondContact O-CB 3.41Å; G191-I195 WeakPolarHBondContact O-CD1 3.4Å; G191-I195 WeakPolarHBondContact O-CG1 3.5Å; G191-I195 PolarHBondContact O-N 3.22Å; G191-Y207 WeakPolarHBondContact CA-OH 3.36Å
192	I	93.5	Very high	88.6	Confident	2 Å²	2	25.6 Å²	25.6	1%	0.01	14%	0.137	C	C	.	.	H	α-helix	trans	-63.3	-46.4	173.8	-66	167.7	0	0	0	111.7	E194 I195 K196 V237 F286 F478 Y581	I192-E194 VanDerWaalsContact C-N 3.31Å; I192-E194 PolarHBondContact O-N 3.34Å; I192-I195 PolarHBondContact O-N 2.74Å; I192-K196 WeakPolarHBondContact O-CB 3.13Å; I192-K196 PolarHBondContact O-N 2.72Å; I192-V237 HydrophobicContact CD1-CG2 4.42Å; I192-V237 HydrophobicContact CG1-CB 4.36Å; I192-F286 HydrophobicContact CD1-CZ 4.21Å; I192-F478 HydrophobicContact CD1-CE2 4.25Å; I192-F478 HydrophobicContact CD1-CZ 3.91Å; I192-Y581 HydrophobicContact CB-CD1 4.14Å; I192-Y581 HydrophobicContact CB-CE1 3.96Å; I192-Y581 HydrophobicContact CD1-CE1 4.11Å; I192-Y581 HydrophobicContact CD1-CE2 4.28Å; I192-Y581 WeakPolarHBondContact CD1-OH 3.39Å; I192-Y581 HydrophobicContact CG2-CD1 4.11Å; I192-Y581 HydrophobicContact CG2-CD2 4.1Å; I192-Y581 HydrophobicContact CG2-CE1 4.2Å; I192-Y581 HydrophobicContact CG2-CE2 4.2Å; I192-Y581 HydrophobicContact CG2-CG 4.05Å
193	P	92.1	Very high	88.1	Confident	7 Å²	7	22.2 Å²	22.2	5%	0.045	12%	0.116	C	C	.	.	H	α-helix	trans	-51.6	-48.7	175.3	-30.9	38.9	0	0	0	112.9	K196 T197 Y581 H584 I585	P193-K196 WeakPolarHBondContact O-CB 2.79Å; P193-K196 PolarHBondContact O-N 3.23Å; P193-T197 VanDerWaalsContact O-CG2 3.31Å; P193-T197 WeakPolarHBondContact O-CG2 3.13Å; P193-T197 PolarHBondContact O-N 3.43Å; P193-Y581 HydrophobicContact CG-CD1 3.81Å; P193-H584 HydrophobicContact CG-CB 4.26Å; P193-I585 HydrophobicContact CB-CD1 4.5Å; P193-I585 HydrophobicContact CB-CG1 3.76Å
194	E	90.9	Very high	87.7	Confident	23 Å²	23	17.2 Å²	17.2	11%	0.107	9%	0.094	C	C	.	.	H	α-helix	trans	-68.6	-41.7	-178.4	-64.8	79	-175.4	0	0	111.2	G191 I192 K196 T197 I198 I204 Y207 Y590	G191-E194 VanDerWaalsContact CA-OE2 3.22Å; G191-E194 WeakPolarHBondContact CA-OE2 3.44Å; I192-E194 VanDerWaalsContact C-N 3.31Å; I192-E194 PolarHBondContact O-N 3.34Å; E194-K196 VanDerWaalsContact C-N 3.31Å; E194-K196 PolarHBondContact O-N 3.27Å; E194-T197 WeakPolarHBondContact CA-OG1 2.99Å; E194-T197 PolarHBondContact O-N 3.03Å; E194-T197 PolarHBondContact O-OG1 3.38Å; E194-I198 VanDerWaalsContact O-CG1 3.29Å; E194-I198 WeakPolarHBondContact O-CG1 3.5Å; E194-I198 PolarHBondContact O-N 3.4Å; E194-I204 HydrophobicContact CB-CD1 4.22Å; E194-I204 HydrophobicContact CG-CD1 4.43Å; E194-Y207 HydrophobicContact CB-CD1 4.24Å; E194-Y207 HydrophobicContact CB-CD2 4.38Å; E194-Y207 HydrophobicContact CB-CE1 3.56Å; E194-Y207 HydrophobicContact CB-CE2 3.76Å; E194-Y207 WeakPolarHBondContact CB-OH 3.32Å; E194-Y207 HydrophobicContact CG-CD2 4.41Å; E194-Y207 HydrophobicContact CG-CE1 4.42Å; E194-Y207 HydrophobicContact CG-CE2 3.69Å; E194-Y207 PolarHBondContact OE2-OH 2.71Å; E194-Y590 HydrophobicContact CG-CE2 3.96Å
195	I	92.4	Very high	87.3	Confident	5 Å²	5	25.3 Å²	25.3	3%	0.026	12%	0.124	C	C	.	.	H	α-helix	trans	-61.7	-41.1	174.5	-66.4	159.4	0	0	0	111	G191 I192 T197 I198 L199 Y207 V237 H238 C241 V291	G191-I195 WeakPolarHBondContact O-CB 3.41Å; G191-I195 WeakPolarHBondContact O-CD1 3.4Å; G191-I195 WeakPolarHBondContact O-CG1 3.5Å; G191-I195 PolarHBondContact O-N 3.22Å; I192-I195 PolarHBondContact O-N 2.74Å; I195-T197 VanDerWaalsContact C-N 3.35Å; I195-T197 PolarHBondContact O-N 3.38Å; I195-I198 PolarHBondContact O-N 3.09Å; I195-L199 HydrophobicContact CG2-CD1 3.96Å; I195-L199 HydrophobicContact CG2-CG 4.38Å; I195-L199 WeakPolarHBondContact O-CG 3.14Å; I195-L199 PolarHBondContact O-N 3.06Å; I195-Y207 HydrophobicContact CG1-CE1 4.4Å; I195-V237 HydrophobicContact CD1-CG1 4.3Å; I195-H238 HydrophobicContact CD1-CB 3.88Å; I195-C241 HydrophobicContact CD1-CB 4.2Å; I195-C241 HydrophobicContact CG1-CB 4.49Å; I195-V291 HydrophobicContact CG2-CG1 3.77Å
196	K	90.6	Very high	87.1	Confident	10 Å²	10	24.5 Å²	24.5	4%	0.043	13%	0.128	C	C	.	.	H	α-helix	trans	-60.3	-44.2	176.3	-163.6	-179.5	-165.4	-164.8	0	111.1	I192 P193 E194 L199 S200 E290 E582 I585 Y592	I192-K196 WeakPolarHBondContact O-CB 3.13Å; I192-K196 PolarHBondContact O-N 2.72Å; P193-K196 WeakPolarHBondContact O-CB 2.79Å; P193-K196 PolarHBondContact O-N 3.23Å; E194-K196 VanDerWaalsContact C-N 3.31Å; E194-K196 PolarHBondContact O-N 3.27Å; K196-L199 PolarHBondContact O-N 2.9Å; K196-S200 WeakPolarHBondContact O-CB 3.12Å; K196-S200 PolarHBondContact O-N 2.67Å; K196-E290 WeakPolarHBondContact CE-O 3.31Å; K196-E582 IonicContact NZ-OE1 2.77Å; K196-E582 PolarHBondContact NZ-OE1 3.25Å; K196-I585 HydrophobicContact CB-CD1 4.18Å; K196-I585 HydrophobicContact CD-CD1 3.83Å; K196-I585 HydrophobicContact CG-CD1 4.33Å; K196-Y592 HydrophobicContact CD-CE1 4.44Å; K196-Y592 HydrophobicContact CD-CE2 4.24Å; K196-Y592 WeakPolarHBondContact CE-OH 3.32Å; K196-Y592 HydrophobicContact CG-CE2 3.89Å; K196-Y592 PolarHBondContact NZ-OH 3.33Å
197	T	87.5	Confident	87.2	Confident	2 Å²	2	19.8 Å²	19.8	1%	0.012	11%	0.109	C	C	.	.	H	α-helix	trans	-66	-39.4	175.1	66	0	0	0	0	112.3	P193 E194 I195 S200 G201 F202 I585 Y590	P193-T197 VanDerWaalsContact O-CG2 3.31Å; P193-T197 WeakPolarHBondContact O-CG2 3.13Å; P193-T197 PolarHBondContact O-N 3.43Å; E194-T197 WeakPolarHBondContact CA-OG1 2.99Å; E194-T197 PolarHBondContact O-N 3.03Å; E194-T197 PolarHBondContact O-OG1 3.38Å; I195-T197 VanDerWaalsContact C-N 3.35Å; I195-T197 PolarHBondContact O-N 3.38Å; T197-S200 PolarHBondContact O-N 3.13Å; T197-G201 PolarHBondContact O-N 2.91Å; T197-F202 PolarHBondContact O-N 2.65Å; T197-I585 HydrophobicContact CG2-CD1 4.12Å; T197-I585 HydrophobicContact CG2-CG1 4.05Å; T197-I585 HydrophobicContact CG2-CG2 4.01Å; T197-Y590 HydrophobicContact CG2-CD2 3.85Å; T197-Y590 HydrophobicContact CG2-CG 3.98Å
198	I	88.3	Confident	87.2	Confident	13 Å²	13	20.5 Å²	20.5	7%	0.067	11%	0.113	C	C	.	.	H	α-helix	trans	-59.9	-53.7	175.6	-71.5	163.5	0	0	0	108.9	E194 I195 S200 G201 F202 I204 Y207 L208 R262 L265	E194-I198 VanDerWaalsContact O-CG1 3.29Å; E194-I198 WeakPolarHBondContact O-CG1 3.5Å; E194-I198 PolarHBondContact O-N 3.4Å; I195-I198 PolarHBondContact O-N 3.09Å; I198-S200 VanDerWaalsContact C-N 3.29Å; I198-S200 PolarHBondContact O-N 3.44Å; I198-G201 PolarHBondContact O-N 3.34Å; I198-F202 VanDerWaalsContact CA-O 3.29Å; I198-F202 WeakPolarHBondContact CA-O 3.48Å; I198-I204 HydrophobicContact CD1-CB 4.42Å; I198-I204 HydrophobicContact CD1-CD1 4.5Å; I198-I204 HydrophobicContact CD1-CG1 4.36Å; I198-I204 HydrophobicContact CG1-CB 4.41Å; I198-I204 HydrophobicContact CG1-CD1 4.24Å; I198-I204 HydrophobicContact CG1-CG1 3.94Å; I198-Y207 HydrophobicContact CD1-CD1 3.64Å; I198-Y207 HydrophobicContact CD1-CE1 4.32Å; I198-Y207 HydrophobicContact CD1-CG 4.36Å; I198-L208 HydrophobicContact CD1-CD1 4.29Å; I198-L208 HydrophobicContact CD1-CG 4.28Å; I198-R262 PolarHBondContact O-NH1 3.35Å; I198-R262 PolarHBondContact O-NH2 3.49Å; I198-L265 HydrophobicContact CG2-CD1 4.26Å
199	L	87.8	Confident	87.3	Confident	8 Å²	8	20.4 Å²	20.4	4%	0.042	12%	0.116	C	C	.	.	H	α-helix	trans	-64.4	-30.2	-178.4	-68.5	173.4	0	0	0	113.4	I195 K196 G201 R262 L265 V291	I195-L199 HydrophobicContact CG2-CD1 3.96Å; I195-L199 HydrophobicContact CG2-CG 4.38Å; I195-L199 WeakPolarHBondContact O-CG 3.14Å; I195-L199 PolarHBondContact O-N 3.06Å; K196-L199 PolarHBondContact O-N 2.9Å; L199-G201 VanDerWaalsContact C-N 3.28Å; L199-G201 PolarHBondContact O-N 3.35Å; L199-R262 HydrophobicContact CD2-CB 3.87Å; L199-R262 HydrophobicContact CD2-CG 4.21Å; L199-R262 WeakPolarHBondContact CD2-O 3.11Å; L199-R262 PolarHBondContact O-NH1 2.81Å; L199-R262 VanDerWaalsContact O-NH1 3.08Å; L199-L265 HydrophobicContact CD2-CB 4.06Å; L199-V291 HydrophobicContact CD1-CB 4.42Å; L199-V291 HydrophobicContact CD1-CG1 3.26Å; L199-V291 WeakPolarHBondContact CD1-O 3.37Å
200	S	80.9	Confident	87.3	Confident	4 Å²	4	26.8 Å²	26.8	3%	0.028	14%	0.14	C	C	.	.	H	α-helix	trans	-62.8	-27.2	175.4	-178.9	0	0	0	0	114.5	K196 T197 I198 K748	K196-S200 WeakPolarHBondContact O-CB 3.12Å; K196-S200 PolarHBondContact O-N 2.67Å; T197-S200 PolarHBondContact O-N 3.13Å; I198-S200 VanDerWaalsContact C-N 3.29Å; I198-S200 PolarHBondContact O-N 3.44Å; S200-K748 PolarHBondContact O-NZ 2.99Å; S200-K748 PolarHBondContact OG-NZ 2.91Å
201	G	77.9	Confident	87.3	Confident	3 Å²	3	34.5 Å²	34.5	3%	0.031	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	150.7	-14.9	178.5	0	0	0	0	0	115.3	T41 I42 T197 I198 L199 R262	T41-G201 WeakPolarHBondContact CA-O 3.34Å; I42-G201 PolarHBondContact N-O 2.77Å; T197-G201 PolarHBondContact O-N 2.91Å; I198-G201 PolarHBondContact O-N 3.34Å; L199-G201 VanDerWaalsContact C-N 3.28Å; L199-G201 PolarHBondContact O-N 3.35Å; G201-R262 PolarHBondContact O-NH2 3.47Å
202	F	80.1	Confident	87.3	Confident	6 Å²	6	34.8 Å²	34.8	3%	0.026	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	153.3	-170.5	-60.8	-80.5	0	0	0	111.1	F39 T41 T197 I198 R262 P591 K748	F39-F202 HydrophobicContact CB-CD1 4.15Å; T41-F202 HydrophobicContact CG2-CD1 3.79Å; T41-F202 HydrophobicContact CG2-CE1 3.35Å; T41-F202 HydrophobicContact CG2-CZ 4.01Å; T197-F202 PolarHBondContact O-N 2.65Å; I198-F202 VanDerWaalsContact CA-O 3.29Å; I198-F202 WeakPolarHBondContact CA-O 3.48Å; F202-R262 PolarHBondContact O-NH2 3.39Å; F202-P591 HydrophobicContact CD1-CB 4.2Å; F202-P591 HydrophobicContact CD1-CG 3.57Å; F202-P591 HydrophobicContact CD2-CB 4.42Å; F202-P591 HydrophobicContact CD2-CG 4.18Å; F202-P591 WeakPolarHBondContact CD2-O 3.32Å; F202-P591 HydrophobicContact CE1-CB 3.57Å; F202-P591 HydrophobicContact CE1-CG 3.44Å; F202-P591 VanDerWaalsContact CE1-CG 3.44Å; F202-P591 HydrophobicContact CE2-CB 3.85Å; F202-P591 HydrophobicContact CE2-CG 4.09Å; F202-P591 WeakPolarHBondContact CE2-O 3.49Å; F202-P591 HydrophobicContact CG-CG 3.94Å; F202-P591 HydrophobicContact CZ-CB 3.39Å; F202-P591 HydrophobicContact CZ-CG 3.74Å; F202-P591 WeakPolarHBondContact CZ-O 3.5Å; F202-K748 HydrophobicContact CE1-CD 4.44Å; F202-K748 HydrophobicContact CE2-CD 4.05Å; F202-K748 VanDerWaalsContact CE2-CE 3.46Å; F202-K748 HydrophobicContact CZ-CD 3.53Å; F202-K748 VanDerWaalsContact CZ-CE 3.44Å; F202-K748 HydrophobicContact CZ-CG 4.22Å
203	I	79.4	Confident	87.4	Confident	37 Å²	37	35.8 Å²	35.8	19%	0.19	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	117.4	180	-60.1	173.6	0	0	0	107.5	H40 I42	H40-I203 PolarHBondContact O-N 3.26Å; I42-I203 HydrophobicContact CG2-CD1 3.82Å; I42-I203 HydrophobicContact CG2-CG1 4.28Å
204	I	83	Confident	87.6	Confident	21 Å²	21	39.8 Å²	39.8	11%	0.108	20%	0.196	C	C	.	.			trans	-102	110.9	172	-44.9	-172.4	0	0	0	107.5	F39 E194 I198 Y207	F39-I204 HydrophobicContact CD1-CG1 4.38Å; F39-I204 HydrophobicContact CE1-CD1 4.42Å; F39-I204 HydrophobicContact CE1-CG1 3.91Å; E194-I204 HydrophobicContact CB-CD1 4.22Å; E194-I204 HydrophobicContact CG-CD1 4.43Å; I198-I204 HydrophobicContact CD1-CB 4.42Å; I198-I204 HydrophobicContact CD1-CD1 4.5Å; I198-I204 HydrophobicContact CD1-CG1 4.36Å; I198-I204 HydrophobicContact CG1-CB 4.41Å; I198-I204 HydrophobicContact CG1-CD1 4.24Å; I198-I204 HydrophobicContact CG1-CG1 3.94Å; I204-Y207 HydrophobicContact CG2-CG 4.47Å
205	R	80.4	Confident	87.8	Confident	172 Å²	172	39.3 Å²	39.3	65%	0.649	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.5	143.3	-177.1	-64.7	-175.2	-176.5	179.4	6.7	110.3	H40 Y207	H40-R205 PolarHBondContact NE2-NH2 3.19Å; R205-Y207 PolarHBondContact O-N 3.28Å
206	G	81.8	Confident	88	Confident	50 Å²	50	39.1 Å²	39.1	52%	0.515	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.9	-19.2	177.9	0	0	0	0	0	115.8	L208 G209 T212	G206-L208 PolarHBondContact O-N 3.2Å; G206-G209 PolarHBondContact O-N 3.33Å; G206-G209 VanDerWaalsContact O-N 3.07Å; G206-T212 WeakPolarHBondContact O-CG2 3.45Å
207	Y	89.4	Confident	88.2	Confident	5 Å²	5	39.7 Å²	39.7	2%	0.02	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-50.3	-177.8	-169.8	-101.3	0	0	0	113.2	Y186 G191 E194 I195 I198 I204 R205 G209 T212 H238	Y186-Y207 AromaticContact CD1-CD2 3.94Å; Y186-Y207 HydrophobicContact CD1-CD2 3.94Å; Y186-Y207 HydrophobicContact CG-CD2 4.23Å; G191-Y207 WeakPolarHBondContact CA-OH 3.36Å; E194-Y207 HydrophobicContact CB-CD1 4.24Å; E194-Y207 HydrophobicContact CB-CD2 4.38Å; E194-Y207 HydrophobicContact CB-CE1 3.56Å; E194-Y207 HydrophobicContact CB-CE2 3.76Å; E194-Y207 WeakPolarHBondContact CB-OH 3.32Å; E194-Y207 HydrophobicContact CG-CD2 4.41Å; E194-Y207 HydrophobicContact CG-CE1 4.42Å; E194-Y207 HydrophobicContact CG-CE2 3.69Å; E194-Y207 PolarHBondContact OE2-OH 2.71Å; I195-Y207 HydrophobicContact CG1-CE1 4.4Å; I198-Y207 HydrophobicContact CD1-CD1 3.64Å; I198-Y207 HydrophobicContact CD1-CE1 4.32Å; I198-Y207 HydrophobicContact CD1-CG 4.36Å; I204-Y207 HydrophobicContact CG2-CG 4.47Å; R205-Y207 PolarHBondContact O-N 3.28Å; Y207-G209 PolarHBondContact O-N 3.19Å; Y207-T212 WeakPolarHBondContact O-CB 3.4Å; Y207-T212 PolarHBondContact O-OG1 3.46Å; Y207-H238 AromaticContact CD1-NE2 3.45Å; Y207-H238 WeakPolarHBondContact CD1-NE2 3.31Å; Y207-H238 AromaticContact CE1-CD2 3.49Å; Y207-H238 VanDerWaalsContact CE1-CD2 3.49Å; Y207-H238 WeakPolarHBondContact CE1-CD2 3.36Å; Y207-H238 AromaticContact CE1-CE1 3.5Å; Y207-H238 AromaticContact CE1-NE2 3Å; Y207-H238 WeakPolarHBondContact CE1-NE2 3.48Å; Y207-H238 AromaticContact CZ-CE1 3.42Å; Y207-H238 VanDerWaalsContact CZ-CE1 3.42Å; Y207-H238 AromaticContact CZ-ND1 3.99Å; Y207-H238 AromaticContact CZ-NE2 3.46Å; Y207-H238 PolarHBondContact OH-CE1 3.28Å
208	L	91.3	Very high	88.6	Confident	16 Å²	16	43 Å²	43	8%	0.084	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87	27.6	176.8	-59.2	173.3	0	0	0	113	I198 G206 C241 N245 L265	I198-L208 HydrophobicContact CD1-CD1 4.29Å; I198-L208 HydrophobicContact CD1-CG 4.28Å; G206-L208 PolarHBondContact O-N 3.2Å; L208-C241 HydrophobicContact CD2-CB 3.96Å; L208-N245 HydrophobicContact CB-CB 3.81Å; L208-N245 HydrophobicContact CD1-CB 4.28Å; L208-N245 PolarHBondContact O-ND2 3.32Å; L208-L265 HydrophobicContact CD1-CD1 3.68Å; L208-L265 HydrophobicContact CD1-CD2 3.89Å; L208-L265 HydrophobicContact CD1-CG 4.45Å
209	G	90.5	Very high	89	Confident	23 Å²	23	42.4 Å²	42.4	24%	0.237	21%	0.214	C	C	.	.			trans	-71.7	162.7	-176.2	0	0	0	0	0	114.2	G206 Y207 W211 T212 L213	G206-G209 PolarHBondContact O-N 3.33Å; G206-G209 VanDerWaalsContact O-N 3.07Å; Y207-G209 PolarHBondContact O-N 3.19Å; G209-W211 VanDerWaalsContact C-N 3.31Å; G209-W211 PolarHBondContact O-N 3.33Å; G209-T212 PolarHBondContact N-OG1 3.25Å; G209-T212 VanDerWaalsContact N-OG1 3.12Å; G209-T212 PolarHBondContact O-N 2.89Å; G209-T212 PolarHBondContact O-OG1 3.08Å; G209-L213 PolarHBondContact O-N 2.62Å; G209-L213 VanDerWaalsContact O-N 3.13Å
210	K	91.8	Very high	89.4	Confident	152 Å²	152	42 Å²	42	66%	0.661	21%	0.212	S	C	*	.	H	α-helix	trans	-66.5	-32.5	173.4	62.8	178.7	-178	175	0	113.1	L213 L214	K210-L213 WeakPolarHBondContact O-CB 2.77Å; K210-L214 PolarHBondContact O-N 3.02Å; K210-L214 VanDerWaalsContact O-N 3.17Å
211	W	91.1	Very high	90.1	Very high	165 Å²	165	42.4 Å²	42.4	63%	0.625	21%	0.214	S	C	*	.	H	α-helix	trans	-71.7	-38.7	176.9	-73	118.8	0	0	0	111.8	G209 L213 L214 I215	G209-W211 VanDerWaalsContact C-N 3.31Å; G209-W211 PolarHBondContact O-N 3.33Å; W211-L213 VanDerWaalsContact C-N 3.33Å; W211-L214 PolarHBondContact O-N 3.36Å; W211-I215 WeakPolarHBondContact O-CB 3.05Å; W211-I215 WeakPolarHBondContact O-CG1 3.35Å; W211-I215 PolarHBondContact O-N 2.77Å
212	T	93.6	Very high	91	Very high	7 Å²	7	43 Å²	43	4%	0.043	22%	0.217	C	C	.	.	H	α-helix	trans	-66.1	-38.4	175	59.6	0	0	0	0	110.9	A184 G206 Y207 G209 K216	A184-T212 HydrophobicContact CB-CG2 4.36Å; G206-T212 WeakPolarHBondContact O-CG2 3.45Å; Y207-T212 WeakPolarHBondContact O-CB 3.4Å; Y207-T212 PolarHBondContact O-OG1 3.46Å; G209-T212 PolarHBondContact N-OG1 3.25Å; G209-T212 VanDerWaalsContact N-OG1 3.12Å; G209-T212 PolarHBondContact O-N 2.89Å; G209-T212 PolarHBondContact O-OG1 3.08Å; T212-K216 WeakPolarHBondContact O-CB 3.46Å; T212-K216 PolarHBondContact O-N 3.23Å
213	L	95.3	Very high	91.7	Very high	22 Å²	22	42.8 Å²	42.8	12%	0.115	22%	0.216	C	C	.	.	H	α-helix	trans	-54.5	-57	171	177.8	61.7	0	0	0	111.6	L93 G209 K210 W211 K216 T217 V239 C242	L93-L213 HydrophobicContact CD1-CD1 4.2Å; G209-L213 PolarHBondContact O-N 2.62Å; G209-L213 VanDerWaalsContact O-N 3.13Å; K210-L213 WeakPolarHBondContact O-CB 2.77Å; W211-L213 VanDerWaalsContact C-N 3.33Å; L213-K216 PolarHBondContact O-N 2.83Å; L213-T217 HydrophobicContact CD1-CG2 4.26Å; L213-T217 WeakPolarHBondContact O-CG2 3.33Å; L213-T217 PolarHBondContact O-N 2.88Å; L213-T217 PolarHBondContact O-OG1 3.02Å; L213-V239 HydrophobicContact CD1-CB 4.38Å; L213-V239 HydrophobicContact CD1-CG1 3.71Å; L213-C242 HydrophobicContact CB-CB 3.9Å; L213-C242 HydrophobicContact CD1-CB 3.88Å; L213-C242 HydrophobicContact CG-CB 4.33Å
214	L	95.3	Very high	92.5	Very high	92 Å²	92	42.3 Å²	42.3	48%	0.482	21%	0.214	S	C	.	.	H	α-helix	trans	-64.5	-44.9	-175	-175.6	151.4	0	0	0	112.7	K210 W211 T217 V218	K210-L214 PolarHBondContact O-N 3.02Å; K210-L214 VanDerWaalsContact O-N 3.17Å; W211-L214 PolarHBondContact O-N 3.36Å; L214-T217 PolarHBondContact O-OG1 3.36Å; L214-V218 PolarHBondContact O-N 3.13Å
215	I	95.4	Very high	93	Very high	13 Å²	13	41.3 Å²	41.3	7%	0.067	21%	0.209	C	C	.	.	H	α-helix	trans	-70.6	-40	-179.4	-62.5	-63.3	0	0	0	110.5	F183 A184 A187 W211 T217 V218 T219	F183-I215 HydrophobicContact CB-CD1 3.62Å; F183-I215 HydrophobicContact CB-CG1 3.76Å; F183-I215 HydrophobicContact CD2-CD1 4.25Å; F183-I215 HydrophobicContact CG-CD1 4.03Å; A184-I215 HydrophobicContact CB-CB 3.76Å; A184-I215 HydrophobicContact CB-CG1 3.9Å; A184-I215 HydrophobicContact CB-CG2 3.9Å; A187-I215 HydrophobicContact CB-CG2 4.42Å; W211-I215 WeakPolarHBondContact O-CB 3.05Å; W211-I215 WeakPolarHBondContact O-CG1 3.35Å; W211-I215 PolarHBondContact O-N 2.77Å; I215-T217 PolarHBondContact O-N 3.02Å; I215-V218 PolarHBondContact O-N 2.79Å; I215-T219 HydrophobicContact CG2-CG2 3.91Å; I215-T219 VanDerWaalsContact O-CB 3.32Å; I215-T219 WeakPolarHBondContact O-CB 3.41Å; I215-T219 VanDerWaalsContact O-CG2 3.27Å; I215-T219 WeakPolarHBondContact O-CG2 3.07Å; I215-T219 PolarHBondContact O-N 3.05Å; I215-T219 PolarHBondContact O-OG1 2.89Å
216	K	96.5	Very high	93.7	Very high	1 Å²	1	33.2 Å²	33.2	0%	0.004	18%	0.179	C	C	.	.	H	α-helix	trans	-66.5	-37.6	-179.7	-166	164.3	-172.8	142.9	0	111.8	A187 G189 S190 T212 L213 L220 H238 V239 P474	A187-K216 HydrophobicContact CB-CB 3.92Å; A187-K216 HydrophobicContact CB-CD 4.48Å; A187-K216 HydrophobicContact CB-CG 4.29Å; A187-K216 WeakPolarHBondContact O-CE 3.45Å; A187-K216 PolarHBondContact O-NZ 3.45Å; G189-K216 PolarHBondContact O-NZ 3.08Å; S190-K216 PolarHBondContact O-NZ 2.78Å; T212-K216 WeakPolarHBondContact O-CB 3.46Å; T212-K216 PolarHBondContact O-N 3.23Å; L213-K216 PolarHBondContact O-N 2.83Å; K216-L220 WeakPolarHBondContact O-CB 3.43Å; K216-L220 PolarHBondContact O-N 3.14Å; K216-H238 HydrophobicContact CD-CB 4.46Å; K216-H238 WeakPolarHBondContact CD-ND1 3.27Å; K216-H238 PolarHBondContact NZ-ND1 2.85Å; K216-V239 HydrophobicContact CG-CG2 4.47Å; K216-P474 HydrophobicContact CG-CB 4.38Å; K216-P474 HydrophobicContact CG-CG 4.49Å
217	T	95.7	Very high	94.1	Very high	22 Å²	22	32 Å²	32	14%	0.135	17%	0.166	C	C	.	.	H	α-helix	trans	-63.2	-47.5	176.1	53.4	0	0	0	0	111.8	I97 L213 L214 I215 V221 V239	I97-T217 HydrophobicContact CD1-CG2 4.23Å; L213-T217 HydrophobicContact CD1-CG2 4.26Å; L213-T217 WeakPolarHBondContact O-CG2 3.33Å; L213-T217 PolarHBondContact O-N 2.88Å; L213-T217 PolarHBondContact O-OG1 3.02Å; L214-T217 PolarHBondContact O-OG1 3.36Å; I215-T217 PolarHBondContact O-N 3.02Å; T217-V221 WeakPolarHBondContact O-CG2 3.38Å; T217-V221 PolarHBondContact O-N 3.23Å; T217-V239 HydrophobicContact CG2-CG1 3.85Å; T217-V239 HydrophobicContact CG2-CG2 4.03Å
218	V	96.3	Very high	94.3	Very high	72 Å²	72	32 Å²	32	44%	0.436	17%	0.167	S	C	.	.	H	α-helix	trans	-66.5	-46.6	179.3	175.7	0	0	0	0	111.8	L179 L214 I215 L220 V221 L222	L179-V218 HydrophobicContact CD1-CG1 4.16Å; L214-V218 PolarHBondContact O-N 3.13Å; I215-V218 PolarHBondContact O-N 2.79Å; V218-L220 VanDerWaalsContact C-N 3.31Å; V218-L220 PolarHBondContact O-N 3.28Å; V218-V221 PolarHBondContact O-N 2.86Å; V218-L222 HydrophobicContact CG1-CD1 4.24Å; V218-L222 PolarHBondContact O-N 2.97Å
219	T	95.8	Very high	94.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-73.2	-24.2	-176.5	55.2	0	0	0	0	112.8	L179 V180 I215 A223 P474	L179-T219 HydrophobicContact CB-CG2 3.5Å; L179-T219 HydrophobicContact CD1-CG2 3.97Å; L179-T219 HydrophobicContact CG-CG2 4.4Å; V180-T219 HydrophobicContact CG2-CG2 3.76Å; I215-T219 HydrophobicContact CG2-CG2 3.91Å; I215-T219 VanDerWaalsContact O-CB 3.32Å; I215-T219 WeakPolarHBondContact O-CB 3.41Å; I215-T219 VanDerWaalsContact O-CG2 3.27Å; I215-T219 WeakPolarHBondContact O-CG2 3.07Å; I215-T219 PolarHBondContact O-N 3.05Å; I215-T219 PolarHBondContact O-OG1 2.89Å; T219-A223 WeakPolarHBondContact O-CB 3.33Å; T219-A223 PolarHBondContact O-N 3.36Å; T219-P474 VanDerWaalsContact OG1-CG 3.23Å; T219-P474 WeakPolarHBondContact OG1-CG 3.34Å
220	L	95.6	Very high	94.5	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-64.5	-45.3	171.9	-176.1	61.6	0	0	0	111.7	I97 K216 V218 A223 V224 K232 P235 P474	I97-L220 HydrophobicContact CD1-CD2 4.35Å; I97-L220 HydrophobicContact CG2-CD2 4.3Å; K216-L220 WeakPolarHBondContact O-CB 3.43Å; K216-L220 PolarHBondContact O-N 3.14Å; V218-L220 VanDerWaalsContact C-N 3.31Å; V218-L220 PolarHBondContact O-N 3.28Å; L220-A223 PolarHBondContact O-N 3.29Å; L220-V224 HydrophobicContact CD1-CG2 4.29Å; L220-V224 WeakPolarHBondContact O-CG2 3.33Å; L220-V224 PolarHBondContact O-N 3.39Å; L220-K232 HydrophobicContact CD1-CB 4.32Å; L220-K232 HydrophobicContact CD2-CB 4.02Å; L220-K232 HydrophobicContact CG-CB 4.17Å; L220-P235 HydrophobicContact CD1-CB 3.54Å; L220-P235 HydrophobicContact CD1-CG 3.61Å; L220-P235 HydrophobicContact CD2-CB 3.74Å; L220-P235 HydrophobicContact CG-CB 4.24Å; L220-P474 HydrophobicContact CD1-CB 4.07Å
221	V	96.3	Very high	94.5	Very high	12 Å²	12	23.5 Å²	23.5	7%	0.073	12%	0.124	C	C	.	.	H	α-helix	trans	-58	-53.2	176.3	178.3	0	0	0	0	109.5	I97 A100 V101 M104 T217 V218 A223 V224 S225	I97-V221 HydrophobicContact CB-CG2 4.5Å; I97-V221 HydrophobicContact CG1-CG2 4.35Å; I97-V221 HydrophobicContact CG2-CG2 4.25Å; A100-V221 HydrophobicContact CB-CG1 3.77Å; A100-V221 HydrophobicContact CB-CG2 4.03Å; V101-V221 HydrophobicContact CG2-CB 4.23Å; V101-V221 HydrophobicContact CG2-CG1 4.06Å; V101-V221 HydrophobicContact CG2-CG2 4.19Å; M104-V221 HydrophobicContact CG-CG1 4.29Å; M104-V221 HydrophobicContact SD-CG1 3.47Å; M104-V221 WeakPolarHBondContact SD-CG1 3.19Å; T217-V221 WeakPolarHBondContact O-CG2 3.38Å; T217-V221 PolarHBondContact O-N 3.23Å; V218-V221 PolarHBondContact O-N 2.86Å; V221-A223 VanDerWaalsContact C-N 3.34Å; V221-A223 PolarHBondContact O-N 2.88Å; V221-V224 PolarHBondContact O-N 3.29Å; V221-S225 WeakPolarHBondContact O-CB 3.42Å; V221-S225 PolarHBondContact O-N 2.9Å; V221-S225 PolarHBondContact O-OG 3.1Å
222	L	96.4	Very high	94.6	Very high	15 Å²	15	16.4 Å²	16.4	8%	0.079	10%	0.098	C	C	.	.	H	α-helix	trans	-58.9	-42.1	178.8	-67	168	0	0	0	113.2	M104 F172 L175 A176 L179 V218 S226	M104-L222 HydrophobicContact CE-CD2 3.43Å; M104-L222 VanDerWaalsContact CE-CD2 3.43Å; M104-L222 HydrophobicContact SD-CD2 4.41Å; F172-L222 HydrophobicContact CB-CD2 4.44Å; F172-L222 HydrophobicContact CD1-CD2 3.99Å; F172-L222 HydrophobicContact CG-CD2 4.48Å; L175-L222 HydrophobicContact CB-CD1 4.07Å; A176-L222 HydrophobicContact CB-CB 3.81Å; L179-L222 HydrophobicContact CD1-CD1 3.98Å; V218-L222 HydrophobicContact CG1-CD1 4.24Å; V218-L222 PolarHBondContact O-N 2.97Å; L222-S226 WeakPolarHBondContact O-CB 3.49Å; L222-S226 PolarHBondContact O-N 3.03Å
223	A	95.6	Very high	94.5	Very high	1 Å²	1	16.4 Å²	16.4	1%	0.008	10%	0.097	C	C	.	.	H	α-helix	trans	-66.4	-43.1	-178.5	0	0	0	0	0	112.1	T219 L220 V221 S226	T219-A223 WeakPolarHBondContact O-CB 3.33Å; T219-A223 PolarHBondContact O-N 3.36Å; L220-A223 PolarHBondContact O-N 3.29Å; V221-A223 VanDerWaalsContact C-N 3.34Å; V221-A223 PolarHBondContact O-N 2.88Å; A223-S226 PolarHBondContact O-OG 3.32Å
224	V	94.8	Very high	94.4	Very high	27 Å²	27	15.3 Å²	15.3	16%	0.164	9%	0.092	C	C	.	.	H	α-helix	trans	-70.7	-45	177.5	177.4	0	0	0	0	110.7	V101 L220 V221 S226 G227 K232	V101-V224 HydrophobicContact CG1-CB 4.29Å; V101-V224 HydrophobicContact CG1-CG1 3.65Å; V101-V224 HydrophobicContact CG2-CB 4.32Å; V101-V224 HydrophobicContact CG2-CG1 4.48Å; L220-V224 HydrophobicContact CD1-CG2 4.29Å; L220-V224 WeakPolarHBondContact O-CG2 3.33Å; L220-V224 PolarHBondContact O-N 3.39Å; V221-V224 PolarHBondContact O-N 3.29Å; V224-S226 PolarHBondContact O-N 3.11Å; V224-G227 PolarHBondContact O-N 3.22Å; V224-G227 VanDerWaalsContact O-N 3.09Å; V224-K232 HydrophobicContact CG2-CB 4.21Å
225	S	94.6	Very high	94.4	Very high	0 Å²	0	11 Å²	11	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-64.3	-24.1	179.6	-58.2	0	0	0	0	113.3	V101 M104 T105 K108 V221 G227	V101-S225 PolarHBondContact O-OG 3.09Å; M104-S225 VanDerWaalsContact CB-OG 3.27Å; M104-S225 WeakPolarHBondContact CB-OG 3.4Å; T105-S225 PolarHBondContact OG1-OG 2.83Å; K108-S225 VanDerWaalsContact CD-O 3.27Å; K108-S225 WeakPolarHBondContact CD-O 3.41Å; K108-S225 WeakPolarHBondContact CE-O 3.19Å; K108-S225 PolarHBondContact NZ-O 2.95Å; V221-S225 WeakPolarHBondContact O-CB 3.42Å; V221-S225 PolarHBondContact O-N 2.9Å; V221-S225 PolarHBondContact O-OG 3.1Å; S225-G227 PolarHBondContact O-N 3.15Å
226	S	94.8	Very high	94.4	Very high	2 Å²	2	10.6 Å²	10.6	1%	0.014	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-14.3	173.2	75.6	0	0	0	0	114.5	A169 L222 A223 V224 L228	A169-S226 WeakPolarHBondContact CB-O 3.37Å; L222-S226 WeakPolarHBondContact O-CB 3.49Å; L222-S226 PolarHBondContact O-N 3.03Å; A223-S226 PolarHBondContact O-OG 3.32Å; V224-S226 PolarHBondContact O-N 3.11Å; S226-L228 VanDerWaalsContact C-N 3.29Å; S226-L228 WeakPolarHBondContact OG-CD1 3.33Å; S226-L228 WeakPolarHBondContact OG-CG 3.46Å
227	G	91.3	Very high	94.3	Very high	24 Å²	24	10.6 Å²	10.6	25%	0.247	7%	0.067	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.5	7.3	-179.5	0	0	0	0	0	114.3	V224 S225	V224-G227 PolarHBondContact O-N 3.22Å; V224-G227 VanDerWaalsContact O-N 3.09Å; S225-G227 PolarHBondContact O-N 3.15Å
228	L	92.8	Very high	94.4	Very high	5 Å²	5	9.5 Å²	9.5	3%	0.026	6%	0.06	C	C	.	.			trans	-58.6	148.3	166.8	-72.5	171	0	0	0	110.4	S226 L230 V385 T468 M471 I473	S226-L228 VanDerWaalsContact C-N 3.29Å; S226-L228 WeakPolarHBondContact OG-CD1 3.33Å; S226-L228 WeakPolarHBondContact OG-CG 3.46Å; L228-L230 HydrophobicContact CB-CD1 3.67Å; L228-L230 HydrophobicContact CB-CG 3.84Å; L228-L230 HydrophobicContact CD1-CD1 3.95Å; L228-L230 HydrophobicContact CG-CD1 4.48Å; L228-L230 PolarHBondContact O-N 3.16Å; L228-V385 HydrophobicContact CD2-CG1 4.11Å; L228-T468 HydrophobicContact CD2-CG2 4.08Å; L228-M471 HydrophobicContact CD1-CE 4.49Å; L228-I473 HydrophobicContact CD1-CD1 3.4Å
229	S	93.1	Very high	94.4	Very high	3 Å²	3	6.2 Å²	6.2	2%	0.021	4%	0.041	C	C	.	.	S	Bend	trans	-75.6	74.5	178.2	-162.9	0	0	0	0	110.9	T465 T468 P480	S229-T465 WeakPolarHBondContact OG-CG2 3.36Å; S229-T468 PolarHBondContact O-OG1 2.95Å; S229-P480 WeakPolarHBondContact O-CG 3.46Å
230	L	93	Very high	94.5	Very high	7 Å²	7	6.3 Å²	6.3	4%	0.037	4%	0.041	C	C	.	.			trans	-138.3	158.7	-174.1	-59.3	175.8	0	0	0	109.8	L228 I473	L228-L230 HydrophobicContact CB-CD1 3.67Å; L228-L230 HydrophobicContact CB-CG 3.84Å; L228-L230 HydrophobicContact CD1-CD1 3.95Å; L228-L230 HydrophobicContact CG-CD1 4.48Å; L228-L230 PolarHBondContact O-N 3.16Å; L230-I473 HydrophobicContact CD1-CD1 3.57Å; L230-I473 HydrophobicContact CD1-CG1 4.34Å
231	G	91.9	Very high	94.5	Very high	3 Å²	3	6.4 Å²	6.4	3%	0.031	4%	0.042	C	C	.	.	B	Isolated β-bridge	trans	-123.2	158	173.6	0	0	0	0	0	113.5	G476	G231-G476 PolarHBondContact N-O 3.26Å; G231-G476 WeakPolarHBondContact O-CA 3.21Å; G231-G476 PolarHBondContact O-N 3.19Å
232	K	93.2	Very high	94.5	Very high	16 Å²	16	6 Å²	6	7%	0.07	4%	0.039	C	C	.	.	S	Bend	trans	-81.3	-23.9	174.5	60.5	-172.1	175.5	-179.8	0	114.2	I97 D98 L220 V224 G234 P235 L236	I97-K232 HydrophobicContact CG2-CD 4.26Å; D98-K232 VanDerWaalsContact CG-NZ 3.26Å; D98-K232 VanDerWaalsContact OD1-CE 3.31Å; D98-K232 WeakPolarHBondContact OD1-CE 3.44Å; D98-K232 IonicContact OD1-NZ 3.15Å; D98-K232 PolarHBondContact OD1-NZ 3.48Å; D98-K232 IonicContact OD2-NZ 3.87Å; L220-K232 HydrophobicContact CD1-CB 4.32Å; L220-K232 HydrophobicContact CD2-CB 4.02Å; L220-K232 HydrophobicContact CG-CB 4.17Å; V224-K232 HydrophobicContact CG2-CB 4.21Å; K232-G234 PolarHBondContact O-N 2.91Å; K232-P235 VanDerWaalsContact O-CD 3.29Å; K232-P235 WeakPolarHBondContact O-CD 3.13Å; K232-L236 HydrophobicContact CG-CD1 4.24Å; K232-L236 WeakPolarHBondContact O-CG 3.41Å; K232-L236 PolarHBondContact O-N 2.86Å
233	E	91.6	Very high	94.5	Very high	7 Å²	7	5.2 Å²	5.2	3%	0.033	4%	0.035	C	C	.	.	H	α-helix	trans	-61	-42.1	-168.3	-46.7	-43.5	151.4	0	0	114.8	L236 A276 F277 F478 I479	E233-L236 PolarHBondContact O-N 3.22Å; E233-L236 WeakPolarHBondContact OE2-CD1 3.08Å; E233-A276 HydrophobicContact CB-CB 3.89Å; E233-A276 VanDerWaalsContact CD-O 3.31Å; E233-A276 HydrophobicContact CG-CB 4.34Å; E233-A276 VanDerWaalsContact OE2-C 3.29Å; E233-A276 WeakPolarHBondContact OE2-CA 3.37Å; E233-A276 WeakPolarHBondContact OE2-CB 3.34Å; E233-F277 HydrophobicContact CB-CE2 4.21Å; E233-F277 HydrophobicContact CB-CZ 4.05Å; E233-F277 HydrophobicContact CG-CE1 4.22Å; E233-F277 HydrophobicContact CG-CZ 4.23Å; E233-F478 HydrophobicContact CB-CB 4.47Å; E233-F478 HydrophobicContact CB-CD2 4.06Å; E233-I479 HydrophobicContact CG-CD1 3.78Å; E233-I479 HydrophobicContact CG-CG1 3.62Å
234	G	91.8	Very high	94.5	Very high	0 Å²	0	5.2 Å²	5.2	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-64.2	-54.6	176.8	0	0	0	0	0	112.4	S190 K232 L236 V237	S190-G234 WeakPolarHBondContact OG-CA 3.3Å; K232-G234 PolarHBondContact O-N 2.91Å; G234-L236 VanDerWaalsContact C-N 3.27Å; G234-L236 PolarHBondContact O-N 3.05Å; G234-V237 WeakPolarHBondContact O-CB 3.48Å; G234-V237 PolarHBondContact O-N 3.32Å; G234-V237 VanDerWaalsContact O-N 3.16Å
235	P	95.6	Very high	94.5	Very high	0 Å²	0	5.2 Å²	5.2	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-55	-32.7	173	-33.2	39.4	0	0	0	115.6	S190 L220 K232 V237 H238 V239	S190-P235 WeakPolarHBondContact O-CA 2.87Å; L220-P235 HydrophobicContact CD1-CB 3.54Å; L220-P235 HydrophobicContact CD1-CG 3.61Å; L220-P235 HydrophobicContact CD2-CB 3.74Å; L220-P235 HydrophobicContact CG-CB 4.24Å; K232-P235 VanDerWaalsContact O-CD 3.29Å; K232-P235 WeakPolarHBondContact O-CD 3.13Å; P235-V237 VanDerWaalsContact C-N 3.26Å; P235-V237 PolarHBondContact O-N 2.94Å; P235-H238 WeakPolarHBondContact O-CA 3.47Å; P235-H238 WeakPolarHBondContact O-CB 3.42Å; P235-H238 PolarHBondContact O-N 3.44Å; P235-V239 WeakPolarHBondContact O-CG2 3.26Å; P235-V239 PolarHBondContact O-N 3.43Å
236	L	95.3	Very high	94.5	Very high	5 Å²	5	8.5 Å²	8.5	3%	0.026	5%	0.051	C	C	.	.	H	α-helix	trans	-60.9	-34	176	-78.2	173.9	0	0	0	112.6	A94 I97 K232 E233 G234 H238 V239 A240 A276	A94-L236 HydrophobicContact CB-CD2 4.27Å; I97-L236 HydrophobicContact CD1-CD2 3.55Å; K232-L236 HydrophobicContact CG-CD1 4.24Å; K232-L236 WeakPolarHBondContact O-CG 3.41Å; K232-L236 PolarHBondContact O-N 2.86Å; E233-L236 PolarHBondContact O-N 3.22Å; E233-L236 WeakPolarHBondContact OE2-CD1 3.08Å; G234-L236 VanDerWaalsContact C-N 3.27Å; G234-L236 PolarHBondContact O-N 3.05Å; L236-H238 VanDerWaalsContact C-N 3.3Å; L236-H238 PolarHBondContact O-N 3.49Å; L236-V239 PolarHBondContact O-N 3.12Å; L236-A240 WeakPolarHBondContact O-CB 3.2Å; L236-A240 PolarHBondContact O-N 3.12Å; L236-A276 HydrophobicContact CB-CB 4.44Å; L236-A276 HydrophobicContact CD1-CB 4.1Å
237	V	96.2	Very high	94.5	Very high	1 Å²	1	9.7 Å²	9.7	1%	0.006	6%	0.056	C	C	.	.	H	α-helix	trans	-59.5	-43.6	172	-172.2	0	0	0	0	110.8	I192 I195 G234 P235 A240 C241 A269 V273	I192-V237 HydrophobicContact CD1-CG2 4.42Å; I192-V237 HydrophobicContact CG1-CB 4.36Å; I195-V237 HydrophobicContact CD1-CG1 4.3Å; G234-V237 WeakPolarHBondContact O-CB 3.48Å; G234-V237 PolarHBondContact O-N 3.32Å; G234-V237 VanDerWaalsContact O-N 3.16Å; P235-V237 VanDerWaalsContact C-N 3.26Å; P235-V237 PolarHBondContact O-N 2.94Å; V237-A240 PolarHBondContact O-N 3.34Å; V237-C241 PolarHBondContact O-N 3.42Å; V237-C241 PolarHBondContact O-SG 2.95Å; V237-C241 VanDerWaalsContact O-SG 3.41Å; V237-A269 HydrophobicContact CG1-CB 3.81Å; V237-V273 HydrophobicContact CG1-CG2 4.46Å; V237-V273 HydrophobicContact CG2-CG2 3.5Å; V237-V273 VanDerWaalsContact CG2-CG2 3.5Å
238	H	96.3	Very high	94.6	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-68.3	-43	177.5	-175.5	-146.3	0	0	0	112.6	I195 Y207 K216 P235 L236 A240 C241 C242	I195-H238 HydrophobicContact CD1-CB 3.88Å; Y207-H238 AromaticContact CD1-NE2 3.45Å; Y207-H238 WeakPolarHBondContact CD1-NE2 3.31Å; Y207-H238 AromaticContact CE1-CD2 3.49Å; Y207-H238 VanDerWaalsContact CE1-CD2 3.49Å; Y207-H238 WeakPolarHBondContact CE1-CD2 3.36Å; Y207-H238 AromaticContact CE1-CE1 3.5Å; Y207-H238 AromaticContact CE1-NE2 3Å; Y207-H238 WeakPolarHBondContact CE1-NE2 3.48Å; Y207-H238 AromaticContact CZ-CE1 3.42Å; Y207-H238 VanDerWaalsContact CZ-CE1 3.42Å; Y207-H238 AromaticContact CZ-ND1 3.99Å; Y207-H238 AromaticContact CZ-NE2 3.46Å; Y207-H238 PolarHBondContact OH-CE1 3.28Å; K216-H238 HydrophobicContact CD-CB 4.46Å; K216-H238 WeakPolarHBondContact CD-ND1 3.27Å; K216-H238 PolarHBondContact NZ-ND1 2.85Å; P235-H238 WeakPolarHBondContact O-CA 3.47Å; P235-H238 WeakPolarHBondContact O-CB 3.42Å; P235-H238 PolarHBondContact O-N 3.44Å; L236-H238 VanDerWaalsContact C-N 3.3Å; L236-H238 PolarHBondContact O-N 3.49Å; H238-A240 VanDerWaalsContact C-N 3.3Å; H238-A240 PolarHBondContact O-N 3.18Å; H238-C241 PolarHBondContact O-N 2.97Å; H238-C242 PolarHBondContact NE2-SG 2.56Å; H238-C242 VanDerWaalsContact NE2-SG 3.42Å; H238-C242 PolarHBondContact O-N 3.35Å; H238-C242 PolarHBondContact O-SG 2.93Å; H238-C242 VanDerWaalsContact O-SG 3.41Å
239	V	96.9	Very high	94.4	Very high	3 Å²	3	11.6 Å²	11.6	2%	0.018	7%	0.066	C	C	.	.	H	α-helix	trans	-55.7	-47	174.7	169	0	0	0	0	110.4	L93 L213 K216 T217 P235 L236 C241 C242 C243	L93-V239 HydrophobicContact CD1-CG1 4.11Å; L213-V239 HydrophobicContact CD1-CB 4.38Å; L213-V239 HydrophobicContact CD1-CG1 3.71Å; K216-V239 HydrophobicContact CG-CG2 4.47Å; T217-V239 HydrophobicContact CG2-CG1 3.85Å; T217-V239 HydrophobicContact CG2-CG2 4.03Å; P235-V239 WeakPolarHBondContact O-CG2 3.26Å; P235-V239 PolarHBondContact O-N 3.43Å; L236-V239 PolarHBondContact O-N 3.12Å; V239-C241 PolarHBondContact O-N 3.01Å; V239-C242 WeakPolarHBondContact O-CB 3.37Å; V239-C242 PolarHBondContact O-N 2.83Å; V239-C243 PolarHBondContact O-N 3.25Å; V239-C243 PolarHBondContact O-SG 3.47Å
240	A	97.1	Very high	94.2	Very high	2 Å²	2	17.2 Å²	17.2	2%	0.017	10%	0.095	C	C	.	.	H	α-helix	trans	-63	-42.3	177	0	0	0	0	0	112.5	L236 V237 H238 C242 C243 G244 A268 G272	L236-A240 WeakPolarHBondContact O-CB 3.2Å; L236-A240 PolarHBondContact O-N 3.12Å; V237-A240 PolarHBondContact O-N 3.34Å; H238-A240 VanDerWaalsContact C-N 3.3Å; H238-A240 PolarHBondContact O-N 3.18Å; A240-C242 VanDerWaalsContact C-N 3.32Å; A240-C242 PolarHBondContact O-N 2.87Å; A240-C243 WeakPolarHBondContact O-CB 3.26Å; A240-C243 PolarHBondContact O-N 3Å; A240-G244 PolarHBondContact O-N 3.44Å; A240-A268 WeakPolarHBondContact CB-O 3.49Å; A240-A268 WeakPolarHBondContact O-CB 3.42Å; A240-G272 VanDerWaalsContact CB-CA 3.49Å
241	C	96.7	Very high	94	Very high	1 Å²	1	19.6 Å²	19.6	1%	0.007	11%	0.106	C	C	.	.	H	α-helix	trans	-61.9	-36.6	173.8	-72.2	0	0	0	0	112.9	I195 L208 V237 H238 V239 G244 N245 L265	I195-C241 HydrophobicContact CD1-CB 4.2Å; I195-C241 HydrophobicContact CG1-CB 4.49Å; L208-C241 HydrophobicContact CD2-CB 3.96Å; V237-C241 PolarHBondContact O-N 3.42Å; V237-C241 PolarHBondContact O-SG 2.95Å; V237-C241 VanDerWaalsContact O-SG 3.41Å; H238-C241 PolarHBondContact O-N 2.97Å; V239-C241 PolarHBondContact O-N 3.01Å; C241-G244 WeakPolarHBondContact O-CA 3.25Å; C241-G244 PolarHBondContact O-N 2.85Å; C241-N245 PolarHBondContact O-N 3.21Å; C241-L265 HydrophobicContact CB-CD2 4.37Å; C241-L265 VanDerWaalsContact O-CD2 3.31Å; C241-L265 WeakPolarHBondContact O-CD2 3.43Å; C241-L265 PolarHBondContact SG-O 2.69Å; C241-L265 VanDerWaalsContact SG-O 3.42Å
242	C	96.1	Very high	93.7	Very high	3 Å²	3	22.7 Å²	22.7	2%	0.02	13%	0.127	C	C	.	.	H	α-helix	trans	-64.3	-41.6	172.8	-71.8	0	0	0	0	111.8	L213 H238 V239 A240 G244 N245 L246	L213-C242 HydrophobicContact CB-CB 3.9Å; L213-C242 HydrophobicContact CD1-CB 3.88Å; L213-C242 HydrophobicContact CG-CB 4.33Å; H238-C242 PolarHBondContact NE2-SG 2.56Å; H238-C242 VanDerWaalsContact NE2-SG 3.42Å; H238-C242 PolarHBondContact O-N 3.35Å; H238-C242 PolarHBondContact O-SG 2.93Å; H238-C242 VanDerWaalsContact O-SG 3.41Å; V239-C242 WeakPolarHBondContact O-CB 3.37Å; V239-C242 PolarHBondContact O-N 2.83Å; A240-C242 VanDerWaalsContact C-N 3.32Å; A240-C242 PolarHBondContact O-N 2.87Å; C242-G244 VanDerWaalsContact C-N 3.31Å; C242-G244 PolarHBondContact O-N 3.46Å; C242-N245 PolarHBondContact O-N 3.44Å; C242-L246 PolarHBondContact O-N 2.68Å
243	C	96.2	Very high	93.4	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-59	-42.9	170.3	-63.4	0	0	0	0	111.4	L89 L93 V239 A240 N245 L246 F247	L89-C243 HydrophobicContact CD2-CB 3.92Å; L89-C243 HydrophobicContact CG-CB 4.36Å; L93-C243 WeakPolarHBondContact CD1-SG 3.44Å; V239-C243 PolarHBondContact O-N 3.25Å; V239-C243 PolarHBondContact O-SG 3.47Å; A240-C243 WeakPolarHBondContact O-CB 3.26Å; A240-C243 PolarHBondContact O-N 3Å; C243-N245 PolarHBondContact O-N 2.98Å; C243-L246 WeakPolarHBondContact O-CB 3.13Å; C243-L246 PolarHBondContact O-N 3.43Å; C243-F247 WeakPolarHBondContact O-CD2 3.1Å; C243-F247 PolarHBondContact O-N 3.45Å; C243-F247 VanDerWaalsContact O-N 3.08Å
244	G	95.4	Very high	93.2	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-57	-46.4	173.4	0	0	0	0	0	112.9	A240 C241 C242 F247 C248	A240-G244 PolarHBondContact O-N 3.44Å; C241-G244 WeakPolarHBondContact O-CA 3.25Å; C241-G244 PolarHBondContact O-N 2.85Å; C242-G244 VanDerWaalsContact C-N 3.31Å; C242-G244 PolarHBondContact O-N 3.46Å; G244-F247 PolarHBondContact O-N 3.01Å; G244-C248 WeakPolarHBondContact O-CB 3.46Å; G244-C248 PolarHBondContact O-N 3.27Å; G244-C248 PolarHBondContact O-SG 3.4Å
245	N	95	Very high	93	Very high	28 Å²	28	25.2 Å²	25.2	15%	0.15	15%	0.145	C	C	.	.	H	α-helix	trans	-67.1	-37.6	177.9	-171.4	55.9	0	0	0	112.4	L208 C241 C242 C243 C248 S249 R261 L265	L208-N245 HydrophobicContact CB-CB 3.81Å; L208-N245 HydrophobicContact CD1-CB 4.28Å; L208-N245 PolarHBondContact O-ND2 3.32Å; C241-N245 PolarHBondContact O-N 3.21Å; C242-N245 PolarHBondContact O-N 3.44Å; C243-N245 PolarHBondContact O-N 2.98Å; N245-C248 PolarHBondContact O-N 2.71Å; N245-S249 PolarHBondContact O-N 3.3Å; N245-R261 PolarHBondContact OD1-NH1 2.85Å; N245-L265 HydrophobicContact CB-CD2 4.22Å
246	L	94.6	Very high	92.3	Very high	68 Å²	68	32.2 Å²	32.2	36%	0.356	18%	0.176	S	C	.	.	H	α-helix	trans	-56.7	-52.5	174	177.1	65.4	0	0	0	110.7	L89 C242 C243 S249	L89-L246 HydrophobicContact CD2-CD2 4.2Å; C242-L246 PolarHBondContact O-N 2.68Å; C243-L246 WeakPolarHBondContact O-CB 3.13Å; C243-L246 PolarHBondContact O-N 3.43Å; L246-S249 WeakPolarHBondContact O-CB 3.39Å; L246-S249 PolarHBondContact O-N 2.86Å; L246-S249 PolarHBondContact O-OG 2.7Å
247	F	94.3	Very high	91.9	Very high	27 Å²	27	32.6 Å²	32.6	12%	0.118	18%	0.178	C	C	.	.	H	α-helix	trans	-69.4	-35.3	178.3	-67.3	-63.8	0	0	0	112.7	V82 L85 I86 L89 C243 G244 S249 L250 F251	V82-F247 HydrophobicContact CG1-CB 4.41Å; L85-F247 HydrophobicContact CB-CD1 3.94Å; L85-F247 HydrophobicContact CB-CD2 4.12Å; L85-F247 HydrophobicContact CB-CE1 3.8Å; L85-F247 HydrophobicContact CB-CE2 3.94Å; L85-F247 HydrophobicContact CB-CG 4.12Å; L85-F247 HydrophobicContact CB-CZ 3.8Å; L85-F247 HydrophobicContact CD1-CD1 3.91Å; L85-F247 HydrophobicContact CD1-CE1 4.03Å; L85-F247 HydrophobicContact CG-CE1 4.34Å; L85-F247 WeakPolarHBondContact O-CE2 3.49Å; I86-F247 HydrophobicContact CG1-CB 4.43Å; I86-F247 HydrophobicContact CG1-CD2 3.72Å; I86-F247 HydrophobicContact CG1-CG 4.47Å; L89-F247 HydrophobicContact CB-CE2 3.84Å; L89-F247 HydrophobicContact CB-CZ 4.13Å; L89-F247 HydrophobicContact CD2-CE2 3.54Å; L89-F247 HydrophobicContact CD2-CZ 3.75Å; L89-F247 HydrophobicContact CG-CE2 4.34Å; C243-F247 WeakPolarHBondContact O-CD2 3.1Å; C243-F247 PolarHBondContact O-N 3.45Å; C243-F247 VanDerWaalsContact O-N 3.08Å; G244-F247 PolarHBondContact O-N 3.01Å; F247-S249 PolarHBondContact O-N 2.84Å; F247-L250 HydrophobicContact CD1-CD1 3.93Å; F247-L250 HydrophobicContact CE1-CD1 4.47Å; F247-L250 WeakPolarHBondContact O-CB 3.29Å; F247-L250 PolarHBondContact O-N 2.84Å; F247-L250 VanDerWaalsContact O-N 3.09Å; F247-F251 WeakPolarHBondContact O-CD2 3.12Å; F247-F251 PolarHBondContact O-N 3.5Å
248	C	92.8	Very high	91.2	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-58	-33.9	173.8	-74.4	0	0	0	0	112.7	G244 N245 L250 F251 S255 R261 V264	G244-C248 WeakPolarHBondContact O-CB 3.46Å; G244-C248 PolarHBondContact O-N 3.27Å; G244-C248 PolarHBondContact O-SG 3.4Å; N245-C248 PolarHBondContact O-N 2.71Å; C248-L250 VanDerWaalsContact C-N 3.31Å; C248-L250 PolarHBondContact O-N 2.83Å; C248-F251 PolarHBondContact O-N 3.34Å; C248-F251 VanDerWaalsContact O-O 3.06Å; C248-S255 WeakPolarHBondContact O-CB 3.24Å; C248-S255 PolarHBondContact O-N 3.44Å; C248-R261 HydrophobicContact CB-CG 4.07Å; C248-V264 VanDerWaalsContact SG-CG1 3.52Å
249	S	89.2	Confident	90.7	Very high	69 Å²	69	34.9 Å²	34.9	48%	0.483	19%	0.19	S	C	.	.	H	α-helix	trans	-67.1	-30.9	178.3	78.4	0	0	0	0	113.2	N245 L246 F247	N245-S249 PolarHBondContact O-N 3.3Å; L246-S249 WeakPolarHBondContact O-CB 3.39Å; L246-S249 PolarHBondContact O-N 2.86Å; L246-S249 PolarHBondContact O-OG 2.7Å; F247-S249 PolarHBondContact O-N 2.84Å
250	L	89.6	Confident	90.2	Very high	121 Å²	121	36.7 Å²	36.7	63%	0.634	20%	0.198	S	C	*	.	H	α-helix	trans	-74.4	-29.8	179.5	-63.6	171.1	0	0	0	112.6	F247 C248	F247-L250 HydrophobicContact CD1-CD1 3.93Å; F247-L250 HydrophobicContact CE1-CD1 4.47Å; F247-L250 WeakPolarHBondContact O-CB 3.29Å; F247-L250 PolarHBondContact O-N 2.84Å; F247-L250 VanDerWaalsContact O-N 3.09Å; C248-L250 VanDerWaalsContact C-N 3.31Å; C248-L250 PolarHBondContact O-N 2.83Å
251	F	88.9	Confident	89.9	Confident	58 Å²	58	38.9 Å²	38.9	25%	0.254	21%	0.205	S	C	.	.			trans	-103.1	112.1	-178.8	-68.1	-87.6	0	0	0	111.4	V81 V82 L85 F247 C248 K253 Y254 S255	V81-F251 HydrophobicContact CG1-CZ 4.34Å; V82-F251 HydrophobicContact CG2-CD1 4.44Å; V82-F251 HydrophobicContact CG2-CD2 3.34Å; V82-F251 HydrophobicContact CG2-CE2 3.45Å; V82-F251 VanDerWaalsContact CG2-CE2 3.45Å; V82-F251 HydrophobicContact CG2-CG 3.88Å; V82-F251 HydrophobicContact CG2-CZ 4.06Å; L85-F251 HydrophobicContact CD1-CE2 4.3Å; F247-F251 WeakPolarHBondContact O-CD2 3.12Å; F247-F251 PolarHBondContact O-N 3.5Å; C248-F251 PolarHBondContact O-N 3.34Å; C248-F251 VanDerWaalsContact O-O 3.06Å; F251-K253 PolarHBondContact O-N 2.82Å; F251-Y254 HydrophobicContact CB-CD2 3.85Å; F251-Y254 PolarHBondContact O-N 2.9Å; F251-S255 PolarHBondContact O-N 2.97Å
252	S	84.3	Confident	89.6	Confident	67 Å²	67	39.1 Å²	39.1	47%	0.469	21%	0.206	S	C	.	.	H	α-helix	trans	-56.7	-21.7	-179.5	70.6	0	0	0	0	114.9	K256	S252-K256 WeakPolarHBondContact O-CB 3.41Å; S252-K256 WeakPolarHBondContact O-CG 3.48Å; S252-K256 PolarHBondContact O-N 3.12Å
253	K	86.6	Confident	89.4	Confident	16 Å²	16	40.7 Å²	40.7	7%	0.07	21%	0.213	C	C	.	.	H	α-helix	trans	-61.3	-43.5	172.5	-176.8	174.5	-178.2	154.7	0	112.8	D75 S78 F251	D75-K253 PolarHBondContact O-NZ 3.42Å; D75-K253 IonicContact OD2-NZ 3.36Å; D75-K253 PolarHBondContact OD2-NZ 2.93Å; S78-K253 WeakPolarHBondContact OG-CD 3.49Å; F251-K253 PolarHBondContact O-N 2.82Å
254	Y	88.6	Confident	89.3	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-93.5	-38.2	-176.7	-60.2	-73.8	0	0	0	111.2	G79 V82 F251 K256 N257 K260 V264	G79-Y254 WeakPolarHBondContact CA-OH 3.42Å; G79-Y254 PolarHBondContact N-OH 3.29Å; V82-Y254 HydrophobicContact CB-CE2 4.48Å; V82-Y254 HydrophobicContact CG2-CD2 4.15Å; V82-Y254 HydrophobicContact CG2-CE2 3.91Å; F251-Y254 HydrophobicContact CB-CD2 3.85Å; F251-Y254 PolarHBondContact O-N 2.9Å; Y254-K256 VanDerWaalsContact C-N 3.31Å; Y254-K256 PolarHBondContact O-N 3.47Å; Y254-N257 PolarHBondContact O-N 3.49Å; Y254-N257 VanDerWaalsContact O-O 3.09Å; Y254-K260 HydrophobicContact CD1-CB 3.85Å; Y254-K260 HydrophobicContact CE1-CB 4.18Å; Y254-V264 HydrophobicContact CD1-CG2 3.49Å; Y254-V264 VanDerWaalsContact CD1-CG2 3.49Å; Y254-V264 HydrophobicContact CE1-CG2 3.58Å; Y254-V264 HydrophobicContact CG-CG2 4.14Å
255	S	87.2	Confident	89.3	Confident	60 Å²	60	40.9 Å²	40.9	42%	0.42	21%	0.214	S	C	.	.	H	α-helix	trans	-59.3	-37	177.5	175.4	0	0	0	0	113.6	C248 F251	C248-S255 WeakPolarHBondContact O-CB 3.24Å; C248-S255 PolarHBondContact O-N 3.44Å; F251-S255 PolarHBondContact O-N 2.97Å
256	K	82.1	Confident	89.2	Confident	148 Å²	148	39.7 Å²	39.7	64%	0.643	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.6	-8.4	-177.5	-64.3	-177.5	177.8	-179.3	0	114.8	S252 Y254	S252-K256 WeakPolarHBondContact O-CB 3.41Å; S252-K256 WeakPolarHBondContact O-CG 3.48Å; S252-K256 PolarHBondContact O-N 3.12Å; Y254-K256 VanDerWaalsContact C-N 3.31Å; Y254-K256 PolarHBondContact O-N 3.47Å
257	N	85.1	Confident	89.3	Confident	13 Å²	13	36.5 Å²	36.5	7%	0.07	19%	0.191	C	C	.	.			trans	-127.6	103.3	-177.6	-176.2	-28.4	0	0	0	109.5	E47 Y254 G259 K260 R261	E47-N257 PolarHBondContact OE2-OD1 3.33Å; Y254-N257 PolarHBondContact O-N 3.49Å; Y254-N257 VanDerWaalsContact O-O 3.09Å; N257-G259 VanDerWaalsContact C-N 3.3Å; N257-G259 PolarHBondContact O-N 2.78Å; N257-G259 PolarHBondContact OD1-N 3.36Å; N257-K260 HydrophobicContact CB-CB 4.16Å; N257-K260 HydrophobicContact CB-CG 4.35Å; N257-K260 PolarHBondContact O-N 3.18Å; N257-K260 PolarHBondContact OD1-N 2.86Å; N257-K260 VanDerWaalsContact OD1-N 3.13Å; N257-R261 PolarHBondContact O-N 3.46Å
258	E	82.7	Confident	89.4	Confident	43 Å²	43	35.2 Å²	35.2	20%	0.201	19%	0.186	C	C	.	.	H	α-helix	trans	-62.9	-34.2	-177.4	-72.5	-65.3	167	0	0	113.3	I42 R261 R262	I42-E258 HydrophobicContact CG2-CB 3.87Å; I42-E258 HydrophobicContact CG2-CG 4.25Å; E258-R261 PolarHBondContact O-N 3.34Å; E258-R261 IonicContact OE1-CZ 3.09Å; E258-R261 IonicContact OE1-NE 3.92Å; E258-R261 IonicContact OE1-NH2 2.66Å; E258-R261 PolarHBondContact OE1-NH2 2.83Å; E258-R261 IonicContact OE2-CZ 2.73Å; E258-R261 IonicContact OE2-NE 3.48Å; E258-R261 PolarHBondContact OE2-NE 3.17Å; E258-R261 IonicContact OE2-NH2 2.74Å; E258-R261 PolarHBondContact OE2-NH2 2.92Å; E258-R262 VanDerWaalsContact O-CD 3.27Å; E258-R262 WeakPolarHBondContact O-CD 3.41Å; E258-R262 VanDerWaalsContact O-CG 3.29Å; E258-R262 WeakPolarHBondContact O-CG 3.24Å; E258-R262 PolarHBondContact O-N 2.96Å; E258-R262 VanDerWaalsContact O-N 3.09Å
259	G	84.6	Confident	89.6	Confident	6 Å²	6	35.2 Å²	35.2	6%	0.062	19%	0.186	C	C	.	.	H	α-helix	trans	-64.6	-44.9	176.6	0	0	0	0	0	111.6	N257 R262 E263	N257-G259 VanDerWaalsContact C-N 3.3Å; N257-G259 PolarHBondContact O-N 2.78Å; N257-G259 PolarHBondContact OD1-N 3.36Å; G259-R262 PolarHBondContact O-N 2.92Å; G259-E263 PolarHBondContact O-N 3.09Å
260	K	87.8	Confident	90	Very high	41 Å²	41	31.9 Å²	31.9	18%	0.178	16%	0.163	C	C	.	.	H	α-helix	trans	-68.5	-35.9	175	-70.5	-56.6	-173.2	-167	0	112.9	D51 Y254 N257 R262 E263 V264	D51-K260 WeakPolarHBondContact OD2-CE 3.43Å; Y254-K260 HydrophobicContact CD1-CB 3.85Å; Y254-K260 HydrophobicContact CE1-CB 4.18Å; N257-K260 HydrophobicContact CB-CB 4.16Å; N257-K260 HydrophobicContact CB-CG 4.35Å; N257-K260 PolarHBondContact O-N 3.18Å; N257-K260 PolarHBondContact OD1-N 2.86Å; N257-K260 VanDerWaalsContact OD1-N 3.13Å; K260-R262 VanDerWaalsContact C-N 3.28Å; K260-R262 PolarHBondContact O-N 3.21Å; K260-E263 WeakPolarHBondContact CD-OE2 3.27Å; K260-E263 IonicContact NZ-OE1 3.75Å; K260-E263 PolarHBondContact NZ-OE1 2.92Å; K260-E263 IonicContact NZ-OE2 3.97Å; K260-E263 PolarHBondContact NZ-OE2 3.03Å; K260-E263 WeakPolarHBondContact O-CB 3.22Å; K260-E263 PolarHBondContact O-N 3.41Å; K260-V264 PolarHBondContact O-N 3.33Å
261	R	90.8	Very high	90.3	Very high	47 Å²	47	26.1 Å²	26.1	18%	0.177	13%	0.132	C	C	.	.	H	α-helix	trans	-57.5	-42.5	173.3	-172.6	165.4	74.6	144.2	-6.4	111.4	N245 C248 N257 E258 V264 L265	N245-R261 PolarHBondContact OD1-NH1 2.85Å; C248-R261 HydrophobicContact CB-CG 4.07Å; N257-R261 PolarHBondContact O-N 3.46Å; E258-R261 PolarHBondContact O-N 3.34Å; E258-R261 IonicContact OE1-CZ 3.09Å; E258-R261 IonicContact OE1-NE 3.92Å; E258-R261 IonicContact OE1-NH2 2.66Å; E258-R261 PolarHBondContact OE1-NH2 2.83Å; E258-R261 IonicContact OE2-CZ 2.73Å; E258-R261 IonicContact OE2-NE 3.48Å; E258-R261 PolarHBondContact OE2-NE 3.17Å; E258-R261 IonicContact OE2-NH2 2.74Å; E258-R261 PolarHBondContact OE2-NH2 2.92Å; R261-V264 WeakPolarHBondContact O-CA 3.27Å; R261-V264 WeakPolarHBondContact O-CB 3.29Å; R261-V264 PolarHBondContact O-N 2.71Å; R261-V264 VanDerWaalsContact O-N 3.12Å; R261-L265 HydrophobicContact CG-CD1 4.45Å; R261-L265 WeakPolarHBondContact O-CG 3.3Å; R261-L265 PolarHBondContact O-N 3.32Å
262	R	89.9	Confident	90.7	Very high	6 Å²	6	23.4 Å²	23.4	2%	0.023	12%	0.12	C	C	.	.	H	α-helix	trans	-69.4	-35	179.2	-69.4	157.2	176	-109.3	-12.4	113.9	W44 I198 L199 G201 F202 E258 G259 K260 V264 L265 S266	W44-R262 HydrophobicContact CH2-CB 4.11Å; W44-R262 VanDerWaalsContact CH2-CD 3.47Å; W44-R262 HydrophobicContact CH2-CG 4.44Å; W44-R262 HydrophobicContact CZ3-CB 4.49Å; I198-R262 PolarHBondContact O-NH1 3.35Å; I198-R262 PolarHBondContact O-NH2 3.49Å; L199-R262 HydrophobicContact CD2-CB 3.87Å; L199-R262 HydrophobicContact CD2-CG 4.21Å; L199-R262 WeakPolarHBondContact CD2-O 3.11Å; L199-R262 PolarHBondContact O-NH1 2.81Å; L199-R262 VanDerWaalsContact O-NH1 3.08Å; G201-R262 PolarHBondContact O-NH2 3.47Å; F202-R262 PolarHBondContact O-NH2 3.39Å; E258-R262 VanDerWaalsContact O-CD 3.27Å; E258-R262 WeakPolarHBondContact O-CD 3.41Å; E258-R262 VanDerWaalsContact O-CG 3.29Å; E258-R262 WeakPolarHBondContact O-CG 3.24Å; E258-R262 PolarHBondContact O-N 2.96Å; E258-R262 VanDerWaalsContact O-N 3.09Å; G259-R262 PolarHBondContact O-N 2.92Å; K260-R262 VanDerWaalsContact C-N 3.28Å; K260-R262 PolarHBondContact O-N 3.21Å; R262-V264 PolarHBondContact O-N 3.34Å; R262-L265 PolarHBondContact O-N 3.23Å; R262-S266 PolarHBondContact O-N 3.34Å
263	E	91.6	Very high	91.2	Very high	36 Å²	36	20.2 Å²	20.2	17%	0.168	10%	0.098	C	C	.	.	H	α-helix	trans	-55.8	-40.4	168.8	-70.4	176.3	-167.3	0	0	110.5	G259 K260 A267 T299	G259-E263 PolarHBondContact O-N 3.09Å; K260-E263 WeakPolarHBondContact CD-OE2 3.27Å; K260-E263 IonicContact NZ-OE1 3.75Å; K260-E263 PolarHBondContact NZ-OE1 2.92Å; K260-E263 IonicContact NZ-OE2 3.97Å; K260-E263 PolarHBondContact NZ-OE2 3.03Å; K260-E263 WeakPolarHBondContact O-CB 3.22Å; K260-E263 PolarHBondContact O-N 3.41Å; E263-A267 PolarHBondContact O-N 3.39Å; E263-T299 HydrophobicContact CB-CG2 4.11Å; E263-T299 WeakPolarHBondContact CG-OG1 3.49Å; E263-T299 WeakPolarHBondContact O-CG2 3.29Å
264	V	94.5	Very high	91.6	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.006	10%	0.095	C	C	.	.	H	α-helix	trans	-71.6	-40.4	176.3	-179.3	0	0	0	0	112.3	V82 M83 I86 C248 Y254 K260 R261 R262 S266 A267 A268	V82-V264 HydrophobicContact CG1-CG1 3.82Å; V82-V264 HydrophobicContact CG1-CG2 4.44Å; M83-V264 HydrophobicContact CE-CB 4.09Å; M83-V264 HydrophobicContact CE-CG1 3.94Å; M83-V264 HydrophobicContact CE-CG2 3.74Å; I86-V264 HydrophobicContact CD1-CG1 3.27Å; C248-V264 VanDerWaalsContact SG-CG1 3.52Å; Y254-V264 HydrophobicContact CD1-CG2 3.49Å; Y254-V264 VanDerWaalsContact CD1-CG2 3.49Å; Y254-V264 HydrophobicContact CE1-CG2 3.58Å; Y254-V264 HydrophobicContact CG-CG2 4.14Å; K260-V264 PolarHBondContact O-N 3.33Å; R261-V264 WeakPolarHBondContact O-CA 3.27Å; R261-V264 WeakPolarHBondContact O-CB 3.29Å; R261-V264 PolarHBondContact O-N 2.71Å; R261-V264 VanDerWaalsContact O-N 3.12Å; R262-V264 PolarHBondContact O-N 3.34Å; V264-S266 VanDerWaalsContact C-N 3.31Å; V264-S266 PolarHBondContact O-N 3.33Å; V264-A267 WeakPolarHBondContact O-CB 3.4Å; V264-A267 PolarHBondContact O-N 3.24Å; V264-A268 WeakPolarHBondContact O-CB 3.4Å; V264-A268 PolarHBondContact O-N 3.34Å
265	L	94.7	Very high	91.9	Very high	4 Å²	4	19.6 Å²	19.6	2%	0.021	10%	0.096	C	C	.	.	H	α-helix	trans	-63.3	-36.8	177.2	-67	175.3	0	0	0	112.3	I198 L199 L208 C241 N245 R261 R262 A268 A269	I198-L265 HydrophobicContact CG2-CD1 4.26Å; L199-L265 HydrophobicContact CD2-CB 4.06Å; L208-L265 HydrophobicContact CD1-CD1 3.68Å; L208-L265 HydrophobicContact CD1-CD2 3.89Å; L208-L265 HydrophobicContact CD1-CG 4.45Å; C241-L265 HydrophobicContact CB-CD2 4.37Å; C241-L265 VanDerWaalsContact O-CD2 3.31Å; C241-L265 WeakPolarHBondContact O-CD2 3.43Å; C241-L265 PolarHBondContact SG-O 2.69Å; C241-L265 VanDerWaalsContact SG-O 3.42Å; N245-L265 HydrophobicContact CB-CD2 4.22Å; R261-L265 HydrophobicContact CG-CD1 4.45Å; R261-L265 WeakPolarHBondContact O-CG 3.3Å; R261-L265 PolarHBondContact O-N 3.32Å; R262-L265 PolarHBondContact O-N 3.23Å; L265-A268 PolarHBondContact O-N 3.35Å; L265-A269 PolarHBondContact O-N 3.47Å
266	S	94.4	Very high	92.2	Very high	3 Å²	3	17 Å²	17	2%	0.021	8%	0.078	C	C	.	.	H	α-helix	trans	-67.3	-38.9	174	173.8	0	0	0	0	112.4	R262 V264 A268 A269 A270 S287 S292 F295	R262-S266 PolarHBondContact O-N 3.34Å; V264-S266 VanDerWaalsContact C-N 3.31Å; V264-S266 PolarHBondContact O-N 3.33Å; S266-A268 VanDerWaalsContact C-N 3.34Å; S266-A269 PolarHBondContact O-N 3.23Å; S266-A270 PolarHBondContact O-N 3.38Å; S266-A270 VanDerWaalsContact O-N 3.09Å; S266-S287 PolarHBondContact O-OG 2.8Å; S266-S287 PolarHBondContact OG-OG 3.27Å; S266-S292 VanDerWaalsContact CB-OG 3.29Å; S266-S292 WeakPolarHBondContact CB-OG 3.43Å; S266-S292 PolarHBondContact OG-OG 3.42Å; S266-F295 WeakPolarHBondContact OG-CD2 3.29Å; S266-F295 WeakPolarHBondContact OG-CE2 3.18Å
267	A	95.9	Very high	92.6	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-64.9	-38.8	172.6	0	0	0	0	0	112.2	M83 E263 V264 A270 A271 S303	M83-A267 HydrophobicContact CE-CB 3.93Å; M83-A267 HydrophobicContact SD-CB 3.43Å; M83-A267 WeakPolarHBondContact SD-CB 3.13Å; E263-A267 PolarHBondContact O-N 3.39Å; V264-A267 WeakPolarHBondContact O-CB 3.4Å; V264-A267 PolarHBondContact O-N 3.24Å; A267-A270 WeakPolarHBondContact O-CB 3.41Å; A267-A270 PolarHBondContact O-N 3.27Å; A267-A271 PolarHBondContact O-N 3.25Å; A267-S303 VanDerWaalsContact CA-OG 3.26Å; A267-S303 WeakPolarHBondContact CA-OG 3.35Å; A267-S303 WeakPolarHBondContact CB-OG 3.27Å
268	A	96.9	Very high	92.9	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-66.4	-38.9	175.1	0	0	0	0	0	112.1	I86 A240 V264 L265 S266 A270 A271 G272	I86-A268 HydrophobicContact CG2-CB 3.87Å; A240-A268 WeakPolarHBondContact CB-O 3.49Å; A240-A268 WeakPolarHBondContact O-CB 3.42Å; V264-A268 WeakPolarHBondContact O-CB 3.4Å; V264-A268 PolarHBondContact O-N 3.34Å; L265-A268 PolarHBondContact O-N 3.35Å; S266-A268 VanDerWaalsContact C-N 3.34Å; A268-A270 VanDerWaalsContact C-N 3.33Å; A268-A270 PolarHBondContact O-N 3.47Å; A268-A271 PolarHBondContact O-N 2.97Å; A268-G272 PolarHBondContact O-N 3.27Å
269	A	96.3	Very high	93.4	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-60.3	-43.5	173.1	0	0	0	0	0	111.4	V237 L265 S266 A271 G272 V273 V291	V237-A269 HydrophobicContact CG1-CB 3.81Å; L265-A269 PolarHBondContact O-N 3.47Å; S266-A269 PolarHBondContact O-N 3.23Å; A269-A271 PolarHBondContact O-N 3.23Å; A269-G272 PolarHBondContact O-N 2.81Å; A269-V273 WeakPolarHBondContact O-CG2 3.4Å; A269-V273 PolarHBondContact O-N 2.78Å; A269-V291 HydrophobicContact CB-CG1 3.95Å
270	A	96.7	Very high	93.9	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-61.1	-42.6	174.7	0	0	0	0	0	112.2	S266 A267 A268 G272 V273 S274 G283 V284	S266-A270 PolarHBondContact O-N 3.38Å; S266-A270 VanDerWaalsContact O-N 3.09Å; A267-A270 WeakPolarHBondContact O-CB 3.41Å; A267-A270 PolarHBondContact O-N 3.27Å; A268-A270 VanDerWaalsContact C-N 3.33Å; A268-A270 PolarHBondContact O-N 3.47Å; A270-G272 VanDerWaalsContact C-N 3.35Å; A270-V273 PolarHBondContact O-N 2.77Å; A270-S274 WeakPolarHBondContact O-CB 3.41Å; A270-S274 PolarHBondContact O-N 3.5Å; A270-G283 WeakPolarHBondContact CA-O 3.42Å; A270-V284 HydrophobicContact CB-CG2 4.11Å
271	A	97.4	Very high	94.3	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-63.1	-39.6	175.1	0	0	0	0	0	112.4	A267 A268 A269 S274 V275 A306 A310	A267-A271 PolarHBondContact O-N 3.25Å; A268-A271 PolarHBondContact O-N 2.97Å; A269-A271 PolarHBondContact O-N 3.23Å; A271-S274 WeakPolarHBondContact O-CB 3.33Å; A271-S274 PolarHBondContact O-N 3Å; A271-V275 WeakPolarHBondContact O-CG2 3.49Å; A271-V275 PolarHBondContact O-N 3.46Å; A271-A306 HydrophobicContact CB-CB 4.28Å; A271-A310 HydrophobicContact CB-CB 4.14Å
272	G	96.4	Very high	94.4	Very high	0 Å²	0	7.9 Å²	7.9	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-61.6	-43.5	175.6	0	0	0	0	0	113.1	A240 A268 A269 A270 V275 A276	A240-G272 VanDerWaalsContact CB-CA 3.49Å; A268-G272 PolarHBondContact O-N 3.27Å; A269-G272 PolarHBondContact O-N 2.81Å; A270-G272 VanDerWaalsContact C-N 3.35Å; G272-V275 WeakPolarHBondContact O-CG2 3.24Å; G272-V275 PolarHBondContact O-N 3.36Å; G272-A276 VanDerWaalsContact O-CB 3.24Å; G272-A276 WeakPolarHBondContact O-CB 3.46Å; G272-A276 PolarHBondContact O-N 3.22Å
273	V	95.1	Very high	94.7	Very high	0 Å²	0	7.6 Å²	7.6	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-68.9	-36.8	175	-178.9	0	0	0	0	111.4	V237 A269 A270 V275 A276 F277 F286 I547	V237-V273 HydrophobicContact CG1-CG2 4.46Å; V237-V273 HydrophobicContact CG2-CG2 3.5Å; V237-V273 VanDerWaalsContact CG2-CG2 3.5Å; A269-V273 WeakPolarHBondContact O-CG2 3.4Å; A269-V273 PolarHBondContact O-N 2.78Å; A270-V273 PolarHBondContact O-N 2.77Å; V273-V275 VanDerWaalsContact C-N 3.33Å; V273-V275 PolarHBondContact O-N 2.64Å; V273-A276 WeakPolarHBondContact O-CB 3.49Å; V273-A276 PolarHBondContact O-N 2.73Å; V273-F277 HydrophobicContact CG1-CD2 3.74Å; V273-F277 HydrophobicContact CG1-CE2 4.16Å; V273-F277 PolarHBondContact O-N 3.18Å; V273-F286 HydrophobicContact CB-CD1 4.45Å; V273-F286 HydrophobicContact CB-CG 4.46Å; V273-F286 HydrophobicContact CG1-CB 4.04Å; V273-F286 HydrophobicContact CG1-CD1 4.46Å; V273-F286 HydrophobicContact CG1-CD2 4.23Å; V273-F286 HydrophobicContact CG1-CG 4Å; V273-F286 HydrophobicContact CG2-CB 4.42Å; V273-F286 HydrophobicContact CG2-CD1 3.45Å; V273-F286 VanDerWaalsContact CG2-CD1 3.45Å; V273-F286 HydrophobicContact CG2-CD2 4.37Å; V273-F286 HydrophobicContact CG2-CE1 3.72Å; V273-F286 HydrophobicContact CG2-CG 3.84Å; V273-F286 HydrophobicContact CG2-CZ 4.4Å; V273-I547 HydrophobicContact CG1-CD1 4.24Å
274	S	95.7	Very high	94.9	Very high	0 Å²	0	6.3 Å²	6.3	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-62.3	-37.8	177	-179.8	0	0	0	0	113.1	A270 A271 G278 A279 P280 A307	A270-S274 WeakPolarHBondContact O-CB 3.41Å; A270-S274 PolarHBondContact O-N 3.5Å; A271-S274 WeakPolarHBondContact O-CB 3.33Å; A271-S274 PolarHBondContact O-N 3Å; S274-G278 CarbonylContact O-C 3.53Å; S274-G278 WeakPolarHBondContact O-CA 3.38Å; S274-G278 PolarHBondContact O-N 2.89Å; S274-A279 PolarHBondContact O-N 2.93Å; S274-P280 VanDerWaalsContact OG-CA 3.29Å; S274-P280 WeakPolarHBondContact OG-CA 3.38Å; S274-A307 PolarHBondContact OG-O 3.36Å
275	V	94.6	Very high	94.9	Very high	4 Å²	4	8.7 Å²	8.7	2%	0.024	5%	0.049	C	C	.	.	H	α-helix	trans	-80.6	-29.3	176.2	-62.5	0	0	0	0	112.2	A94 A271 G272 V273 A310 L314	A94-V275 HydrophobicContact CB-CB 3.73Å; A94-V275 HydrophobicContact CB-CG1 4.46Å; A94-V275 HydrophobicContact CB-CG2 3.64Å; A271-V275 WeakPolarHBondContact O-CG2 3.49Å; A271-V275 PolarHBondContact O-N 3.46Å; G272-V275 WeakPolarHBondContact O-CG2 3.24Å; G272-V275 PolarHBondContact O-N 3.36Å; V273-V275 VanDerWaalsContact C-N 3.33Å; V273-V275 PolarHBondContact O-N 2.64Å; V275-A310 HydrophobicContact CG1-CB 3.39Å; V275-L314 HydrophobicContact CB-CD2 4.22Å; V275-L314 WeakPolarHBondContact O-CD2 3.21Å
276	A	93.1	Very high	94.9	Very high	5 Å²	5	8.6 Å²	8.6	4%	0.041	5%	0.049	C	C	.	.	H	α-helix	trans	-64.6	-44	175.6	0	0	0	0	0	113	E233 L236 G272 V273	E233-A276 HydrophobicContact CB-CB 3.89Å; E233-A276 VanDerWaalsContact CD-O 3.31Å; E233-A276 HydrophobicContact CG-CB 4.34Å; E233-A276 VanDerWaalsContact OE2-C 3.29Å; E233-A276 WeakPolarHBondContact OE2-CA 3.37Å; E233-A276 WeakPolarHBondContact OE2-CB 3.34Å; L236-A276 HydrophobicContact CB-CB 4.44Å; L236-A276 HydrophobicContact CD1-CB 4.1Å; G272-A276 VanDerWaalsContact O-CB 3.24Å; G272-A276 WeakPolarHBondContact O-CB 3.46Å; G272-A276 PolarHBondContact O-N 3.22Å; V273-A276 WeakPolarHBondContact O-CB 3.49Å; V273-A276 PolarHBondContact O-N 2.73Å
277	F	91.3	Very high	94.9	Very high	4 Å²	4	8.4 Å²	8.4	2%	0.018	5%	0.048	C	C	.	.	H	α-helix	trans	-114.5	6.2	-175.7	-64.1	-77	0	0	0	114.2	E233 V273 A279 V326 F328 F478 M482 I547 L551	E233-F277 HydrophobicContact CB-CE2 4.21Å; E233-F277 HydrophobicContact CB-CZ 4.05Å; E233-F277 HydrophobicContact CG-CE1 4.22Å; E233-F277 HydrophobicContact CG-CZ 4.23Å; V273-F277 HydrophobicContact CG1-CD2 3.74Å; V273-F277 HydrophobicContact CG1-CE2 4.16Å; V273-F277 PolarHBondContact O-N 3.18Å; F277-A279 HydrophobicContact CB-CB 4.06Å; F277-A279 PolarHBondContact O-N 3.46Å; F277-V326 VanDerWaalsContact O-CG2 3.25Å; F277-V326 WeakPolarHBondContact O-CG2 3.45Å; F277-F328 HydrophobicContact CD1-CZ 4.44Å; F277-F478 HydrophobicContact CE1-CB 4.5Å; F277-F478 AromaticContact CE2-CD2 3.52Å; F277-F478 HydrophobicContact CE2-CD2 3.52Å; F277-F478 AromaticContact CE2-CE2 3.89Å; F277-F478 HydrophobicContact CE2-CE2 3.89Å; F277-F478 HydrophobicContact CZ-CB 3.83Å; F277-F478 AromaticContact CZ-CD2 3.3Å; F277-F478 HydrophobicContact CZ-CD2 3.3Å; F277-F478 HydrophobicContact CZ-CE2 4.09Å; F277-F478 AromaticContact CZ-CG 3.88Å; F277-F478 HydrophobicContact CZ-CG 3.88Å; F277-M482 HydrophobicContact CE1-CE 3.84Å; F277-M482 HydrophobicContact CE1-SD 4.33Å; F277-I547 HydrophobicContact CB-CG2 3.77Å; F277-I547 HydrophobicContact CD1-CG2 4.08Å; F277-I547 HydrophobicContact CD2-CD1 4.43Å; F277-I547 HydrophobicContact CD2-CG2 4.48Å; F277-I547 HydrophobicContact CG-CG2 3.89Å; F277-L551 VanDerWaalsContact O-CD2 3.29Å; F277-L551 WeakPolarHBondContact O-CD2 3.38Å
278	G	90.6	Very high	94.7	Very high	9 Å²	9	12.1 Å²	12.1	9%	0.093	7%	0.067	C	C	.	.	S	Bend	trans	58.3	21	-175	0	0	0	0	0	114.3	S274 P280 L325	S274-G278 CarbonylContact O-C 3.53Å; S274-G278 WeakPolarHBondContact O-CA 3.38Å; S274-G278 PolarHBondContact O-N 2.89Å; G278-P280 WeakPolarHBondContact O-CD 3.38Å; G278-L325 WeakPolarHBondContact O-CD1 3.5Å
279	A	93.3	Very high	94.3	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.076	C	C	.	.			trans	-121.7	87.6	-167	0	0	0	0	0	110.3	S274 F277 G283 I547 E550	S274-A279 PolarHBondContact O-N 2.93Å; F277-A279 HydrophobicContact CB-CB 4.06Å; F277-A279 PolarHBondContact O-N 3.46Å; A279-G283 PolarHBondContact O-N 3.48Å; A279-I547 HydrophobicContact CB-CB 4.33Å; A279-I547 HydrophobicContact CB-CG1 4.14Å; A279-I547 HydrophobicContact CB-CG2 4.14Å; A279-E550 WeakPolarHBondContact CA-OE2 3.44Å; A279-E550 HydrophobicContact CB-CB 3.98Å; A279-E550 WeakPolarHBondContact CB-OE2 3.32Å
280	P	95.3	Very high	93.9	Very high	17 Å²	17	14.3 Å²	14.3	11%	0.11	8%	0.077	C	C	.	.	H	α-helix	trans	-68.8	-39.4	-175.1	26.5	-33.5	0	0	0	113.5	S274 G278 V284 A307 E550	S274-P280 VanDerWaalsContact OG-CA 3.29Å; S274-P280 WeakPolarHBondContact OG-CA 3.38Å; G278-P280 WeakPolarHBondContact O-CD 3.38Å; P280-V284 WeakPolarHBondContact O-CG2 3.2Å; P280-V284 PolarHBondContact O-N 3.21Å; P280-A307 HydrophobicContact CB-CB 4.11Å; P280-E550 WeakPolarHBondContact CD-OE1 3.32Å
281	I	95.1	Very high	93.4	Very high	77 Å²	77	14.5 Å²	14.5	40%	0.395	8%	0.078	S	C	.	.	H	α-helix	trans	-70.3	-45.3	177	-58	168.2	0	0	0	108.8	G283 V284 L285 F304 V546 E550	I281-G283 VanDerWaalsContact C-N 3.29Å; I281-G283 PolarHBondContact O-N 2.91Å; I281-V284 PolarHBondContact O-N 3.22Å; I281-L285 HydrophobicContact CG2-CD1 4.2Å; I281-L285 WeakPolarHBondContact O-CG 3.47Å; I281-L285 PolarHBondContact O-N 3.43Å; I281-F304 HydrophobicContact CG1-CE2 3.83Å; I281-V546 HydrophobicContact CB-CG1 4.07Å; I281-V546 HydrophobicContact CG2-CG1 3.81Å; I281-E550 WeakPolarHBondContact CB-OE1 3.41Å; I281-E550 WeakPolarHBondContact CD1-OE1 3.27Å; I281-E550 WeakPolarHBondContact CG1-OE1 3.26Å; I281-E550 PolarHBondContact N-OE1 2.62Å; I281-E550 VanDerWaalsContact N-OE1 3.12Å; I281-E550 PolarHBondContact N-OE2 3.13Å; I281-E550 VanDerWaalsContact N-OE2 3.09Å
282	G	94.1	Very high	92.8	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-56.2	-42.1	175.9	0	0	0	0	0	112.7	L285 F286 E550	G282-L285 PolarHBondContact O-N 2.93Å; G282-F286 VanDerWaalsContact O-CB 3.32Å; G282-F286 WeakPolarHBondContact O-CB 3.19Å; G282-F286 PolarHBondContact O-N 3.37Å; G282-E550 PolarHBondContact N-OE2 3.28Å
283	G	94.8	Very high	91.7	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-66.4	-37.3	178.3	0	0	0	0	0	114.5	A270 A279 I281 F286 S287	A270-G283 WeakPolarHBondContact CA-O 3.42Å; A279-G283 PolarHBondContact O-N 3.48Å; I281-G283 VanDerWaalsContact C-N 3.29Å; I281-G283 PolarHBondContact O-N 2.91Å; G283-F286 WeakPolarHBondContact O-CB 3.34Å; G283-S287 PolarHBondContact O-N 3.12Å
284	V	96.4	Very high	90.8	Very high	8 Å²	8	23.4 Å²	23.4	5%	0.048	12%	0.116	C	C	.	.	H	α-helix	trans	-68.7	-43.2	174.4	176.9	0	0	0	0	111	A270 P280 I281 F286 S287 L288 F295 L300 F304 A307	A270-V284 HydrophobicContact CB-CG2 4.11Å; P280-V284 WeakPolarHBondContact O-CG2 3.2Å; P280-V284 PolarHBondContact O-N 3.21Å; I281-V284 PolarHBondContact O-N 3.22Å; V284-F286 VanDerWaalsContact C-N 3.33Å; V284-S287 PolarHBondContact O-N 2.96Å; V284-L288 PolarHBondContact O-N 3.35Å; V284-F295 HydrophobicContact CG1-CE1 4.3Å; V284-F295 HydrophobicContact CG1-CZ 4.27Å; V284-L300 HydrophobicContact CG1-CG 4.38Å; V284-F304 HydrophobicContact CG2-CB 4.11Å; V284-F304 HydrophobicContact CG2-CD2 4.29Å; V284-A307 HydrophobicContact CG2-CB 4.32Å
285	L	95.2	Very high	90.2	Very high	51 Å²	51	25.1 Å²	25.1	27%	0.267	12%	0.123	S	C	.	.	H	α-helix	trans	-64.8	-38.5	176.3	-69.1	175.7	0	0	0	111.6	I281 G282 S287 L288 E289 V542 V546	I281-L285 HydrophobicContact CG2-CD1 4.2Å; I281-L285 WeakPolarHBondContact O-CG 3.47Å; I281-L285 PolarHBondContact O-N 3.43Å; G282-L285 PolarHBondContact O-N 2.93Å; L285-S287 VanDerWaalsContact C-N 3.33Å; L285-S287 PolarHBondContact O-N 3.24Å; L285-L288 PolarHBondContact O-N 3.03Å; L285-E289 VanDerWaalsContact O-CB 3.3Å; L285-E289 WeakPolarHBondContact O-CB 3.13Å; L285-E289 PolarHBondContact O-N 3.32Å; L285-V542 HydrophobicContact CD1-CG1 4.48Å; L285-V546 HydrophobicContact CD1-CB 3.96Å; L285-V546 HydrophobicContact CD1-CG1 4.01Å; L285-V546 HydrophobicContact CD1-CG2 3.66Å
286	F	94.3	Very high	89.8	Confident	2 Å²	2	26.1 Å²	26.1	1%	0.009	13%	0.13	C	C	.	.	H	α-helix	trans	-57.3	-47.6	172.2	178.2	-76.4	0	0	0	111.2	I192 V273 G282 G283 V284 L288 E289 E290 V291 F478 M540	I192-F286 HydrophobicContact CD1-CZ 4.21Å; V273-F286 HydrophobicContact CB-CD1 4.45Å; V273-F286 HydrophobicContact CB-CG 4.46Å; V273-F286 HydrophobicContact CG1-CB 4.04Å; V273-F286 HydrophobicContact CG1-CD1 4.46Å; V273-F286 HydrophobicContact CG1-CD2 4.23Å; V273-F286 HydrophobicContact CG1-CG 4Å; V273-F286 HydrophobicContact CG2-CB 4.42Å; V273-F286 HydrophobicContact CG2-CD1 3.45Å; V273-F286 VanDerWaalsContact CG2-CD1 3.45Å; V273-F286 HydrophobicContact CG2-CD2 4.37Å; V273-F286 HydrophobicContact CG2-CE1 3.72Å; V273-F286 HydrophobicContact CG2-CG 3.84Å; V273-F286 HydrophobicContact CG2-CZ 4.4Å; G282-F286 VanDerWaalsContact O-CB 3.32Å; G282-F286 WeakPolarHBondContact O-CB 3.19Å; G282-F286 PolarHBondContact O-N 3.37Å; G283-F286 WeakPolarHBondContact O-CB 3.34Å; V284-F286 VanDerWaalsContact C-N 3.33Å; F286-L288 PolarHBondContact O-N 3.39Å; F286-E289 PolarHBondContact O-N 3.5Å; F286-E290 HydrophobicContact CE1-CB 4.46Å; F286-E290 HydrophobicContact CZ-CB 4.35Å; F286-E290 PolarHBondContact O-N 3.47Å; F286-V291 HydrophobicContact CD1-CG2 3.7Å; F286-V291 HydrophobicContact CE1-CG2 3.29Å; F286-V291 HydrophobicContact CZ-CG2 4.3Å; F286-F478 HydrophobicContact CE2-CE1 4.44Å; F286-F478 AromaticContact CE2-CE2 3.79Å; F286-F478 HydrophobicContact CE2-CE2 3.79Å; F286-F478 AromaticContact CE2-CZ 3.39Å; F286-F478 HydrophobicContact CE2-CZ 3.39Å; F286-F478 HydrophobicContact CZ-CE2 4.06Å; F286-F478 AromaticContact CZ-CZ 3.63Å; F286-F478 HydrophobicContact CZ-CZ 3.63Å; F286-M540 HydrophobicContact CB-CE 4.29Å; F286-M540 HydrophobicContact CD2-CE 2.97Å; F286-M540 HydrophobicContact CD2-SD 3.83Å; F286-M540 HydrophobicContact CE2-CE 3.2Å; F286-M540 HydrophobicContact CE2-SD 3.43Å; F286-M540 WeakPolarHBondContact CE2-SD 3.33Å; F286-M540 HydrophobicContact CG-CE 3.79Å; F286-M540 HydrophobicContact CZ-CE 4.24Å; F286-M540 HydrophobicContact CZ-SD 4.41Å
287	S	94.1	Very high	89.6	Confident	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.159	C	C	.	.	I	π-helix	trans	-63.1	-33.8	179.5	-170.4	0	0	0	0	111.7	S266 G283 V284 L285 V291 S292	S266-S287 PolarHBondContact O-OG 2.8Å; S266-S287 PolarHBondContact OG-OG 3.27Å; G283-S287 PolarHBondContact O-N 3.12Å; V284-S287 PolarHBondContact O-N 2.96Å; L285-S287 VanDerWaalsContact C-N 3.33Å; L285-S287 PolarHBondContact O-N 3.24Å; S287-V291 PolarHBondContact O-N 3.48Å; S287-S292 WeakPolarHBondContact O-CB 3.33Å; S287-S292 PolarHBondContact O-N 3.43Å; S287-S292 PolarHBondContact O-OG 3.46Å
288	L	91.2	Very high	89.5	Confident	77 Å²	77	39.6 Å²	39.6	40%	0.403	19%	0.193	S	C	.	.	I	π-helix	trans	-74.2	-44.9	175.9	-170.4	160.5	0	0	0	112.6	V284 L285 F286 F295 L300	V284-L288 PolarHBondContact O-N 3.35Å; L285-L288 PolarHBondContact O-N 3.03Å; F286-L288 PolarHBondContact O-N 3.39Å; L288-F295 HydrophobicContact CB-CD1 4.33Å; L288-F295 HydrophobicContact CD1-CD1 3.79Å; L288-F295 HydrophobicContact CD1-CE1 4.26Å; L288-F295 HydrophobicContact CG-CB 4.41Å; L288-F295 HydrophobicContact CG-CD1 4.11Å; L288-F295 HydrophobicContact CG-CG 4.43Å; L288-L300 HydrophobicContact CD1-CD1 4.14Å
289	E	89.6	Confident	89.5	Confident	42 Å²	42	39.4 Å²	39.4	20%	0.196	19%	0.19	C	C	.	.	I	π-helix	trans	-77.2	-41.3	-173.4	-171.8	171.8	171.7	0	0	112.4	L285 F286 T541 V542 S543 R596	L285-E289 VanDerWaalsContact O-CB 3.3Å; L285-E289 WeakPolarHBondContact O-CB 3.13Å; L285-E289 PolarHBondContact O-N 3.32Å; F286-E289 PolarHBondContact O-N 3.5Å; E289-T541 PolarHBondContact OE1-N 2.93Å; E289-T541 PolarHBondContact OE1-OG1 3.46Å; E289-V542 PolarHBondContact OE1-N 3.41Å; E289-V542 PolarHBondContact OE2-N 3.49Å; E289-S543 WeakPolarHBondContact OE2-CB 3.28Å; E289-S543 PolarHBondContact OE2-N 2.9Å; E289-S543 PolarHBondContact OE2-OG 3.01Å; E289-R596 PolarHBondContact O-NH2 3.04Å
290	E	87.6	Confident	89.5	Confident	4 Å²	4	41.8 Å²	41.8	2%	0.019	20%	0.202	C	C	.	.	I	π-helix	trans	-114.3	-33	-170.8	-72.4	-54.6	135.3	0	0	115.7	K196 F286 M540 R596	K196-E290 WeakPolarHBondContact CE-O 3.31Å; F286-E290 HydrophobicContact CE1-CB 4.46Å; F286-E290 HydrophobicContact CZ-CB 4.35Å; F286-E290 PolarHBondContact O-N 3.47Å; E290-M540 HydrophobicContact CB-CE 4.09Å; E290-M540 HydrophobicContact CG-CE 3.19Å; E290-M540 HydrophobicContact CG-CG 3.4Å; E290-M540 HydrophobicContact CG-SD 3.57Å; E290-M540 VanDerWaalsContact CG-SD 3.57Å; E290-M540 WeakPolarHBondContact OE1-CG 3.3Å; E290-R596 IonicContact OE1-CZ 3.82Å; E290-R596 IonicContact OE1-NH1 2.87Å; E290-R596 PolarHBondContact OE1-NH1 3.35Å; E290-R596 IonicContact OE1-NH2 3.81Å; E290-R596 PolarHBondContact OE1-NH2 2.72Å; E290-R596 IonicContact OE2-NH2 2.73Å
291	V	86.9	Confident	89.4	Confident	4 Å²	4	48.2 Å²	48.2	2%	0.024	22%	0.224	C	C	.	.	I	π-helix	trans	-97.8	-39.9	-167.2	179.4	0	0	0	0	111.6	I195 L199 A269 F286 S287	I195-V291 HydrophobicContact CG2-CG1 3.77Å; L199-V291 HydrophobicContact CD1-CB 4.42Å; L199-V291 HydrophobicContact CD1-CG1 3.26Å; L199-V291 WeakPolarHBondContact CD1-O 3.37Å; A269-V291 HydrophobicContact CB-CG1 3.95Å; F286-V291 HydrophobicContact CD1-CG2 3.7Å; F286-V291 HydrophobicContact CE1-CG2 3.29Å; F286-V291 HydrophobicContact CZ-CG2 4.3Å; S287-V291 PolarHBondContact O-N 3.48Å
292	S	84.2	Confident	89.3	Confident	16 Å²	16	46.4 Å²	46.4	11%	0.112	21%	0.212	C	C	.	.			trans	-99	133.2	-170.8	-76	0	0	0	0	113.9	S266 S287	S266-S292 VanDerWaalsContact CB-OG 3.29Å; S266-S292 WeakPolarHBondContact CB-OG 3.43Å; S266-S292 PolarHBondContact OG-OG 3.42Å; S287-S292 WeakPolarHBondContact O-CB 3.33Å; S287-S292 PolarHBondContact O-N 3.43Å; S287-S292 PolarHBondContact O-OG 3.46Å
293	Y	73.8	Confident	89.4	Confident	36 Å²	36	46.4 Å²	46.4	14%	0.141	21%	0.212	C	C	.	.	S	Bend	trans	-75.2	-40.7	170.5	179.4	-76.3	0	0	0	112.2	I595 R727 K728	Y293-I595 HydrophobicContact CD1-CD1 4.43Å; Y293-I595 HydrophobicContact CD2-CD1 3.41Å; Y293-I595 VanDerWaalsContact CD2-CD1 3.41Å; Y293-I595 HydrophobicContact CD2-CG1 3.4Å; Y293-I595 VanDerWaalsContact CD2-CG1 3.4Å; Y293-I595 HydrophobicContact CE1-CD1 4.39Å; Y293-I595 HydrophobicContact CE2-CB 4.44Å; Y293-I595 HydrophobicContact CE2-CD1 3.5Å; Y293-I595 VanDerWaalsContact CE2-CD1 3.5Å; Y293-I595 HydrophobicContact CE2-CG1 3.05Å; Y293-I595 HydrophobicContact CG-CD1 3.83Å; Y293-I595 HydrophobicContact CG-CG1 4.3Å; Y293-I595 WeakPolarHBondContact O-CD1 3.34Å; Y293-R727 VanDerWaalsContact CE1-C 3.5Å; Y293-R727 WeakPolarHBondContact CE1-O 3.2Å; Y293-R727 HydrophobicContact CE2-CB 4.12Å; Y293-R727 HydrophobicContact CE2-CG 4.28Å; Y293-R727 WeakPolarHBondContact OH-CA 3.35Å; Y293-R727 WeakPolarHBondContact OH-CB 3.49Å; Y293-R727 PolarHBondContact OH-O 2.84Å; Y293-R727 VanDerWaalsContact OH-O 3.06Å; Y293-K728 WeakPolarHBondContact OH-CA 3.4Å; Y293-K728 PolarHBondContact OH-N 2.74Å
294	Y	76.8	Confident	89.5	Confident	136 Å²	136	49.7 Å²	49.7	53%	0.533	23%	0.227	S	C	.	.			trans	-138.7	125.9	-177.3	171.5	-103	0	0	0	109.6	P296	Y294-P296 HydrophobicContact CD1-CG 4.48Å; Y294-P296 HydrophobicContact CE1-CB 4.02Å; Y294-P296 HydrophobicContact CE1-CG 3.89Å
295	F	82.9	Confident	89.6	Confident	36 Å²	36	52.4 Å²	52.4	16%	0.158	24%	0.238	C	C	.	.			trans	-131.3	92.1	-172.5	-159.5	-108.6	0	0	0	111.6	S266 V284 L288 T299 L300 S303	S266-F295 WeakPolarHBondContact OG-CD2 3.29Å; S266-F295 WeakPolarHBondContact OG-CE2 3.18Å; V284-F295 HydrophobicContact CG1-CE1 4.3Å; V284-F295 HydrophobicContact CG1-CZ 4.27Å; L288-F295 HydrophobicContact CB-CD1 4.33Å; L288-F295 HydrophobicContact CD1-CD1 3.79Å; L288-F295 HydrophobicContact CD1-CE1 4.26Å; L288-F295 HydrophobicContact CG-CB 4.41Å; L288-F295 HydrophobicContact CG-CD1 4.11Å; L288-F295 HydrophobicContact CG-CG 4.43Å; F295-T299 HydrophobicContact CD2-CG2 4.19Å; F295-T299 HydrophobicContact CE2-CG2 3.75Å; F295-T299 HydrophobicContact CZ-CG2 4.33Å; F295-L300 HydrophobicContact CD1-CB 3.94Å; F295-L300 HydrophobicContact CD1-CD1 4.08Å; F295-L300 HydrophobicContact CD1-CG 4.41Å; F295-L300 HydrophobicContact CE1-CB 3.36Å; F295-L300 HydrophobicContact CE1-CD1 3.75Å; F295-L300 HydrophobicContact CE1-CG 3.71Å; F295-L300 HydrophobicContact CZ-CB 4.19Å; F295-S303 WeakPolarHBondContact CZ-OG 3.22Å
296	P	86	Confident	89.7	Confident	25 Å²	25	50 Å²	50	16%	0.162	23%	0.226	C	C	.	.			trans	-72.9	149	-178.6	29.1	-32.1	0	0	0	111.1	Y294 K298 T299 L300	Y294-P296 HydrophobicContact CD1-CG 4.48Å; Y294-P296 HydrophobicContact CE1-CB 4.02Å; Y294-P296 HydrophobicContact CE1-CG 3.89Å; P296-K298 PolarHBondContact O-N 3.43Å; P296-K298 VanDerWaalsContact O-N 3.08Å; P296-T299 WeakPolarHBondContact CG-OG1 3.18Å; P296-T299 WeakPolarHBondContact O-CA 3.12Å; P296-T299 WeakPolarHBondContact O-CB 3.5Å; P296-T299 PolarHBondContact O-N 2.75Å; P296-L300 PolarHBondContact O-N 2.79Å
297	L	88.3	Confident	89.8	Confident	123 Å²	123	49.9 Å²	49.9	64%	0.644	23%	0.225	S	C	*	.	H	α-helix	trans	-54.9	-33.5	-177	-171.9	67.7	0	0	0	113.9	T299 L300 W301	L297-T299 VanDerWaalsContact C-N 3.31Å; L297-T299 PolarHBondContact O-N 3.36Å; L297-L300 HydrophobicContact CD1-CD2 4.3Å; L297-L300 WeakPolarHBondContact O-CB 3.47Å; L297-L300 PolarHBondContact O-N 2.93Å; L297-W301 PolarHBondContact O-N 3.48Å
298	K	88.3	Confident	89.9	Confident	169 Å²	169	54 Å²	54	74%	0.735	25%	0.247	S	C	*	.	H	α-helix	trans	-65.3	-35.1	174.9	-68.4	-175	179.3	-178.7	0	112.5	P296 R302	P296-K298 PolarHBondContact O-N 3.43Å; P296-K298 VanDerWaalsContact O-N 3.08Å; K298-R302 WeakPolarHBondContact O-CG 3.46Å; K298-R302 PolarHBondContact O-N 2.83Å
299	T	90.5	Very high	90.2	Very high	4 Å²	4	51.2 Å²	51.2	3%	0.025	23%	0.233	C	C	.	.	H	α-helix	trans	-74.4	-33.7	175.1	-59.7	0	0	0	0	110.6	E263 F295 P296 L297 R302 S303	E263-T299 HydrophobicContact CB-CG2 4.11Å; E263-T299 WeakPolarHBondContact CG-OG1 3.49Å; E263-T299 WeakPolarHBondContact O-CG2 3.29Å; F295-T299 HydrophobicContact CD2-CG2 4.19Å; F295-T299 HydrophobicContact CE2-CG2 3.75Å; F295-T299 HydrophobicContact CZ-CG2 4.33Å; P296-T299 WeakPolarHBondContact CG-OG1 3.18Å; P296-T299 WeakPolarHBondContact O-CA 3.12Å; P296-T299 WeakPolarHBondContact O-CB 3.5Å; P296-T299 PolarHBondContact O-N 2.75Å; L297-T299 VanDerWaalsContact C-N 3.31Å; L297-T299 PolarHBondContact O-N 3.36Å; T299-R302 PolarHBondContact O-N 2.83Å; T299-S303 WeakPolarHBondContact O-CB 3.44Å; T299-S303 PolarHBondContact O-N 3.48Å; T299-S303 PolarHBondContact O-OG 3.48Å
300	L	93.5	Very high	90.6	Very high	50 Å²	50	49.2 Å²	49.2	26%	0.262	22%	0.224	S	C	.	.	H	α-helix	trans	-55	-54.1	173.6	-173.5	139.4	0	0	0	112.2	V284 L288 F295 P296 L297 R302 S303 F304	V284-L300 HydrophobicContact CG1-CG 4.38Å; L288-L300 HydrophobicContact CD1-CD1 4.14Å; F295-L300 HydrophobicContact CD1-CB 3.94Å; F295-L300 HydrophobicContact CD1-CD1 4.08Å; F295-L300 HydrophobicContact CD1-CG 4.41Å; F295-L300 HydrophobicContact CE1-CB 3.36Å; F295-L300 HydrophobicContact CE1-CD1 3.75Å; F295-L300 HydrophobicContact CE1-CG 3.71Å; F295-L300 HydrophobicContact CZ-CB 4.19Å; P296-L300 PolarHBondContact O-N 2.79Å; L297-L300 HydrophobicContact CD1-CD2 4.3Å; L297-L300 WeakPolarHBondContact O-CB 3.47Å; L297-L300 PolarHBondContact O-N 2.93Å; L300-R302 VanDerWaalsContact C-N 3.34Å; L300-R302 PolarHBondContact O-N 3.49Å; L300-S303 PolarHBondContact O-N 3.17Å; L300-F304 PolarHBondContact O-N 2.98Å
301	W	93.7	Very high	90.9	Very high	153 Å²	153	49.3 Å²	49.3	58%	0.58	23%	0.225	S	C	*	.	H	α-helix	trans	-62.4	-38.2	177.8	-75.8	109.3	0	0	0	113.7	L297 F304 F305	L297-W301 PolarHBondContact O-N 3.48Å; W301-F304 PolarHBondContact O-N 3.48Å; W301-F305 PolarHBondContact O-N 2.93Å
302	R	94.1	Very high	91.3	Very high	38 Å²	38	55.8 Å²	55.8	14%	0.143	25%	0.253	C	S	.	.	H	α-helix	trans	-67.3	-38.3	176.8	-76.6	175.7	177.8	-175.4	-3.1	112.5	M83 K298 T299 L300 F305 A306	M83-R302 HydrophobicContact CE-CB 4.36Å; M83-R302 HydrophobicContact CG-CB 3.9Å; M83-R302 HydrophobicContact CG-CG 4.36Å; M83-R302 HydrophobicContact SD-CB 4.32Å; K298-R302 WeakPolarHBondContact O-CG 3.46Å; K298-R302 PolarHBondContact O-N 2.83Å; T299-R302 PolarHBondContact O-N 2.83Å; L300-R302 VanDerWaalsContact C-N 3.34Å; L300-R302 PolarHBondContact O-N 3.49Å; R302-F305 PolarHBondContact O-N 2.82Å; R302-A306 WeakPolarHBondContact O-CB 3.29Å; R302-A306 PolarHBondContact O-N 3.09Å
303	S	95.9	Very high	91.8	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-66.3	-44.1	176.8	-54	0	0	0	0	110.5	A267 F295 T299 L300 F305 A306 A307	A267-S303 VanDerWaalsContact CA-OG 3.26Å; A267-S303 WeakPolarHBondContact CA-OG 3.35Å; A267-S303 WeakPolarHBondContact CB-OG 3.27Å; F295-S303 WeakPolarHBondContact CZ-OG 3.22Å; T299-S303 WeakPolarHBondContact O-CB 3.44Å; T299-S303 PolarHBondContact O-N 3.48Å; T299-S303 PolarHBondContact O-OG 3.48Å; L300-S303 PolarHBondContact O-N 3.17Å; S303-F305 VanDerWaalsContact C-N 3.35Å; S303-F305 PolarHBondContact O-N 2.94Å; S303-A306 PolarHBondContact O-N 3.48Å; S303-A307 WeakPolarHBondContact O-CB 3.45Å; S303-A307 PolarHBondContact O-N 3.45Å
304	F	96.5	Very high	92.7	Very high	69 Å²	69	53.9 Å²	53.9	30%	0.303	24%	0.244	S	C	.	.	H	α-helix	trans	-59.2	-45	174.7	-174.8	-104.2	0	0	0	112.2	I281 V284 L300 W301 A307 L308	I281-F304 HydrophobicContact CG1-CE2 3.83Å; V284-F304 HydrophobicContact CG2-CB 4.11Å; V284-F304 HydrophobicContact CG2-CD2 4.29Å; L300-F304 PolarHBondContact O-N 2.98Å; W301-F304 PolarHBondContact O-N 3.48Å; F304-A307 PolarHBondContact O-N 3.32Å; F304-L308 WeakPolarHBondContact O-CB 3.45Å; F304-L308 PolarHBondContact O-N 3.31Å
305	F	97.4	Very high	93.4	Very high	66 Å²	66	54.3 Å²	54.3	29%	0.289	25%	0.245	S	C	.	.	H	α-helix	trans	-62.5	-45.1	175.3	178.7	-102.3	0	0	0	112.9	W80 M83 L84 W301 R302 S303 A307 L308 V309	W80-F305 HydrophobicContact CE3-CB 4.15Å; W80-F305 AromaticContact CE3-CD1 3.68Å; W80-F305 HydrophobicContact CE3-CD1 3.68Å; W80-F305 HydrophobicContact CE3-CD2 4.28Å; W80-F305 HydrophobicContact CE3-CE1 4.12Å; W80-F305 AromaticContact CE3-CG 3.77Å; W80-F305 HydrophobicContact CE3-CG 3.77Å; W80-F305 HydrophobicContact CZ3-CB 3.62Å; W80-F305 HydrophobicContact CZ3-CD1 4.06Å; W80-F305 HydrophobicContact CZ3-CD2 4.08Å; W80-F305 AromaticContact CZ3-CG 3.65Å; W80-F305 HydrophobicContact CZ3-CG 3.65Å; M83-F305 HydrophobicContact CB-CD1 3.84Å; M83-F305 HydrophobicContact CB-CE1 4.33Å; L84-F305 HydrophobicContact CB-CE1 4.12Å; L84-F305 HydrophobicContact CD1-CE1 4.49Å; L84-F305 HydrophobicContact CD1-CZ 4.23Å; W301-F305 PolarHBondContact O-N 2.93Å; R302-F305 PolarHBondContact O-N 2.82Å; S303-F305 VanDerWaalsContact C-N 3.35Å; S303-F305 PolarHBondContact O-N 2.94Å; F305-A307 PolarHBondContact O-N 3.03Å; F305-L308 PolarHBondContact O-N 3.41Å; F305-V309 HydrophobicContact CD1-CG2 4.46Å; F305-V309 HydrophobicContact CD2-CG2 4.48Å; F305-V309 HydrophobicContact CE1-CG2 4.1Å; F305-V309 HydrophobicContact CE2-CG2 4.12Å; F305-V309 HydrophobicContact CZ-CG2 3.92Å; F305-V309 VanDerWaalsContact O-CG2 3.29Å; F305-V309 WeakPolarHBondContact O-CG2 3.33Å; F305-V309 PolarHBondContact O-N 3.42Å
306	A	97.4	Very high	93.8	Very high	0 Å²	0	56.3 Å²	56.3	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-60.6	-44	176.7	0	0	0	0	0	112.1	M83 A271 R302 S303 V309 A310	M83-A306 HydrophobicContact CB-CB 4.01Å; M83-A306 HydrophobicContact CG-CB 4.39Å; M83-A306 HydrophobicContact SD-CB 4.03Å; A271-A306 HydrophobicContact CB-CB 4.28Å; R302-A306 WeakPolarHBondContact O-CB 3.29Å; R302-A306 PolarHBondContact O-N 3.09Å; S303-A306 PolarHBondContact O-N 3.48Å; A306-V309 PolarHBondContact O-N 2.91Å; A306-A310 WeakPolarHBondContact O-CB 3.22Å; A306-A310 PolarHBondContact O-N 2.86Å
307	A	97.3	Very high	94	Very high	0 Å²	0	58.3 Å²	58.3	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-61.8	-47.2	177.2	0	0	0	0	0	112	S274 P280 V284 S303 F304 F305 V309 A310 A311	S274-A307 PolarHBondContact OG-O 3.36Å; P280-A307 HydrophobicContact CB-CB 4.11Å; V284-A307 HydrophobicContact CG2-CB 4.32Å; S303-A307 WeakPolarHBondContact O-CB 3.45Å; S303-A307 PolarHBondContact O-N 3.45Å; F304-A307 PolarHBondContact O-N 3.32Å; F305-A307 PolarHBondContact O-N 3.03Å; A307-V309 PolarHBondContact O-N 3.03Å; A307-A310 WeakPolarHBondContact O-CB 3.46Å; A307-A310 PolarHBondContact O-N 3.28Å; A307-A310 VanDerWaalsContact O-N 3.17Å; A307-A311 PolarHBondContact O-N 3.3Å
308	L	96.4	Very high	93.9	Very high	87 Å²	87	55.1 Å²	55.1	46%	0.455	26%	0.255	S	S	.	.	H	α-helix	trans	-62.2	-42.4	178.2	-173.5	68	0	0	0	112.2	F304 F305 A310 A311 F312	F304-L308 WeakPolarHBondContact O-CB 3.45Å; F304-L308 PolarHBondContact O-N 3.31Å; F305-L308 PolarHBondContact O-N 3.41Å; L308-A310 VanDerWaalsContact C-N 3.32Å; L308-A311 PolarHBondContact O-N 3.47Å; L308-F312 VanDerWaalsContact O-CB 3.27Å; L308-F312 WeakPolarHBondContact O-CB 3.29Å; L308-F312 PolarHBondContact O-N 3.37Å
309	V	97.8	Very high	93.6	Very high	18 Å²	18	47.4 Å²	47.4	11%	0.109	22%	0.223	C	C	.	.	H	α-helix	trans	-62.5	-42.4	175.2	171.4	0	0	0	0	110.6	L84 L88 F305 A306 A307 F312 T313	L84-V309 HydrophobicContact CD1-CG1 3.98Å; L84-V309 HydrophobicContact CD1-CG2 3.96Å; L88-V309 HydrophobicContact CD2-CG1 4.19Å; L88-V309 HydrophobicContact CG-CG1 4Å; F305-V309 HydrophobicContact CD1-CG2 4.46Å; F305-V309 HydrophobicContact CD2-CG2 4.48Å; F305-V309 HydrophobicContact CE1-CG2 4.1Å; F305-V309 HydrophobicContact CE2-CG2 4.12Å; F305-V309 HydrophobicContact CZ-CG2 3.92Å; F305-V309 VanDerWaalsContact O-CG2 3.29Å; F305-V309 WeakPolarHBondContact O-CG2 3.33Å; F305-V309 PolarHBondContact O-N 3.42Å; A306-V309 PolarHBondContact O-N 2.91Å; A307-V309 PolarHBondContact O-N 3.03Å; V309-F312 PolarHBondContact O-N 3.29Å; V309-T313 WeakPolarHBondContact O-CB 3.26Å; V309-T313 PolarHBondContact O-N 2.87Å; V309-T313 PolarHBondContact O-OG1 2.97Å
310	A	97	Very high	92.9	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-64	-47.3	179.2	0	0	0	0	0	111.7	G87 A271 V275 A306 A307 L308 T313 L314	G87-A310 VanDerWaalsContact O-CA 3.3Å; G87-A310 WeakPolarHBondContact O-CA 3.4Å; A271-A310 HydrophobicContact CB-CB 4.14Å; V275-A310 HydrophobicContact CG1-CB 3.39Å; A306-A310 WeakPolarHBondContact O-CB 3.22Å; A306-A310 PolarHBondContact O-N 2.86Å; A307-A310 WeakPolarHBondContact O-CB 3.46Å; A307-A310 PolarHBondContact O-N 3.28Å; A307-A310 VanDerWaalsContact O-N 3.17Å; L308-A310 VanDerWaalsContact C-N 3.32Å; A310-T313 WeakPolarHBondContact O-CB 3.43Å; A310-T313 PolarHBondContact O-N 3.02Å; A310-L314 PolarHBondContact O-N 3.16Å
311	A	94.1	Very high	91.9	Very high	5 Å²	5	47.4 Å²	47.4	4%	0.041	23%	0.232	C	C	.	.	H	α-helix	trans	-60.8	-45.3	174.5	0	0	0	0	0	111.9	A307 L308 T313 L314 R315 L325	A307-A311 PolarHBondContact O-N 3.3Å; L308-A311 PolarHBondContact O-N 3.47Å; A311-T313 VanDerWaalsContact C-N 3.28Å; A311-T313 PolarHBondContact O-N 2.92Å; A311-L314 PolarHBondContact O-N 3.22Å; A311-R315 WeakPolarHBondContact O-CB 3.17Å; A311-R315 PolarHBondContact O-N 3.38Å; A311-L325 HydrophobicContact CB-CD1 4.33Å; A311-L325 HydrophobicContact CB-CD2 4.29Å; A311-L325 WeakPolarHBondContact O-CD2 3.41Å
312	F	94.8	Very high	90.9	Very high	140 Å²	140	43 Å²	43	61%	0.614	22%	0.22	S	C	*	.	H	α-helix	trans	-60.1	-39.8	176.5	178.6	-96.6	0	0	0	112.1	L308 V309 R315 S316	L308-F312 VanDerWaalsContact O-CB 3.27Å; L308-F312 WeakPolarHBondContact O-CB 3.29Å; L308-F312 PolarHBondContact O-N 3.37Å; V309-F312 PolarHBondContact O-N 3.29Å; F312-R315 PolarHBondContact O-N 2.87Å; F312-S316 WeakPolarHBondContact O-CB 3.09Å; F312-S316 PolarHBondContact O-N 3.01Å; F312-S316 PolarHBondContact O-OG 3.04Å
313	T	95.8	Very high	90	Very high	13 Å²	13	44.1 Å²	44.1	8%	0.08	23%	0.234	C	C	.	.	H	α-helix	trans	-65.3	-45.6	177.9	-53.8	0	0	0	0	110.8	T92 V309 A310 A311 S316 I317	T92-T313 HydrophobicContact CG2-CG2 3.75Å; V309-T313 WeakPolarHBondContact O-CB 3.26Å; V309-T313 PolarHBondContact O-N 2.87Å; V309-T313 PolarHBondContact O-OG1 2.97Å; A310-T313 WeakPolarHBondContact O-CB 3.43Å; A310-T313 PolarHBondContact O-N 3.02Å; A311-T313 VanDerWaalsContact C-N 3.28Å; A311-T313 PolarHBondContact O-N 2.92Å; T313-S316 WeakPolarHBondContact O-CB 3.06Å; T313-S316 PolarHBondContact O-N 3.47Å; T313-I317 HydrophobicContact CG2-CD1 4.49Å; T313-I317 WeakPolarHBondContact O-CG1 3.16Å; T313-I317 PolarHBondContact O-N 3.19Å; T313-I317 VanDerWaalsContact O-N 3.15Å
314	L	92.8	Very high	89.2	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-61	-45.4	176.1	-176.5	62.6	0	0	0	111.7	A94 V275 A310 A311 S316 I317 N318 P319 L325	A94-L314 HydrophobicContact CB-CD1 4.46Å; V275-L314 HydrophobicContact CB-CD2 4.22Å; V275-L314 WeakPolarHBondContact O-CD2 3.21Å; A310-L314 PolarHBondContact O-N 3.16Å; A311-L314 PolarHBondContact O-N 3.22Å; L314-S316 VanDerWaalsContact C-N 3.25Å; L314-S316 PolarHBondContact O-N 2.86Å; L314-I317 PolarHBondContact O-N 3.42Å; L314-I317 VanDerWaalsContact O-N 3.15Å; L314-N318 PolarHBondContact O-N 2.62Å; L314-N318 VanDerWaalsContact O-N 3.08Å; L314-P319 HydrophobicContact CD1-CG 4.13Å; L314-L325 HydrophobicContact CB-CD2 4.39Å
315	R	91.1	Very high	88.2	Confident	145 Å²	145	47.3 Å²	47.3	55%	0.547	25%	0.246	S	C	.	.	H	α-helix	trans	-58.5	-38.3	174.9	-171	170.8	178.4	159	0.8	112.4	A311 F312 I317 N318 L325	A311-R315 WeakPolarHBondContact O-CB 3.17Å; A311-R315 PolarHBondContact O-N 3.38Å; F312-R315 PolarHBondContact O-N 2.87Å; R315-I317 VanDerWaalsContact C-N 3.29Å; R315-I317 PolarHBondContact O-N 3.13Å; R315-N318 PolarHBondContact O-N 3.37Å; R315-L325 HydrophobicContact CB-CD2 3.65Å; R315-L325 HydrophobicContact CG-CD2 4.47Å
316	S	91.9	Very high	87.2	Confident	77 Å²	77	44.7 Å²	44.7	54%	0.538	24%	0.236	S	C	.	.	H	α-helix	trans	-69.6	-28.7	-179.5	-56.6	0	0	0	0	112.4	F312 T313 L314	F312-S316 WeakPolarHBondContact O-CB 3.09Å; F312-S316 PolarHBondContact O-N 3.01Å; F312-S316 PolarHBondContact O-OG 3.04Å; T313-S316 WeakPolarHBondContact O-CB 3.06Å; T313-S316 PolarHBondContact O-N 3.47Å; L314-S316 VanDerWaalsContact C-N 3.25Å; L314-S316 PolarHBondContact O-N 2.86Å
317	I	90.1	Very high	86	Confident	67 Å²	67	45.8 Å²	45.8	34%	0.344	24%	0.241	S	C	.	.	H	α-helix	trans	-76.2	-31.6	173.2	-66.1	167.6	0	0	0	110.9	T92 L99 T313 L314 R315	T92-I317 HydrophobicContact CG2-CD1 4.19Å; L99-I317 HydrophobicContact CD1-CG2 4.11Å; T313-I317 HydrophobicContact CG2-CD1 4.49Å; T313-I317 WeakPolarHBondContact O-CG1 3.16Å; T313-I317 PolarHBondContact O-N 3.19Å; T313-I317 VanDerWaalsContact O-N 3.15Å; L314-I317 PolarHBondContact O-N 3.42Å; L314-I317 VanDerWaalsContact O-N 3.15Å; R315-I317 VanDerWaalsContact C-N 3.29Å; R315-I317 PolarHBondContact O-N 3.13Å
318	N	86.6	Confident	85	Confident	56 Å²	56	46 Å²	46	30%	0.299	24%	0.242	S	C	.	.			trans	50.8	61.6	178.8	-170.2	25.5	0	0	0	113	L314 R315 F320 G321 N322 S323	L314-N318 PolarHBondContact O-N 2.62Å; L314-N318 VanDerWaalsContact O-N 3.08Å; R315-N318 PolarHBondContact O-N 3.37Å; N318-F320 VanDerWaalsContact C-N 3.25Å; N318-F320 PolarHBondContact O-N 2.93Å; N318-G321 WeakPolarHBondContact ND2-CA 3.49Å; N318-G321 PolarHBondContact ND2-O 3.32Å; N318-G321 PolarHBondContact O-N 3.17Å; N318-G321 VanDerWaalsContact O-N 3.15Å; N318-G321 WeakPolarHBondContact OD1-CA 3.44Å; N318-G321 PolarHBondContact OD1-N 2.97Å; N318-N322 PolarHBondContact OD1-N 3.34Å; N318-S323 WeakPolarHBondContact OD1-CA 3.32Å; N318-S323 PolarHBondContact OD1-N 2.87Å
319	P	81.5	Confident	84.3	Confident	7 Å²	7	44.5 Å²	44.5	5%	0.045	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-37.6	-172.5	24.4	-35.2	0	0	0	113.4	D98 L99 L314	D98-P319 HydrophobicContact CB-CB 4.04Å; D98-P319 HydrophobicContact CB-CG 4.48Å; L99-P319 HydrophobicContact CD1-CB 3.52Å; L99-P319 HydrophobicContact CG-CB 4.38Å; L314-P319 HydrophobicContact CD1-CG 4.13Å
320	F	75.1	Confident	83.5	Confident	13 Å²	13	44.2 Å²	44.2	6%	0.057	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	1.5	-176.2	-51.5	-65.2	0	0	0	113.8	D98 D102 W125 N318 N322 L327	D98-F320 HydrophobicContact CB-CZ 4.36Å; D102-F320 WeakPolarHBondContact OD2-CE1 2.94Å; W125-F320 WeakPolarHBondContact CH2-O 3.23Å; W125-F320 WeakPolarHBondContact CZ3-O 3.35Å; N318-F320 VanDerWaalsContact C-N 3.25Å; N318-F320 PolarHBondContact O-N 2.93Å; F320-N322 PolarHBondContact O-N 3.19Å; F320-L327 HydrophobicContact CD1-CB 4.33Å; F320-L327 HydrophobicContact CD1-CD1 3.96Å; F320-L327 HydrophobicContact CE1-CB 4.11Å; F320-L327 HydrophobicContact CE1-CD1 4.43Å; F320-L327 HydrophobicContact CE2-CB 4.41Å; F320-L327 HydrophobicContact CG-CD1 4.32Å; F320-L327 HydrophobicContact CZ-CB 4.17Å
321	G	73.1	Confident	82.7	Confident	41 Å²	41	48.3 Å²	48.3	42%	0.423	25%	0.248	S	C	.	.	S	Bend	trans	69.3	-13.4	-179.1	0	0	0	0	0	116.3	N318 S323	N318-G321 WeakPolarHBondContact ND2-CA 3.49Å; N318-G321 PolarHBondContact ND2-O 3.32Å; N318-G321 PolarHBondContact O-N 3.17Å; N318-G321 VanDerWaalsContact O-N 3.15Å; N318-G321 WeakPolarHBondContact OD1-CA 3.44Å; N318-G321 PolarHBondContact OD1-N 2.97Å; G321-S323 PolarHBondContact O-N 3.42Å
322	N	71.6	Confident	82	Confident	61 Å²	61	48.8 Å²	48.8	33%	0.326	25%	0.249	S	C	.	.	S	Bend	trans	-87.4	4.6	-175.8	66.4	7.8	0	0	0	114.6	N318 F320 R324	N318-N322 PolarHBondContact OD1-N 3.34Å; F320-N322 PolarHBondContact O-N 3.19Å; N322-R324 PolarHBondContact O-N 3.24Å; N322-R324 WeakPolarHBondContact OD1-CB 3.42Å; N322-R324 PolarHBondContact OD1-N 3Å; N322-R324 PolarHBondContact OD1-O 3.33Å
323	S	76.2	Confident	80.9	Confident	62 Å²	62	49.5 Å²	49.5	43%	0.434	25%	0.254	S	S	.	.	S	Bend	trans	61.5	3.9	-175.7	76.8	0	0	0	0	115.7	N318 G321	N318-S323 WeakPolarHBondContact OD1-CA 3.32Å; N318-S323 PolarHBondContact OD1-N 2.87Å; G321-S323 PolarHBondContact O-N 3.42Å
324	R	79.5	Confident	79.9	Confident	96 Å²	96	49.8 Å²	49.8	36%	0.362	26%	0.256	S	S	.	.	S	Bend	trans	-90.4	156.6	173.7	-56.9	-63.3	-175.1	161.6	5.1	109.5	N322 Y329 E331	N322-R324 PolarHBondContact O-N 3.24Å; N322-R324 WeakPolarHBondContact OD1-CB 3.42Å; N322-R324 PolarHBondContact OD1-N 3Å; N322-R324 PolarHBondContact OD1-O 3.33Å; R324-Y329 HydrophobicContact CG-CD1 4.19Å; R324-Y329 HydrophobicContact CG-CG 4.33Å; R324-Y329 PolarHBondContact NH1-OH 3.05Å; R324-Y329 VanDerWaalsContact NH1-OH 3.11Å; R324-E331 IonicContact CZ-OE1 3.65Å; R324-E331 IonicContact NH1-OE1 3.86Å; R324-E331 PolarHBondContact NH1-OE1 3.36Å; R324-E331 IonicContact NH2-OE1 2.58Å; R324-E331 PolarHBondContact NH2-OE1 2.92Å
325	L	74	Confident	79.3	Confident	39 Å²	39	53.2 Å²	53.2	20%	0.204	28%	0.278	C	S	.	.	S	Bend	trans	-77.7	-24.5	-177	-72.3	165.9	0	0	0	112.9	G278 A311 L314 R315	G278-L325 WeakPolarHBondContact O-CD1 3.5Å; A311-L325 HydrophobicContact CB-CD1 4.33Å; A311-L325 HydrophobicContact CB-CD2 4.29Å; A311-L325 WeakPolarHBondContact O-CD2 3.41Å; L314-L325 HydrophobicContact CB-CD2 4.39Å; R315-L325 HydrophobicContact CB-CD2 3.65Å; R315-L325 HydrophobicContact CG-CD2 4.47Å
326	V	78.1	Confident	79	Confident	11 Å²	11	48 Å²	48	7%	0.067	26%	0.258	C	S	.	.	S	Bend	trans	-142.2	150.5	-172.8	-160.3	0	0	0	0	109.4	F277 F328 L551	F277-V326 VanDerWaalsContact O-CG2 3.25Å; F277-V326 WeakPolarHBondContact O-CG2 3.45Å; V326-F328 VanDerWaalsContact C-N 3.32Å; V326-F328 HydrophobicContact CG1-CD1 3.68Å; V326-F328 HydrophobicContact CG1-CD2 4.37Å; V326-F328 HydrophobicContact CG1-CE1 3.25Å; V326-F328 HydrophobicContact CG1-CE2 4.02Å; V326-F328 HydrophobicContact CG1-CG 4.23Å; V326-F328 HydrophobicContact CG1-CZ 3.45Å; V326-F328 VanDerWaalsContact CG1-CZ 3.45Å; V326-F328 PolarHBondContact O-N 3.38Å; V326-L551 HydrophobicContact CB-CD2 4.09Å; V326-L551 HydrophobicContact CG1-CD2 4.41Å; V326-L551 HydrophobicContact CG2-CD2 3.85Å
327	L	71.3	Confident	78.8	Confident	23 Å²	23	48.2 Å²	48.2	12%	0.12	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-28.2	-177.3	-173.6	63.7	0	0	0	114.7	F320 E405 S408	F320-L327 HydrophobicContact CD1-CB 4.33Å; F320-L327 HydrophobicContact CD1-CD1 3.96Å; F320-L327 HydrophobicContact CE1-CB 4.11Å; F320-L327 HydrophobicContact CE1-CD1 4.43Å; F320-L327 HydrophobicContact CE2-CB 4.41Å; F320-L327 HydrophobicContact CG-CD1 4.32Å; F320-L327 HydrophobicContact CZ-CB 4.17Å; L327-E405 HydrophobicContact CD2-CG 3.96Å; L327-S408 PolarHBondContact O-OG 3.23Å
328	F	76.6	Confident	78.6	Confident	4 Å²	4	51.6 Å²	51.6	2%	0.018	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109	32.7	-172.6	52.1	-94.3	0	0	0	113.2	F277 V326 I407 F411 I479 L551	F277-F328 HydrophobicContact CD1-CZ 4.44Å; V326-F328 VanDerWaalsContact C-N 3.32Å; V326-F328 HydrophobicContact CG1-CD1 3.68Å; V326-F328 HydrophobicContact CG1-CD2 4.37Å; V326-F328 HydrophobicContact CG1-CE1 3.25Å; V326-F328 HydrophobicContact CG1-CE2 4.02Å; V326-F328 HydrophobicContact CG1-CG 4.23Å; V326-F328 HydrophobicContact CG1-CZ 3.45Å; V326-F328 VanDerWaalsContact CG1-CZ 3.45Å; V326-F328 PolarHBondContact O-N 3.38Å; F328-I407 HydrophobicContact CB-CG2 4.18Å; F328-I407 HydrophobicContact CD2-CG2 4.48Å; F328-I407 HydrophobicContact CG-CG2 4.19Å; F328-F411 HydrophobicContact CB-CD2 4.2Å; F328-F411 HydrophobicContact CD2-CD2 4.34Å; F328-F411 HydrophobicContact CD2-CE2 4.05Å; F328-I479 HydrophobicContact CE1-CD1 4.36Å; F328-L551 HydrophobicContact CD2-CD1 4.26Å; F328-L551 HydrophobicContact CD2-CD2 4.17Å; F328-L551 HydrophobicContact CE2-CD1 3.57Å; F328-L551 HydrophobicContact CE2-CD2 3.75Å; F328-L551 HydrophobicContact CE2-CG 4.27Å; F328-L551 HydrophobicContact CZ-CD2 4.5Å
329	Y	81.8	Confident	78.6	Confident	57 Å²	57	50.8 Å²	50.8	22%	0.224	27%	0.265	C	S	.	.			trans	-73.1	126.3	171.6	177.7	-83	0	0	0	110	R324 E331 L551	R324-Y329 HydrophobicContact CG-CD1 4.19Å; R324-Y329 HydrophobicContact CG-CG 4.33Å; R324-Y329 PolarHBondContact NH1-OH 3.05Å; R324-Y329 VanDerWaalsContact NH1-OH 3.11Å; Y329-E331 HydrophobicContact CE1-CG 3.61Å; Y329-E331 WeakPolarHBondContact CE1-OE1 3.39Å; Y329-E331 VanDerWaalsContact CZ-OE1 3.26Å; Y329-E331 WeakPolarHBondContact OH-CG 3.49Å; Y329-E331 PolarHBondContact OH-OE1 3.22Å; Y329-L551 WeakPolarHBondContact CD2-O 3.44Å; Y329-L551 WeakPolarHBondContact CE2-O 3.37Å
330	V	80.9	Confident	78.9	Confident	11 Å²	11	50.6 Å²	50.6	7%	0.067	26%	0.264	C	S	.	.			trans	-137.1	133.2	-177.9	-175.9	0	0	0	0	110.5	Y332 F411 N412 L551 T552	V330-Y332 HydrophobicContact CB-CE2 3.94Å; V330-Y332 HydrophobicContact CG1-CD1 4.46Å; V330-Y332 HydrophobicContact CG1-CD2 4.2Å; V330-Y332 HydrophobicContact CG1-CE1 3.99Å; V330-Y332 HydrophobicContact CG1-CE2 3.62Å; V330-F411 HydrophobicContact CG2-CB 3.65Å; V330-N412 VanDerWaalsContact CG2-OD1 3.32Å; V330-N412 WeakPolarHBondContact CG2-OD1 3.38Å; V330-L551 PolarHBondContact N-O 3.5Å; V330-T552 CarbonylContact O-C 2.99Å; V330-T552 WeakPolarHBondContact O-CA 3.44Å; V330-T552 VanDerWaalsContact O-O 3.12Å
331	E	80.5	Confident	79.7	Confident	86 Å²	86	52.2 Å²	52.2	40%	0.402	27%	0.273	S	S	.	.			trans	-105.3	125.1	172.6	-77.4	168.4	-151.1	0	0	108.9	R324 Y329	R324-E331 IonicContact CZ-OE1 3.65Å; R324-E331 IonicContact NH1-OE1 3.86Å; R324-E331 PolarHBondContact NH1-OE1 3.36Å; R324-E331 IonicContact NH2-OE1 2.58Å; R324-E331 PolarHBondContact NH2-OE1 2.92Å; Y329-E331 HydrophobicContact CE1-CG 3.61Å; Y329-E331 WeakPolarHBondContact CE1-OE1 3.39Å; Y329-E331 VanDerWaalsContact CZ-OE1 3.26Å; Y329-E331 WeakPolarHBondContact OH-CG 3.49Å; Y329-E331 PolarHBondContact OH-OE1 3.22Å
332	Y	79.8	Confident	80.6	Confident	16 Å²	16	54.9 Å²	54.9	6%	0.063	28%	0.28	C	S	.	.			trans	-106.2	135.1	176.3	-59.4	-89.3	0	0	0	109.7	V330 F411 D413 G523 M527 T552 Y557	V330-Y332 HydrophobicContact CB-CE2 3.94Å; V330-Y332 HydrophobicContact CG1-CD1 4.46Å; V330-Y332 HydrophobicContact CG1-CD2 4.2Å; V330-Y332 HydrophobicContact CG1-CE1 3.99Å; V330-Y332 HydrophobicContact CG1-CE2 3.62Å; Y332-F411 PolarHBondContact OH-O 3.25Å; Y332-D413 WeakPolarHBondContact CD1-OD2 3.39Å; Y332-D413 WeakPolarHBondContact CE1-OD2 3.17Å; Y332-G523 PolarHBondContact OH-O 2.89Å; Y332-M527 HydrophobicContact CD2-CE 3.71Å; Y332-M527 HydrophobicContact CE2-CE 2.99Å; Y332-M527 HydrophobicContact CE2-SD 3.44Å; Y332-M527 WeakPolarHBondContact CE2-SD 3.29Å; Y332-M527 WeakPolarHBondContact OH-CG 3.44Å; Y332-M527 PolarHBondContact OH-SD 3.06Å; Y332-M527 VanDerWaalsContact OH-SD 3.35Å; Y332-T552 HydrophobicContact CE2-CG2 4.31Å; Y332-Y557 WeakPolarHBondContact CB-OH 3.33Å; Y332-Y557 HydrophobicContact CD2-CE2 4.26Å; Y332-Y557 HydrophobicContact CG-CE2 4.49Å; Y332-Y557 PolarHBondContact O-OH 3.44Å
333	H	71.4	Confident	81.7	Confident	154 Å²	154	53 Å²	53	71%	0.713	27%	0.272	S	S	*	.			trans	-102.9	-9.3	-175.8	-61.5	-53.1	0	0	0	113.9
334	T	74.6	Confident	82.7	Confident	20 Å²	20	50 Å²	50	12%	0.123	25%	0.251	C	S	.	.	S	Bend	trans	-99.2	133	-177.8	52.2	0	0	0	0	112.3	D518 T521 Y557	T334-D518 HydrophobicContact CG2-CB 4.3Å; T334-D518 WeakPolarHBondContact CG2-OD2 3.26Å; T334-T521 WeakPolarHBondContact OG1-CG2 3.49Å; T334-Y557 PolarHBondContact O-OH 2.9Å; T334-Y557 VanDerWaalsContact O-OH 3.04Å
335	P	79.6	Confident	83.5	Confident	72 Å²	72	48.6 Å²	48.6	47%	0.468	25%	0.25	S	C	.	.	P	Polyproline II helix	trans	-72.6	145.8	177.1	30.8	-34.5	0	0	0	110.9
336	W	85.6	Confident	84.6	Confident	34 Å²	34	52 Å²	52	13%	0.129	27%	0.268	C	S	.	.	P	Polyproline II helix	trans	-85.4	156	173.7	70	-84.5	0	0	0	111.5	M338 F344 L524 E556 Y557 V559 P560	W336-M338 HydrophobicContact CH2-CE 3.32Å; W336-M338 HydrophobicContact CH2-SD 3.76Å; W336-M338 HydrophobicContact CZ2-CE 3.86Å; W336-M338 HydrophobicContact CZ3-CE 3.93Å; W336-M338 HydrophobicContact CZ3-SD 3.97Å; W336-F344 HydrophobicContact CE3-CE2 4.42Å; W336-L524 HydrophobicContact CB-CD2 3.93Å; W336-E556 PolarHBondContact NE1-O 2.93Å; W336-Y557 AromaticContact CD1-CD1 3.94Å; W336-V559 HydrophobicContact CH2-CB 4.19Å; W336-V559 HydrophobicContact CH2-CG1 3.8Å; W336-V559 HydrophobicContact CZ2-CB 3.72Å; W336-V559 HydrophobicContact CZ2-CG1 3.86Å; W336-V559 HydrophobicContact CZ2-CG2 4.46Å; W336-P560 HydrophobicContact CD2-CG 4.07Å; W336-P560 HydrophobicContact CG-CG 4.28Å
337	Y	86.4	Confident	85.5	Confident	82 Å²	82	51.8 Å²	51.8	32%	0.322	27%	0.266	S	S	.	.			trans	-113.5	150.5	-177.2	-61.8	-90.7	0	0	0	112.7	A339 E340 W512	Y337-A339 PolarHBondContact O-N 3.46Å; Y337-A339 VanDerWaalsContact O-N 3.07Å; Y337-E340 VanDerWaalsContact O-CB 3.29Å; Y337-E340 WeakPolarHBondContact O-CB 3.29Å; Y337-E340 PolarHBondContact O-N 2.87Å; Y337-W512 VanDerWaalsContact CB-CE3 3.42Å; Y337-W512 HydrophobicContact CD1-CB 3.61Å; Y337-W512 HydrophobicContact CD1-CD2 4.44Å; Y337-W512 HydrophobicContact CD1-CE3 4.13Å; Y337-W512 HydrophobicContact CD1-CG 4.31Å; Y337-W512 HydrophobicContact CD2-CD2 4.27Å; Y337-W512 AromaticContact CD2-CE3 3.24Å; Y337-W512 HydrophobicContact CD2-CE3 3.24Å; Y337-W512 AromaticContact CD2-CZ3 3.74Å; Y337-W512 HydrophobicContact CD2-CZ3 3.74Å; Y337-W512 HydrophobicContact CE1-CB 3.8Å; Y337-W512 AromaticContact CE2-CE3 3.94Å; Y337-W512 HydrophobicContact CE2-CE3 3.94Å; Y337-W512 HydrophobicContact CG-CB 4.06Å; Y337-W512 AromaticContact CG-CD2 3.96Å; Y337-W512 HydrophobicContact CG-CD2 3.96Å; Y337-W512 AromaticContact CG-CE3 3.33Å; Y337-W512 HydrophobicContact CG-CE3 3.33Å; Y337-W512 HydrophobicContact CG-CG 4.31Å; Y337-W512 HydrophobicContact CG-CZ3 4.04Å
338	M	86.3	Confident	86.8	Confident	138 Å²	138	50.7 Å²	50.7	68%	0.68	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-58.4	-27.2	-177.2	-68.8	-68.1	147	0	0	114.4	W336 E340 L341	W336-M338 HydrophobicContact CH2-CE 3.32Å; W336-M338 HydrophobicContact CH2-SD 3.76Å; W336-M338 HydrophobicContact CZ2-CE 3.86Å; W336-M338 HydrophobicContact CZ3-CE 3.93Å; W336-M338 HydrophobicContact CZ3-SD 3.97Å; M338-E340 VanDerWaalsContact C-N 3.28Å; M338-E340 PolarHBondContact O-N 2.92Å; M338-L341 WeakPolarHBondContact O-CB 3.36Å; M338-L341 PolarHBondContact O-N 2.92Å
339	A	85.8	Confident	87.8	Confident	39 Å²	39	52.9 Å²	52.9	32%	0.322	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-67.6	-28.9	176.1	0	0	0	0	0	112.7	Y337 L341 V342 W512	Y337-A339 PolarHBondContact O-N 3.46Å; Y337-A339 VanDerWaalsContact O-N 3.07Å; A339-L341 PolarHBondContact O-N 3.37Å; A339-V342 PolarHBondContact O-N 3.21Å; A339-W512 HydrophobicContact CB-CH2 4.18Å; A339-W512 HydrophobicContact CB-CZ2 3.42Å; A339-W512 VanDerWaalsContact CB-CZ2 3.42Å
340	E	89	Confident	88.5	Confident	3 Å²	3	53.6 Å²	53.6	1%	0.014	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-69.5	-14.7	175.3	-55.5	-163	124	0	0	112.9	Y337 M338 V342 P343 F344 W512 Y525	Y337-E340 VanDerWaalsContact O-CB 3.29Å; Y337-E340 WeakPolarHBondContact O-CB 3.29Å; Y337-E340 PolarHBondContact O-N 2.87Å; M338-E340 VanDerWaalsContact C-N 3.28Å; M338-E340 PolarHBondContact O-N 2.92Å; E340-V342 PolarHBondContact O-N 3.28Å; E340-P343 WeakPolarHBondContact O-CD 3.4Å; E340-P343 WeakPolarHBondContact O-CG 3.23Å; E340-F344 HydrophobicContact CB-CD2 4.21Å; E340-F344 HydrophobicContact CB-CE2 3.59Å; E340-F344 HydrophobicContact CB-CZ 3.85Å; E340-F344 WeakPolarHBondContact O-CD2 3.43Å; E340-F344 WeakPolarHBondContact O-CG 3.19Å; E340-F344 PolarHBondContact O-N 3.01Å; E340-F344 VanDerWaalsContact O-N 3.1Å; E340-W512 HydrophobicContact CG-CH2 3.55Å; E340-W512 HydrophobicContact CG-CZ3 3.6Å; E340-Y525 WeakPolarHBondContact CB-OH 3.46Å; E340-Y525 VanDerWaalsContact CD-OH 3.3Å; E340-Y525 WeakPolarHBondContact CG-OH 3.46Å; E340-Y525 PolarHBondContact OE1-OH 3.28Å
341	L	91.5	Very high	89.3	Confident	47 Å²	47	53.1 Å²	53.1	25%	0.246	28%	0.275	C	S	.	.	H	α-helix	trans	-60.1	-31.2	174.9	-167.9	64.8	0	0	0	112.1	M338 A339 F344 I345 A563	M338-L341 WeakPolarHBondContact O-CB 3.36Å; M338-L341 PolarHBondContact O-N 2.92Å; A339-L341 PolarHBondContact O-N 3.37Å; L341-F344 PolarHBondContact O-N 3.5Å; L341-I345 HydrophobicContact CD2-CD1 4.46Å; L341-I345 HydrophobicContact CG-CD1 3.97Å; L341-I345 HydrophobicContact CG-CG1 4.4Å; L341-I345 WeakPolarHBondContact O-CB 3.33Å; L341-I345 VanDerWaalsContact O-CG1 3.24Å; L341-I345 WeakPolarHBondContact O-CG1 3.33Å; L341-I345 PolarHBondContact O-N 3.35Å; L341-A563 HydrophobicContact CD1-CB 3.7Å
342	V	93	Very high	90.1	Very high	97 Å²	97	49 Å²	49	59%	0.588	26%	0.256	S	S	*	.	H	α-helix	trans	-63	-56.9	178.2	178.3	0	0	0	0	111.5	A339 E340 F344 I345 L346	A339-V342 PolarHBondContact O-N 3.21Å; E340-V342 PolarHBondContact O-N 3.28Å; V342-F344 VanDerWaalsContact C-N 3.28Å; V342-F344 PolarHBondContact O-N 3.24Å; V342-I345 PolarHBondContact O-N 3.43Å; V342-L346 WeakPolarHBondContact O-CG 3.48Å; V342-L346 PolarHBondContact O-N 3.1Å
343	P	94.1	Very high	90.9	Very high	22 Å²	22	52.1 Å²	52.1	14%	0.143	27%	0.274	C	S	.	.	H	α-helix	trans	-63.9	-30.8	175.8	24.2	-33.7	0	0	0	113.1	E340 L346 L347 V492 V496 Y525	E340-P343 WeakPolarHBondContact O-CD 3.4Å; E340-P343 WeakPolarHBondContact O-CG 3.23Å; P343-L346 PolarHBondContact O-N 3.27Å; P343-L347 WeakPolarHBondContact O-CG 3.38Å; P343-L347 PolarHBondContact O-N 3.05Å; P343-V492 HydrophobicContact CB-CG1 4.34Å; P343-V496 HydrophobicContact CB-CG2 4.43Å; P343-Y525 HydrophobicContact CB-CE1 3.87Å; P343-Y525 HydrophobicContact CG-CE1 3.75Å
344	F	95.9	Very high	92.1	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-63.1	-41.2	172.3	-62.7	-30.7	0	0	0	113	W336 E340 L341 V342 L346 L347 G348 L524 Y525 V528 P560 A564	W336-F344 HydrophobicContact CE3-CE2 4.42Å; E340-F344 HydrophobicContact CB-CD2 4.21Å; E340-F344 HydrophobicContact CB-CE2 3.59Å; E340-F344 HydrophobicContact CB-CZ 3.85Å; E340-F344 WeakPolarHBondContact O-CD2 3.43Å; E340-F344 WeakPolarHBondContact O-CG 3.19Å; E340-F344 PolarHBondContact O-N 3.01Å; E340-F344 VanDerWaalsContact O-N 3.1Å; L341-F344 PolarHBondContact O-N 3.5Å; V342-F344 VanDerWaalsContact C-N 3.28Å; V342-F344 PolarHBondContact O-N 3.24Å; F344-L346 VanDerWaalsContact C-N 3.34Å; F344-L347 PolarHBondContact O-N 2.82Å; F344-G348 PolarHBondContact O-N 2.94Å; F344-L524 HydrophobicContact CZ-CD2 4.04Å; F344-L524 HydrophobicContact CZ-CG 4.24Å; F344-Y525 HydrophobicContact CD1-CD1 4.11Å; F344-Y525 HydrophobicContact CD1-CE1 4.1Å; F344-Y525 AromaticContact CE1-CD1 3.71Å; F344-Y525 HydrophobicContact CE1-CD1 3.71Å; F344-Y525 AromaticContact CE1-CD2 3.81Å; F344-Y525 HydrophobicContact CE1-CD2 3.81Å; F344-Y525 AromaticContact CE1-CE1 3.68Å; F344-Y525 HydrophobicContact CE1-CE1 3.68Å; F344-Y525 AromaticContact CE1-CE2 3.75Å; F344-Y525 HydrophobicContact CE1-CE2 3.75Å; F344-Y525 AromaticContact CE1-CG 3.78Å; F344-Y525 HydrophobicContact CE1-CG 3.78Å; F344-Y525 AromaticContact CE1-CZ 3.7Å; F344-Y525 HydrophobicContact CZ-CD2 4.33Å; F344-Y525 HydrophobicContact CZ-CE1 4.47Å; F344-Y525 AromaticContact CZ-CE2 3.97Å; F344-Y525 HydrophobicContact CZ-CE2 3.97Å; F344-V528 HydrophobicContact CB-CG1 3.95Å; F344-V528 HydrophobicContact CD1-CB 4.01Å; F344-V528 HydrophobicContact CD1-CG1 3.73Å; F344-V528 HydrophobicContact CD1-CG2 3.99Å; F344-V528 HydrophobicContact CE1-CB 4.36Å; F344-V528 HydrophobicContact CE1-CG2 4.04Å; F344-V528 HydrophobicContact CG-CG1 4.01Å; F344-V528 HydrophobicContact CG-CG2 4.43Å; F344-P560 HydrophobicContact CD2-CB 3.32Å; F344-P560 HydrophobicContact CD2-CG 4.5Å; F344-P560 HydrophobicContact CE2-CB 3.54Å; F344-P560 HydrophobicContact CE2-CG 4.3Å; F344-P560 HydrophobicContact CG-CB 4.12Å; F344-P560 HydrophobicContact CZ-CB 4.47Å; F344-A564 WeakPolarHBondContact O-CB 3.32Å
345	I	96.8	Very high	93.1	Very high	65 Å²	65	44.3 Å²	44.3	33%	0.333	24%	0.236	S	C	.	.	H	α-helix	trans	-64.5	-40.2	173.9	-71.9	168.6	0	0	0	110.5	L341 V342 L347 G348 V349 T567	L341-I345 HydrophobicContact CD2-CD1 4.46Å; L341-I345 HydrophobicContact CG-CD1 3.97Å; L341-I345 HydrophobicContact CG-CG1 4.4Å; L341-I345 WeakPolarHBondContact O-CB 3.33Å; L341-I345 VanDerWaalsContact O-CG1 3.24Å; L341-I345 WeakPolarHBondContact O-CG1 3.33Å; L341-I345 PolarHBondContact O-N 3.35Å; V342-I345 PolarHBondContact O-N 3.43Å; I345-L347 PolarHBondContact O-N 2.77Å; I345-G348 CarbonylContact O-C 3.44Å; I345-G348 VanDerWaalsContact O-CA 3.29Å; I345-G348 WeakPolarHBondContact O-CA 3.26Å; I345-G348 PolarHBondContact O-N 2.98Å; I345-V349 WeakPolarHBondContact O-CG2 3.37Å; I345-V349 PolarHBondContact O-N 3.09Å; I345-T567 HydrophobicContact CG2-CG2 4.05Å
346	L	97.1	Very high	93.9	Very high	111 Å²	111	41.6 Å²	41.6	58%	0.581	22%	0.217	S	C	*	.	H	α-helix	trans	-63.1	-40.3	176	-68	176	0	0	0	112.2	V342 P343 F344 G348 V349 F350	V342-L346 WeakPolarHBondContact O-CG 3.48Å; V342-L346 PolarHBondContact O-N 3.1Å; P343-L346 PolarHBondContact O-N 3.27Å; F344-L346 VanDerWaalsContact C-N 3.34Å; L346-G348 VanDerWaalsContact C-N 3.28Å; L346-G348 PolarHBondContact O-N 3.43Å; L346-V349 PolarHBondContact O-N 3.33Å; L346-F350 PolarHBondContact O-N 3.24Å
347	L	97.3	Very high	94.4	Very high	6 Å²	6	44.7 Å²	44.7	3%	0.031	24%	0.236	C	C	.	.	H	α-helix	trans	-61.5	-38.4	170.3	-73.1	173.9	0	0	0	111.3	P343 F344 I345 F350 G351 V492 Y525 V528 A532	P343-L347 WeakPolarHBondContact O-CG 3.38Å; P343-L347 PolarHBondContact O-N 3.05Å; F344-L347 PolarHBondContact O-N 2.82Å; I345-L347 PolarHBondContact O-N 2.77Å; L347-F350 PolarHBondContact O-N 3.47Å; L347-G351 PolarHBondContact O-N 3.37Å; L347-V492 HydrophobicContact CD2-CB 4.18Å; L347-V492 HydrophobicContact CD2-CG2 3.88Å; L347-Y525 HydrophobicContact CD1-CD1 4.19Å; L347-V528 HydrophobicContact CD1-CG1 4.45Å; L347-A532 WeakPolarHBondContact O-CB 3.22Å
348	G	97.8	Very high	94.9	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-54.6	-52.6	169.1	0	0	0	0	0	112.6	F344 I345 L346 F350 G351 G352 A564 S568	F344-G348 PolarHBondContact O-N 2.94Å; I345-G348 CarbonylContact O-C 3.44Å; I345-G348 VanDerWaalsContact O-CA 3.29Å; I345-G348 WeakPolarHBondContact O-CA 3.26Å; I345-G348 PolarHBondContact O-N 2.98Å; L346-G348 VanDerWaalsContact C-N 3.28Å; L346-G348 PolarHBondContact O-N 3.43Å; G348-F350 VanDerWaalsContact C-N 3.34Å; G348-F350 PolarHBondContact O-N 3.33Å; G348-G351 PolarHBondContact O-N 3.43Å; G348-G352 PolarHBondContact O-N 2.88Å; G348-A564 WeakPolarHBondContact CA-O 3.48Å; G348-S568 WeakPolarHBondContact O-CA 3.43Å; G348-S568 VanDerWaalsContact O-CB 3.22Å; G348-S568 WeakPolarHBondContact O-CB 3.41Å
349	V	98.3	Very high	95.3	Very high	51 Å²	51	34.8 Å²	34.8	31%	0.309	19%	0.192	S	C	.	.	H	α-helix	trans	-59	-45.7	177.8	176.4	0	0	0	0	111.2	I345 L346 G351 G352 L353 T567 V571	I345-V349 WeakPolarHBondContact O-CG2 3.37Å; I345-V349 PolarHBondContact O-N 3.09Å; L346-V349 PolarHBondContact O-N 3.33Å; V349-G351 PolarHBondContact O-N 3.35Å; V349-G352 PolarHBondContact O-N 2.92Å; V349-L353 HydrophobicContact CG1-CD1 4.06Å; V349-L353 HydrophobicContact CG1-CG 4.44Å; V349-L353 WeakPolarHBondContact O-CG 3.16Å; V349-L353 PolarHBondContact O-N 3.12Å; V349-T567 HydrophobicContact CG2-CG2 3.87Å; V349-V571 HydrophobicContact CB-CG2 4.47Å; V349-V571 HydrophobicContact CG1-CG2 4.41Å; V349-V571 HydrophobicContact CG2-CG2 4.17Å
350	F	97.6	Very high	95.7	Very high	72 Å²	72	40 Å²	40	32%	0.316	20%	0.203	S	C	.	.	H	α-helix	trans	-57.9	-47.3	175.4	172.9	-99	0	0	0	111.8	L346 L347 G348 G352 L353 W354 A488	L346-F350 PolarHBondContact O-N 3.24Å; L347-F350 PolarHBondContact O-N 3.47Å; G348-F350 VanDerWaalsContact C-N 3.34Å; G348-F350 PolarHBondContact O-N 3.33Å; F350-G352 VanDerWaalsContact C-N 3.31Å; F350-G352 PolarHBondContact O-N 2.85Å; F350-L353 PolarHBondContact O-N 3.12Å; F350-W354 WeakPolarHBondContact O-CB 3.22Å; F350-W354 PolarHBondContact O-N 3.19Å; F350-A488 HydrophobicContact CD1-CB 4.09Å; F350-A488 HydrophobicContact CE1-CB 3.52Å; F350-A488 HydrophobicContact CZ-CB 4.07Å
351	G	97.1	Very high	96	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-59.4	-39.1	178.2	0	0	0	0	0	113.2	L347 G348 V349 G355 S568	L347-G351 PolarHBondContact O-N 3.37Å; G348-G351 PolarHBondContact O-N 3.43Å; V349-G351 PolarHBondContact O-N 3.35Å; G351-G355 PolarHBondContact O-N 3.01Å; G351-S568 VanDerWaalsContact C-OG 3.24Å
352	G	97.1	Very high	96.2	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-71.3	-40.5	178.3	0	0	0	0	0	113.4	G348 V349 F350 T356 S568	G348-G352 PolarHBondContact O-N 2.88Å; V349-G352 PolarHBondContact O-N 2.92Å; F350-G352 VanDerWaalsContact C-N 3.31Å; F350-G352 PolarHBondContact O-N 2.85Å; G352-T356 WeakPolarHBondContact O-CB 3.35Å; G352-T356 PolarHBondContact O-N 3.47Å; G352-T356 PolarHBondContact O-OG1 2.93Å; G352-S568 VanDerWaalsContact CA-O 3.25Å; G352-S568 WeakPolarHBondContact CA-O 3.42Å; G352-S568 WeakPolarHBondContact CA-OG 3.05Å; G352-S568 PolarHBondContact N-OG 3.22Å
353	L	97.2	Very high	96.2	Very high	82 Å²	82	35.5 Å²	35.5	43%	0.429	18%	0.18	S	C	.	.	H	α-helix	trans	-65.3	-45.2	174.4	-69.4	175.5	0	0	0	111.4	V349 F350 T356 L357 V571 F575	V349-L353 HydrophobicContact CG1-CD1 4.06Å; V349-L353 HydrophobicContact CG1-CG 4.44Å; V349-L353 WeakPolarHBondContact O-CG 3.16Å; V349-L353 PolarHBondContact O-N 3.12Å; F350-L353 PolarHBondContact O-N 3.12Å; L353-T356 PolarHBondContact O-N 3.45Å; L353-L357 WeakPolarHBondContact O-CB 3.31Å; L353-L357 PolarHBondContact O-N 3.07Å; L353-V571 HydrophobicContact CD2-CG1 4.02Å; L353-V571 HydrophobicContact CG-CG1 4.02Å; L353-F575 HydrophobicContact CD2-CD2 4.47Å; L353-F575 HydrophobicContact CD2-CE2 3.62Å; L353-F575 HydrophobicContact CD2-CZ 4.06Å
354	W	95.9	Very high	96.1	Very high	10 Å²	10	37.3 Å²	37.3	4%	0.038	20%	0.196	C	C	.	.	H	α-helix	trans	-59.2	-50.3	174.1	164.1	-119.4	0	0	0	111.3	F350 T356 L357 F358 I462 I466 V484	F350-W354 WeakPolarHBondContact O-CB 3.22Å; F350-W354 PolarHBondContact O-N 3.19Å; W354-T356 VanDerWaalsContact C-N 3.28Å; W354-T356 PolarHBondContact O-N 2.61Å; W354-L357 HydrophobicContact CE3-CD2 4.37Å; W354-L357 HydrophobicContact CZ3-CD2 4.45Å; W354-L357 PolarHBondContact O-N 3.22Å; W354-F358 HydrophobicContact CD2-CB 4.38Å; W354-F358 HydrophobicContact CE3-CB 4.36Å; W354-F358 HydrophobicContact CH2-CB 3.96Å; W354-F358 AromaticContact CH2-CD2 3.77Å; W354-F358 HydrophobicContact CH2-CD2 3.77Å; W354-F358 HydrophobicContact CH2-CG 4.29Å; W354-F358 HydrophobicContact CZ2-CB 4Å; W354-F358 AromaticContact CZ2-CD2 3.79Å; W354-F358 HydrophobicContact CZ2-CD2 3.79Å; W354-F358 HydrophobicContact CZ2-CG 4.17Å; W354-F358 HydrophobicContact CZ3-CB 4.11Å; W354-F358 WeakPolarHBondContact O-CB 3.44Å; W354-F358 PolarHBondContact O-N 3.06Å; W354-I462 HydrophobicContact CD2-CG1 4.42Å; W354-I462 HydrophobicContact CE3-CG1 4.04Å; W354-I462 HydrophobicContact CE3-CG2 4.23Å; W354-I462 HydrophobicContact CH2-CB 4.07Å; W354-I462 HydrophobicContact CH2-CG1 4.04Å; W354-I462 HydrophobicContact CH2-CG2 4.04Å; W354-I462 VanDerWaalsContact CH2-O 3.29Å; W354-I462 WeakPolarHBondContact CH2-O 3.29Å; W354-I462 HydrophobicContact CZ2-CG1 4.39Å; W354-I462 HydrophobicContact CZ3-CB 3.98Å; W354-I462 HydrophobicContact CZ3-CG1 3.88Å; W354-I462 HydrophobicContact CZ3-CG2 3.54Å; W354-I466 HydrophobicContact CH2-CD1 4.4Å; W354-I466 HydrophobicContact CH2-CG1 4.23Å; W354-I466 HydrophobicContact CZ3-CD1 4.35Å; W354-V484 HydrophobicContact CD2-CG1 4.25Å; W354-V484 HydrophobicContact CG-CG1 4.32Å; W354-V484 HydrophobicContact CZ2-CG1 4.4Å; W354-V484 HydrophobicContact CZ2-CG2 4.25Å
355	G	96.3	Very high	96	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-57.2	-42.5	179.1	0	0	0	0	0	112.6	G351 F358 I359	G351-G355 PolarHBondContact O-N 3.01Å; G355-F358 PolarHBondContact O-N 3.4Å; G355-I359 WeakPolarHBondContact O-CD1 3.43Å; G355-I359 WeakPolarHBondContact O-CG1 3.5Å; G355-I359 PolarHBondContact O-N 3.36Å
356	T	96	Very high	95.7	Very high	14 Å²	14	38.4 Å²	38.4	9%	0.086	20%	0.197	C	C	.	.	H	α-helix	trans	-62.7	-48.9	175.4	-59.6	0	0	0	0	112.3	G352 L353 W354 F358 I359 R360 A572 F575	G352-T356 WeakPolarHBondContact O-CB 3.35Å; G352-T356 PolarHBondContact O-N 3.47Å; G352-T356 PolarHBondContact O-OG1 2.93Å; L353-T356 PolarHBondContact O-N 3.45Å; W354-T356 VanDerWaalsContact C-N 3.28Å; W354-T356 PolarHBondContact O-N 2.61Å; T356-F358 VanDerWaalsContact C-N 3.34Å; T356-I359 PolarHBondContact O-N 2.99Å; T356-R360 PolarHBondContact O-N 3.47Å; T356-R360 VanDerWaalsContact O-N 3.09Å; T356-A572 WeakPolarHBondContact OG1-CA 3.49Å; T356-F575 HydrophobicContact CG2-CB 3.34Å; T356-F575 HydrophobicContact CG2-CD2 4.27Å; T356-F575 HydrophobicContact CG2-CG 3.89Å
357	L	95.8	Very high	95.4	Very high	99 Å²	99	40.3 Å²	40.3	52%	0.518	20%	0.197	S	C	.	.	H	α-helix	trans	-59.3	-47.8	178.4	175.1	63.8	0	0	0	110.6	L353 W354 R360 A361	L353-L357 WeakPolarHBondContact O-CB 3.31Å; L353-L357 PolarHBondContact O-N 3.07Å; W354-L357 HydrophobicContact CE3-CD2 4.37Å; W354-L357 HydrophobicContact CZ3-CD2 4.45Å; W354-L357 PolarHBondContact O-N 3.22Å; L357-R360 PolarHBondContact O-N 3.39Å; L357-A361 WeakPolarHBondContact O-CB 3Å; L357-A361 PolarHBondContact O-N 2.87Å
358	F	96.3	Very high	95	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-58.5	-51.6	179.3	174.9	-94	0	0	0	111.6	W354 G355 T356 R360 A361 N362 I466 F469 L477 V537 I580	W354-F358 HydrophobicContact CD2-CB 4.38Å; W354-F358 HydrophobicContact CE3-CB 4.36Å; W354-F358 HydrophobicContact CH2-CB 3.96Å; W354-F358 AromaticContact CH2-CD2 3.77Å; W354-F358 HydrophobicContact CH2-CD2 3.77Å; W354-F358 HydrophobicContact CH2-CG 4.29Å; W354-F358 HydrophobicContact CZ2-CB 4Å; W354-F358 AromaticContact CZ2-CD2 3.79Å; W354-F358 HydrophobicContact CZ2-CD2 3.79Å; W354-F358 HydrophobicContact CZ2-CG 4.17Å; W354-F358 HydrophobicContact CZ3-CB 4.11Å; W354-F358 WeakPolarHBondContact O-CB 3.44Å; W354-F358 PolarHBondContact O-N 3.06Å; G355-F358 PolarHBondContact O-N 3.4Å; T356-F358 VanDerWaalsContact C-N 3.34Å; F358-R360 PolarHBondContact O-N 2.87Å; F358-A361 PolarHBondContact O-N 3.07Å; F358-N362 HydrophobicContact CE1-CB 4.4Å; F358-N362 HydrophobicContact CZ-CB 4.27Å; F358-N362 WeakPolarHBondContact O-CB 3.36Å; F358-N362 PolarHBondContact O-N 2.85Å; F358-I466 HydrophobicContact CD2-CG1 3.79Å; F358-I466 HydrophobicContact CE2-CG1 4.28Å; F358-F469 HydrophobicContact CZ-CB 4.1Å; F358-F469 HydrophobicContact CZ-CD1 4.22Å; F358-F469 HydrophobicContact CZ-CG 4.36Å; F358-L477 HydrophobicContact CE1-CD1 3.92Å; F358-L477 HydrophobicContact CE1-CD2 3.55Å; F358-L477 HydrophobicContact CE1-CG 4.34Å; F358-L477 HydrophobicContact CE2-CD1 4.14Å; F358-L477 HydrophobicContact CZ-CD1 3.44Å; F358-L477 VanDerWaalsContact CZ-CD1 3.44Å; F358-L477 HydrophobicContact CZ-CD2 3.89Å; F358-L477 HydrophobicContact CZ-CG 4.31Å; F358-V537 HydrophobicContact CD1-CG1 4Å; F358-V537 HydrophobicContact CD1-CG2 4.22Å; F358-V537 HydrophobicContact CE1-CG1 4.12Å; F358-I580 HydrophobicContact CD1-CD1 4.41Å; F358-I580 HydrophobicContact CE1-CD1 3.81Å; F358-I580 HydrophobicContact CE1-CG1 4.09Å
359	I	95.3	Very high	94.5	Very high	13 Å²	13	47.9 Å²	47.9	7%	0.067	23%	0.225	C	C	.	.	H	α-helix	trans	-60.2	-50.1	-178.7	-67	163.6	0	0	0	110.3	G355 T356 A361 N362 I363 I580	G355-I359 WeakPolarHBondContact O-CD1 3.43Å; G355-I359 WeakPolarHBondContact O-CG1 3.5Å; G355-I359 PolarHBondContact O-N 3.36Å; T356-I359 PolarHBondContact O-N 2.99Å; I359-A361 PolarHBondContact O-N 3.25Å; I359-N362 PolarHBondContact O-N 2.91Å; I359-I363 HydrophobicContact CG2-CG1 4.28Å; I359-I363 WeakPolarHBondContact O-CB 3.48Å; I359-I363 WeakPolarHBondContact O-CG1 3.43Å; I359-I363 PolarHBondContact O-N 3.39Å; I359-I580 HydrophobicContact CG1-CB 4.15Å; I359-I580 HydrophobicContact CG1-CD1 4.21Å
360	R	94.7	Very high	93.7	Very high	149 Å²	149	50.4 Å²	50.4	56%	0.562	23%	0.232	S	C	*	.	H	α-helix	trans	-63.1	-45.3	-178.4	-72.4	-175.5	176.1	-173.2	-0.2	112.2	T356 L357 F358 A364 F575	T356-R360 PolarHBondContact O-N 3.47Å; T356-R360 VanDerWaalsContact O-N 3.09Å; L357-R360 PolarHBondContact O-N 3.39Å; F358-R360 PolarHBondContact O-N 2.87Å; R360-A364 VanDerWaalsContact O-CB 3.26Å; R360-A364 WeakPolarHBondContact O-CB 3.3Å; R360-A364 PolarHBondContact O-N 3.36Å; R360-F575 PolarHBondContact NH2-O 3.01Å
361	A	95.4	Very high	93	Very high	32 Å²	32	52 Å²	52	26%	0.264	25%	0.248	S	C	.	.	H	α-helix	trans	-67.7	-44	-179.7	0	0	0	0	0	111.8	L357 F358 I359 A364 W365 I466	L357-A361 WeakPolarHBondContact O-CB 3Å; L357-A361 PolarHBondContact O-N 2.87Å; F358-A361 PolarHBondContact O-N 3.07Å; I359-A361 PolarHBondContact O-N 3.25Å; A361-A364 PolarHBondContact O-N 3.37Å; A361-W365 WeakPolarHBondContact O-CB 3.38Å; A361-W365 PolarHBondContact O-N 3.27Å; A361-I466 HydrophobicContact CB-CD1 4.04Å; A361-I466 HydrophobicContact CB-CG1 4.43Å; A361-I466 HydrophobicContact CB-CG2 3.76Å
362	N	95.1	Very high	92.4	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-64.6	-46.1	178.8	-178.9	-101.7	0	0	0	111.5	F358 I359 A364 W365 C366 I466 F469 H584	F358-N362 HydrophobicContact CE1-CB 4.4Å; F358-N362 HydrophobicContact CZ-CB 4.27Å; F358-N362 WeakPolarHBondContact O-CB 3.36Å; F358-N362 PolarHBondContact O-N 2.85Å; I359-N362 PolarHBondContact O-N 2.91Å; N362-A364 PolarHBondContact O-N 3.33Å; N362-W365 PolarHBondContact O-N 3.46Å; N362-C366 WeakPolarHBondContact O-CB 3.3Å; N362-C366 PolarHBondContact O-N 3.03Å; N362-C366 PolarHBondContact O-SG 2.67Å; N362-C366 VanDerWaalsContact O-SG 3.39Å; N362-I466 PolarHBondContact ND2-O 3Å; N362-F469 PolarHBondContact ND2-O 2.95Å; N362-F469 WeakPolarHBondContact OD1-CD1 3.19Å; N362-H584 PolarHBondContact OD1-NE2 3.45Å
363	I	92.9	Very high	91.6	Very high	20 Å²	20	59.3 Å²	59.3	10%	0.103	28%	0.284	C	S	.	.	H	α-helix	trans	-65	-40.6	178.2	-65.3	-65.7	0	0	0	111.2	I359 W365 C366 R367 L587	I359-I363 HydrophobicContact CG2-CG1 4.28Å; I359-I363 WeakPolarHBondContact O-CB 3.48Å; I359-I363 WeakPolarHBondContact O-CG1 3.43Å; I359-I363 PolarHBondContact O-N 3.39Å; I363-W365 VanDerWaalsContact C-N 3.32Å; I363-W365 PolarHBondContact O-N 2.96Å; I363-C366 PolarHBondContact O-N 2.78Å; I363-R367 VanDerWaalsContact O-CB 3.27Å; I363-R367 WeakPolarHBondContact O-CB 3.47Å; I363-R367 PolarHBondContact O-N 3.38Å; I363-L587 HydrophobicContact CD1-CB 4.44Å; I363-L587 HydrophobicContact CD1-CD2 4.18Å
364	A	93.1	Very high	90.5	Very high	59 Å²	59	59 Å²	59	49%	0.488	28%	0.283	S	S	.	.	H	α-helix	trans	-60.1	-43.2	173.9	0	0	0	0	0	111.6	R360 A361 N362 R367 R368	R360-A364 VanDerWaalsContact O-CB 3.26Å; R360-A364 WeakPolarHBondContact O-CB 3.3Å; R360-A364 PolarHBondContact O-N 3.36Å; A361-A364 PolarHBondContact O-N 3.37Å; N362-A364 PolarHBondContact O-N 3.33Å; A364-R367 PolarHBondContact O-N 3.33Å; A364-R368 WeakPolarHBondContact O-CB 3.45Å; A364-R368 PolarHBondContact O-N 3.28Å
365	W	93	Very high	89.3	Confident	81 Å²	81	60 Å²	60	31%	0.307	30%	0.296	S	S	.	.	H	α-helix	trans	-66.5	-45.5	176.9	-173.5	-106.6	0	0	0	112.5	A361 N362 I363 R367 R368 R369 F467	A361-W365 WeakPolarHBondContact O-CB 3.38Å; A361-W365 PolarHBondContact O-N 3.27Å; N362-W365 PolarHBondContact O-N 3.46Å; I363-W365 VanDerWaalsContact C-N 3.32Å; I363-W365 PolarHBondContact O-N 2.96Å; W365-R367 VanDerWaalsContact C-N 3.33Å; W365-R367 PolarHBondContact O-N 3.44Å; W365-R368 CarbonylContact O-C 3.34Å; W365-R368 WeakPolarHBondContact O-CA 3.47Å; W365-R368 VanDerWaalsContact O-CB 3.3Å; W365-R368 WeakPolarHBondContact O-CB 3.42Å; W365-R368 PolarHBondContact O-N 2.96Å; W365-R368 VanDerWaalsContact O-N 3.12Å; W365-R369 VanDerWaalsContact CD1-CZ 3.46Å; W365-R369 VanDerWaalsContact NE1-CZ 3.26Å; W365-R369 PolarHBondContact O-N 2.9Å; W365-F467 AromaticContact CD2-CD1 3.76Å; W365-F467 HydrophobicContact CD2-CD1 3.76Å; W365-F467 AromaticContact CD2-CE1 3.76Å; W365-F467 HydrophobicContact CD2-CE1 3.76Å; W365-F467 AromaticContact CE2-CD1 3.54Å; W365-F467 AromaticContact CE2-CE1 3.89Å; W365-F467 HydrophobicContact CE3-CD1 4.24Å; W365-F467 AromaticContact CE3-CE1 3.76Å; W365-F467 HydrophobicContact CE3-CE1 3.76Å; W365-F467 HydrophobicContact CG-CD1 4.12Å; W365-F467 HydrophobicContact CG-CE1 4.38Å; W365-F467 HydrophobicContact CH2-CD1 4.33Å; W365-F467 HydrophobicContact CH2-CE1 4.03Å; W365-F467 AromaticContact CZ2-CD1 3.86Å; W365-F467 HydrophobicContact CZ2-CD1 3.86Å; W365-F467 HydrophobicContact CZ2-CE1 4.04Å; W365-F467 HydrophobicContact CZ3-CD1 4.5Å; W365-F467 AromaticContact CZ3-CE1 3.89Å; W365-F467 HydrophobicContact CZ3-CE1 3.89Å; W365-F467 AromaticContact NE1-CD1 3.76Å
366	C	90.8	Very high	88.6	Confident	7 Å²	7	65.7 Å²	65.7	5%	0.047	32%	0.321	C	S	.	.	H	α-helix	trans	-65.7	-34.7	176.7	-70.1	0	0	0	0	112.2	N362 I363 R368 R369 K370 L587	N362-C366 WeakPolarHBondContact O-CB 3.3Å; N362-C366 PolarHBondContact O-N 3.03Å; N362-C366 PolarHBondContact O-SG 2.67Å; N362-C366 VanDerWaalsContact O-SG 3.39Å; I363-C366 PolarHBondContact O-N 2.78Å; C366-R368 VanDerWaalsContact C-N 3.35Å; C366-R369 WeakPolarHBondContact O-CB 3.38Å; C366-R369 PolarHBondContact O-N 3.08Å; C366-K370 PolarHBondContact O-N 2.98Å; C366-K370 VanDerWaalsContact O-N 3.13Å; C366-L587 HydrophobicContact CB-CD2 3.39Å
367	R	89.9	Confident	88.2	Confident	152 Å²	152	72.2 Å²	72.2	57%	0.574	35%	0.345	S	S	*	.	H	α-helix	trans	-64.4	-40.6	170.8	-171.9	-178.6	-65	167.7	-0.6	111.3	I363 A364 W365 R369 K370 T371 L587	I363-R367 VanDerWaalsContact O-CB 3.27Å; I363-R367 WeakPolarHBondContact O-CB 3.47Å; I363-R367 PolarHBondContact O-N 3.38Å; A364-R367 PolarHBondContact O-N 3.33Å; W365-R367 VanDerWaalsContact C-N 3.33Å; W365-R367 PolarHBondContact O-N 3.44Å; R367-R369 VanDerWaalsContact C-N 3.34Å; R367-R369 PolarHBondContact O-N 3.49Å; R367-K370 PolarHBondContact O-N 2.9Å; R367-T371 WeakPolarHBondContact O-CG2 3.43Å; R367-T371 PolarHBondContact O-N 3.38Å; R367-T371 PolarHBondContact O-OG1 2.84Å; R367-L587 HydrophobicContact CB-CD1 4.09Å
368	R	89.3	Confident	87.8	Confident	148 Å²	148	67.8 Å²	67.8	56%	0.558	32%	0.322	S	S	*	.	H	α-helix	trans	-61	-41.6	172.6	-172.5	73.1	171.6	137.4	7.1	111.2	A364 W365 C366 K370 T371 T372	A364-R368 WeakPolarHBondContact O-CB 3.45Å; A364-R368 PolarHBondContact O-N 3.28Å; W365-R368 CarbonylContact O-C 3.34Å; W365-R368 WeakPolarHBondContact O-CA 3.47Å; W365-R368 VanDerWaalsContact O-CB 3.3Å; W365-R368 WeakPolarHBondContact O-CB 3.42Å; W365-R368 PolarHBondContact O-N 2.96Å; W365-R368 VanDerWaalsContact O-N 3.12Å; C366-R368 VanDerWaalsContact C-N 3.35Å; R368-K370 PolarHBondContact O-N 2.82Å; R368-T371 PolarHBondContact O-N 3.44Å; R368-T371 PolarHBondContact O-OG1 2.97Å; R368-T372 HydrophobicContact CG-CG2 4.04Å; R368-T372 VanDerWaalsContact O-CB 3.3Å; R368-T372 WeakPolarHBondContact O-CB 3.41Å; R368-T372 WeakPolarHBondContact O-CG2 3.43Å; R368-T372 PolarHBondContact O-N 3.39Å; R368-T372 VanDerWaalsContact O-N 3.1Å; R368-T372 PolarHBondContact O-OG1 3.2Å
369	R	87	Confident	87.6	Confident	16 Å²	16	69 Å²	69	6%	0.06	33%	0.329	C	S	.	.	H	α-helix	trans	-57.5	-45.5	175	-72.1	175.2	166	150	5.2	112.5	W365 C366 R367 G375 E381 F467 F469 G470	W365-R369 VanDerWaalsContact CD1-CZ 3.46Å; W365-R369 VanDerWaalsContact NE1-CZ 3.26Å; W365-R369 PolarHBondContact O-N 2.9Å; C366-R369 WeakPolarHBondContact O-CB 3.38Å; C366-R369 PolarHBondContact O-N 3.08Å; R367-R369 VanDerWaalsContact C-N 3.34Å; R367-R369 PolarHBondContact O-N 3.49Å; R369-G375 WeakPolarHBondContact O-CA 3.4Å; R369-G375 PolarHBondContact O-N 3.47Å; R369-E381 IonicContact CZ-OE1 2.8Å; R369-E381 IonicContact NE-OE1 3.3Å; R369-E381 PolarHBondContact NE-OE1 2.97Å; R369-E381 IonicContact NE-OE2 3.45Å; R369-E381 PolarHBondContact NE-OE2 2.85Å; R369-E381 IonicContact NH2-OE1 2.99Å; R369-E381 PolarHBondContact NH2-OE1 3.38Å; R369-F467 PolarHBondContact NH1-O 3.03Å; R369-F467 PolarHBondContact NH2-O 2.97Å; R369-F469 PolarHBondContact NH1-O 3.18Å; R369-F469 VanDerWaalsContact NH1-O 3.1Å; R369-G470 PolarHBondContact NH1-O 3.18Å
370	K	82.8	Confident	87.5	Confident	105 Å²	105	73 Å²	73	46%	0.457	35%	0.35	S	S	.	.	H	α-helix	trans	-69.4	-37.8	-179.7	-68.5	-170.5	179.2	-167.7	0	113.3	C366 R367 R368 L587 N588	C366-K370 PolarHBondContact O-N 2.98Å; C366-K370 VanDerWaalsContact O-N 3.13Å; R367-K370 PolarHBondContact O-N 2.9Å; R368-K370 PolarHBondContact O-N 2.82Å; K370-L587 PolarHBondContact NZ-O 2.88Å; K370-N588 PolarHBondContact NZ-OD1 2.89Å
371	T	82.7	Confident	87.4	Confident	106 Å²	106	67 Å²	67	65%	0.65	33%	0.329	S	S	*	.	H	α-helix	trans	-86.4	-11.1	-174.8	51.9	0	0	0	0	114.4	R367 R368	R367-T371 WeakPolarHBondContact O-CG2 3.43Å; R367-T371 PolarHBondContact O-N 3.38Å; R367-T371 PolarHBondContact O-OG1 2.84Å; R368-T371 PolarHBondContact O-N 3.44Å; R368-T371 PolarHBondContact O-OG1 2.97Å
372	T	85.1	Confident	87.3	Confident	28 Å²	28	65.5 Å²	65.5	17%	0.172	32%	0.316	C	S	.	.	S	Bend	trans	-118.1	169.5	-174	63.9	0	0	0	0	113.1	R368 L374 G375	R368-T372 HydrophobicContact CG-CG2 4.04Å; R368-T372 VanDerWaalsContact O-CB 3.3Å; R368-T372 WeakPolarHBondContact O-CB 3.41Å; R368-T372 WeakPolarHBondContact O-CG2 3.43Å; R368-T372 PolarHBondContact O-N 3.39Å; R368-T372 VanDerWaalsContact O-N 3.1Å; R368-T372 PolarHBondContact O-OG1 3.2Å; T372-L374 PolarHBondContact O-N 2.92Å; T372-L374 WeakPolarHBondContact OG1-CB 3.44Å; T372-L374 PolarHBondContact OG1-N 3.44Å; T372-G375 PolarHBondContact O-N 3.1Å
373	Q	78.4	Confident	87.3	Confident	124 Å²	124	67.9 Å²	67.9	58%	0.579	33%	0.328	S	S	*	.	G	3₁₀ helix	trans	-60.6	-14	174.6	-55.7	-67.4	-15.1	0	0	113.4	G375 K376	Q373-G375 PolarHBondContact O-N 3.05Å; Q373-K376 WeakPolarHBondContact O-CB 3.33Å; Q373-K376 PolarHBondContact O-N 2.64Å; Q373-K376 VanDerWaalsContact O-N 3.1Å
374	L	75.1	Confident	87.4	Confident	77 Å²	77	71.1 Å²	71.1	40%	0.403	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-58.3	-33.8	174.9	-68.9	169.7	0	0	0	111.6	T372 K376 Y377	T372-L374 PolarHBondContact O-N 2.92Å; T372-L374 WeakPolarHBondContact OG1-CB 3.44Å; T372-L374 PolarHBondContact OG1-N 3.44Å; L374-K376 PolarHBondContact O-N 3.13Å; L374-Y377 PolarHBondContact O-N 3.24Å
375	G	70.4	Confident	87.5	Confident	31 Å²	31	69.2 Å²	69.2	32%	0.32	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-63.9	-21.4	177.6	0	0	0	0	0	114.5	R369 T372 Q373	R369-G375 WeakPolarHBondContact O-CA 3.4Å; R369-G375 PolarHBondContact O-N 3.47Å; T372-G375 PolarHBondContact O-N 3.1Å; Q373-G375 PolarHBondContact O-N 3.05Å
376	K	81.5	Confident	87.7	Confident	119 Å²	119	65.4 Å²	65.4	52%	0.517	31%	0.313	S	S	.	.	G	3₁₀ helix	trans	-76.9	-24.1	-179.5	-65.2	-171.6	-179.8	171.3	0	113.5	Q373 L374 P378	Q373-K376 WeakPolarHBondContact O-CB 3.33Å; Q373-K376 PolarHBondContact O-N 2.64Å; Q373-K376 VanDerWaalsContact O-N 3.1Å; L374-K376 PolarHBondContact O-N 3.13Å; K376-P378 VanDerWaalsContact O-CD 3.22Å; K376-P378 WeakPolarHBondContact O-CD 3.22Å
377	Y	88.2	Confident	87.9	Confident	151 Å²	151	66 Å²	66	59%	0.592	32%	0.32	S	S	*	.			trans	-120.4	60.9	-174.4	-58.2	-77	0	0	0	112.5	L374 V379 L380 E381	L374-Y377 PolarHBondContact O-N 3.24Å; Y377-V379 VanDerWaalsContact C-N 3.3Å; Y377-V379 PolarHBondContact O-N 3.27Å; Y377-L380 PolarHBondContact O-N 2.87Å; Y377-E381 PolarHBondContact O-N 3.43Å; Y377-E381 VanDerWaalsContact O-N 3.08Å
378	P	87.1	Confident	88.2	Confident	6 Å²	6	62.7 Å²	62.7	4%	0.039	31%	0.313	C	S	.	.	H	α-helix	trans	-66.1	-31.1	-175.6	27.5	-35.8	0	0	0	113.3	F30 K376 V382 K472	F30-P378 HydrophobicContact CE1-CG 4.34Å; F30-P378 HydrophobicContact CZ-CG 3.84Å; K376-P378 VanDerWaalsContact O-CD 3.22Å; K376-P378 WeakPolarHBondContact O-CD 3.22Å; P378-V382 VanDerWaalsContact O-CG2 3.25Å; P378-V382 WeakPolarHBondContact O-CG2 3.36Å; P378-V382 PolarHBondContact O-N 3.39Å; P378-V382 VanDerWaalsContact O-N 3.11Å; P378-K472 HydrophobicContact CB-CB 3.92Å; P378-K472 HydrophobicContact CB-CG 3.7Å
379	V	92	Very high	88.5	Confident	26 Å²	26	55.8 Å²	55.8	16%	0.158	29%	0.287	C	S	.	.	H	α-helix	trans	-65.6	-47.3	177.3	176.6	0	0	0	0	110.3	F174 V177 Y377 E381 V382 I383	F174-V379 HydrophobicContact CD2-CG1 4.21Å; F174-V379 HydrophobicContact CE2-CG1 4.27Å; V177-V379 HydrophobicContact CG1-CB 4.19Å; V177-V379 HydrophobicContact CG1-CG1 3.83Å; V177-V379 HydrophobicContact CG1-CG2 4.11Å; V177-V379 HydrophobicContact CG2-CG2 4.03Å; Y377-V379 VanDerWaalsContact C-N 3.3Å; Y377-V379 PolarHBondContact O-N 3.27Å; V379-E381 VanDerWaalsContact C-N 3.34Å; V379-E381 PolarHBondContact O-N 2.93Å; V379-V382 PolarHBondContact O-N 3.04Å; V379-I383 HydrophobicContact CG1-CD1 3.92Å; V379-I383 VanDerWaalsContact O-CG1 3.28Å; V379-I383 WeakPolarHBondContact O-CG1 3.38Å; V379-I383 PolarHBondContact O-N 3.04Å; V379-I383 VanDerWaalsContact O-N 3.1Å
380	L	92.5	Very high	88.9	Confident	96 Å²	96	55.1 Å²	55.1	50%	0.503	29%	0.285	S	S	.	.	H	α-helix	trans	-63.4	-42	178.9	-177.1	64.9	0	0	0	111.2	Y377 V382 I383 I384	Y377-L380 PolarHBondContact O-N 2.87Å; L380-V382 VanDerWaalsContact C-N 3.34Å; L380-V382 PolarHBondContact O-N 3.5Å; L380-I383 PolarHBondContact O-N 2.81Å; L380-I384 HydrophobicContact CD1-CD1 4.02Å; L380-I384 HydrophobicContact CD1-CG1 4.29Å; L380-I384 HydrophobicContact CD2-CD1 4.34Å; L380-I384 HydrophobicContact CG-CD1 3.75Å; L380-I384 HydrophobicContact CG-CG1 4.38Å; L380-I384 WeakPolarHBondContact O-CB 3.4Å; L380-I384 VanDerWaalsContact O-CG1 3.28Å; L380-I384 WeakPolarHBondContact O-CG1 3.33Å; L380-I384 PolarHBondContact O-N 3.42Å
381	E	92.6	Very high	89.4	Confident	24 Å²	24	54.2 Å²	54.2	11%	0.112	29%	0.285	C	S	.	.	H	α-helix	trans	-56.7	-47.7	175.1	179.4	177.6	-153.6	0	0	111.7	R369 Y377 V379 I383 I384 V385	R369-E381 IonicContact CZ-OE1 2.8Å; R369-E381 IonicContact NE-OE1 3.3Å; R369-E381 PolarHBondContact NE-OE1 2.97Å; R369-E381 IonicContact NE-OE2 3.45Å; R369-E381 PolarHBondContact NE-OE2 2.85Å; R369-E381 IonicContact NH2-OE1 2.99Å; R369-E381 PolarHBondContact NH2-OE1 3.38Å; Y377-E381 PolarHBondContact O-N 3.43Å; Y377-E381 VanDerWaalsContact O-N 3.08Å; V379-E381 VanDerWaalsContact C-N 3.34Å; V379-E381 PolarHBondContact O-N 2.93Å; E381-I383 VanDerWaalsContact C-N 3.34Å; E381-I383 PolarHBondContact O-N 2.8Å; E381-I384 PolarHBondContact O-N 3.21Å; E381-V385 HydrophobicContact CG-CG2 4.34Å; E381-V385 WeakPolarHBondContact O-CG2 2.9Å; E381-V385 PolarHBondContact O-N 2.63Å
382	V	94.3	Very high	89.9	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-62	-42.3	-179.8	174.1	0	0	0	0	112.3	V177 P378 V379 L380 T386 M471 I473	V177-V382 HydrophobicContact CB-CB 4.31Å; V177-V382 HydrophobicContact CB-CG1 4.25Å; V177-V382 HydrophobicContact CB-CG2 4.25Å; V177-V382 HydrophobicContact CG1-CB 4.42Å; V177-V382 HydrophobicContact CG1-CG1 4.43Å; V177-V382 HydrophobicContact CG2-CB 4.37Å; V177-V382 HydrophobicContact CG2-CG2 3.92Å; P378-V382 VanDerWaalsContact O-CG2 3.25Å; P378-V382 WeakPolarHBondContact O-CG2 3.36Å; P378-V382 PolarHBondContact O-N 3.39Å; P378-V382 VanDerWaalsContact O-N 3.11Å; V379-V382 PolarHBondContact O-N 3.04Å; L380-V382 VanDerWaalsContact C-N 3.34Å; L380-V382 PolarHBondContact O-N 3.5Å; V382-T386 VanDerWaalsContact O-CB 3.3Å; V382-T386 WeakPolarHBondContact O-CB 3.42Å; V382-T386 PolarHBondContact O-N 3.26Å; V382-T386 PolarHBondContact O-OG1 3.07Å; V382-M471 HydrophobicContact CB-CE 3.74Å; V382-M471 HydrophobicContact CG1-CE 3.89Å; V382-M471 HydrophobicContact CG2-CB 4.38Å; V382-M471 HydrophobicContact CG2-CE 3.44Å; V382-M471 VanDerWaalsContact CG2-CE 3.44Å; V382-I473 HydrophobicContact CG1-CD1 4.36Å; V382-I473 HydrophobicContact CG1-CG2 4.1Å; V382-I473 HydrophobicContact CG2-CG2 4.01Å
383	I	95.6	Very high	90.3	Very high	50 Å²	50	52.5 Å²	52.5	26%	0.256	27%	0.271	S	S	.	.	H	α-helix	trans	-64.8	-45.2	177.8	-64.5	167.5	0	0	0	110.5	L170 F174 V379 L380 E381 T386 G387	L170-I383 HydrophobicContact CD2-CG2 3.97Å; L170-I383 WeakPolarHBondContact CD2-O 3.38Å; F174-I383 HydrophobicContact CD2-CD1 3.88Å; V379-I383 HydrophobicContact CG1-CD1 3.92Å; V379-I383 VanDerWaalsContact O-CG1 3.28Å; V379-I383 WeakPolarHBondContact O-CG1 3.38Å; V379-I383 PolarHBondContact O-N 3.04Å; V379-I383 VanDerWaalsContact O-N 3.1Å; L380-I383 PolarHBondContact O-N 2.81Å; E381-I383 VanDerWaalsContact C-N 3.34Å; E381-I383 PolarHBondContact O-N 2.8Å; I383-T386 PolarHBondContact O-N 3.41Å; I383-G387 PolarHBondContact O-N 3.12Å
384	I	94.9	Very high	90.9	Very high	88 Å²	88	47.4 Å²	47.4	45%	0.451	25%	0.246	S	C	.	.	H	α-helix	trans	-64.1	-48.3	-179.3	-69.9	171	0	0	0	110.8	L380 E381 T386 G387 I388	L380-I384 HydrophobicContact CD1-CD1 4.02Å; L380-I384 HydrophobicContact CD1-CG1 4.29Å; L380-I384 HydrophobicContact CD2-CD1 4.34Å; L380-I384 HydrophobicContact CG-CD1 3.75Å; L380-I384 HydrophobicContact CG-CG1 4.38Å; L380-I384 WeakPolarHBondContact O-CB 3.4Å; L380-I384 VanDerWaalsContact O-CG1 3.28Å; L380-I384 WeakPolarHBondContact O-CG1 3.33Å; L380-I384 PolarHBondContact O-N 3.42Å; E381-I384 PolarHBondContact O-N 3.21Å; I384-T386 VanDerWaalsContact C-N 3.32Å; I384-T386 PolarHBondContact O-N 3.49Å; I384-G387 PolarHBondContact O-N 3.45Å; I384-I388 HydrophobicContact CG2-CD1 3.83Å; I384-I388 WeakPolarHBondContact O-CG1 3.08Å; I384-I388 PolarHBondContact O-N 2.86Å
385	V	95.1	Very high	91.7	Very high	19 Å²	19	47.4 Å²	47.4	12%	0.115	25%	0.251	C	S	.	.	H	α-helix	trans	-63.6	-40.8	179.5	175.4	0	0	0	0	110.5	L228 E381 I388 T389 I464 T468 M471	L228-V385 HydrophobicContact CD2-CG1 4.11Å; E381-V385 HydrophobicContact CG-CG2 4.34Å; E381-V385 WeakPolarHBondContact O-CG2 2.9Å; E381-V385 PolarHBondContact O-N 2.63Å; V385-I388 PolarHBondContact O-N 3.46Å; V385-T389 VanDerWaalsContact O-CB 3.31Å; V385-T389 WeakPolarHBondContact O-CB 3.22Å; V385-T389 PolarHBondContact O-N 2.87Å; V385-T389 PolarHBondContact O-OG1 2.88Å; V385-I464 HydrophobicContact CG1-CD1 4.48Å; V385-T468 HydrophobicContact CG1-CG2 4.02Å; V385-M471 HydrophobicContact CB-CE 4Å; V385-M471 HydrophobicContact CB-SD 4.04Å; V385-M471 HydrophobicContact CG1-CE 4.24Å; V385-M471 HydrophobicContact CG1-SD 3.79Å; V385-M471 HydrophobicContact CG2-CE 4.45Å; V385-M471 HydrophobicContact CG2-SD 4.22Å
386	T	96.2	Very high	92.7	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.006	24%	0.241	C	C	.	.	H	α-helix	trans	-62.7	-44.7	174.6	-54	0	0	0	0	111.6	A169 L170 S173 V382 I383 I384 I388 T389 A390	A169-T386 HydrophobicContact CB-CG2 4.02Å; L170-T386 HydrophobicContact CD2-CG2 4.26Å; S173-T386 WeakPolarHBondContact CB-OG1 3.29Å; S173-T386 PolarHBondContact OG-OG1 3.24Å; V382-T386 VanDerWaalsContact O-CB 3.3Å; V382-T386 WeakPolarHBondContact O-CB 3.42Å; V382-T386 PolarHBondContact O-N 3.26Å; V382-T386 PolarHBondContact O-OG1 3.07Å; I383-T386 PolarHBondContact O-N 3.41Å; I384-T386 VanDerWaalsContact C-N 3.32Å; I384-T386 PolarHBondContact O-N 3.49Å; T386-I388 PolarHBondContact O-N 3.02Å; T386-T389 PolarHBondContact O-N 3.49Å; T386-A390 WeakPolarHBondContact O-CB 3.35Å; T386-A390 PolarHBondContact O-N 3.43Å
387	G	96.1	Very high	93	Very high	19 Å²	19	42.8 Å²	42.8	20%	0.196	23%	0.226	C	C	.	.	H	α-helix	trans	-60.4	-46.5	178.2	0	0	0	0	0	112.4	I383 I384 A390 L391	I383-G387 PolarHBondContact O-N 3.12Å; I384-G387 PolarHBondContact O-N 3.45Å; G387-A390 PolarHBondContact O-N 2.73Å; G387-L391 WeakPolarHBondContact O-CB 3.13Å; G387-L391 PolarHBondContact O-N 3.41Å
388	I	95.7	Very high	93.1	Very high	82 Å²	82	35.8 Å²	35.8	42%	0.421	20%	0.199	S	C	.	.	H	α-helix	trans	-62.9	-44	175.2	-66.4	168.8	0	0	0	110.6	I384 V385 T386 L391 L392	I384-I388 HydrophobicContact CG2-CD1 3.83Å; I384-I388 WeakPolarHBondContact O-CG1 3.08Å; I384-I388 PolarHBondContact O-N 2.86Å; V385-I388 PolarHBondContact O-N 3.46Å; T386-I388 PolarHBondContact O-N 3.02Å; I388-L391 PolarHBondContact O-N 2.94Å; I388-L392 HydrophobicContact CG2-CD1 3.82Å; I388-L392 HydrophobicContact CG2-CG 4.42Å; I388-L392 WeakPolarHBondContact O-CB 3.36Å; I388-L392 WeakPolarHBondContact O-CG 3Å; I388-L392 PolarHBondContact O-N 3.28Å
389	T	95.3	Very high	93.2	Very high	3 Å²	3	35.9 Å²	35.9	2%	0.018	20%	0.199	C	C	.	.	H	α-helix	trans	-60.7	-50.7	179.2	-55.3	0	0	0	0	110.7	V385 T386 L391 L392 A393 F460 I464	V385-T389 VanDerWaalsContact O-CB 3.31Å; V385-T389 WeakPolarHBondContact O-CB 3.22Å; V385-T389 PolarHBondContact O-N 2.87Å; V385-T389 PolarHBondContact O-OG1 2.88Å; T386-T389 PolarHBondContact O-N 3.49Å; T389-L391 PolarHBondContact O-N 2.93Å; T389-L392 PolarHBondContact O-N 3.41Å; T389-A393 WeakPolarHBondContact O-CB 3.48Å; T389-A393 PolarHBondContact O-N 3.23Å; T389-F460 HydrophobicContact CG2-CZ 4.04Å; T389-I464 HydrophobicContact CG2-CG1 4.18Å; T389-I464 WeakPolarHBondContact OG1-CD1 3.44Å; T389-I464 WeakPolarHBondContact OG1-CG1 3.28Å
390	A	94.8	Very high	93.1	Very high	3 Å²	3	37.6 Å²	37.6	3%	0.025	20%	0.203	C	C	.	.	H	α-helix	trans	-66.1	-39	-178.4	0	0	0	0	0	112.2	Y165 I166 A169 T386 G387 Y394	Y165-A390 HydrophobicContact CD1-CB 4.23Å; Y165-A390 HydrophobicContact CE1-CB 4.04Å; I166-A390 HydrophobicContact CB-CB 4.5Å; I166-A390 HydrophobicContact CG1-CB 4.03Å; A169-A390 HydrophobicContact CB-CB 3.97Å; T386-A390 WeakPolarHBondContact O-CB 3.35Å; T386-A390 PolarHBondContact O-N 3.43Å; G387-A390 PolarHBondContact O-N 2.73Å; A390-Y394 PolarHBondContact O-N 3.04Å
391	L	94.7	Very high	92.8	Very high	86 Å²	86	37.6 Å²	37.6	45%	0.45	20%	0.196	S	C	.	.	H	α-helix	trans	-60.3	-49.1	175.7	-173.1	76.9	0	0	0	110.8	Y162 I166 G387 I388 T389 P395	Y162-L391 HydrophobicContact CE2-CD1 4.41Å; Y162-L391 WeakPolarHBondContact OH-CD1 2.92Å; Y162-L391 PolarHBondContact OH-O 3.47Å; I166-L391 HydrophobicContact CD1-CD1 3.96Å; G387-L391 WeakPolarHBondContact O-CB 3.13Å; G387-L391 PolarHBondContact O-N 3.41Å; I388-L391 PolarHBondContact O-N 2.94Å; T389-L391 PolarHBondContact O-N 2.93Å; L391-P395 WeakPolarHBondContact O-CD 3.24Å
392	L	93.4	Very high	92.5	Very high	95 Å²	95	37.3 Å²	37.3	50%	0.497	20%	0.197	S	C	.	.	H	α-helix	trans	-79.1	-26.4	-176.9	-65.2	178.7	0	0	0	113.6	I388 T389 P395 F460	I388-L392 HydrophobicContact CG2-CD1 3.82Å; I388-L392 HydrophobicContact CG2-CG 4.42Å; I388-L392 WeakPolarHBondContact O-CB 3.36Å; I388-L392 WeakPolarHBondContact O-CG 3Å; I388-L392 PolarHBondContact O-N 3.28Å; T389-L392 PolarHBondContact O-N 3.41Å; L392-P395 WeakPolarHBondContact O-CD 3.49Å; L392-F460 HydrophobicContact CB-CD2 4.09Å; L392-F460 HydrophobicContact CB-CE2 3.5Å; L392-F460 HydrophobicContact CB-CZ 4.19Å; L392-F460 HydrophobicContact CD1-CD2 4.38Å; L392-F460 HydrophobicContact CD1-CE2 4Å; L392-F460 HydrophobicContact CG-CE2 4.41Å
393	A	92.2	Very high	92.3	Very high	3 Å²	3	38 Å²	38	3%	0.025	20%	0.202	C	C	.	.	H	α-helix	trans	-79.7	-31.3	-176.5	0	0	0	0	0	113.6	T389 T399 R400 F460	T389-A393 WeakPolarHBondContact O-CB 3.48Å; T389-A393 PolarHBondContact O-N 3.23Å; A393-T399 WeakPolarHBondContact CA-OG1 3.43Å; A393-T399 PolarHBondContact O-OG1 3.42Å; A393-R400 PolarHBondContact O-N 3.03Å; A393-F460 HydrophobicContact CB-CE1 4.16Å; A393-F460 HydrophobicContact CB-CZ 4.16Å
394	Y	91.4	Very high	91.9	Very high	16 Å²	16	36.6 Å²	36.6	6%	0.063	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-40.3	-174	-170.6	-93.5	0	0	0	115.4	Y158 N161 Y162 Y165 A390 N396 R400	Y158-Y394 HydrophobicContact CD2-CE1 4.27Å; Y158-Y394 HydrophobicContact CE1-CE1 4.22Å; Y158-Y394 HydrophobicContact CE2-CD1 4.44Å; Y158-Y394 AromaticContact CE2-CE1 3.65Å; Y158-Y394 HydrophobicContact CE2-CE1 3.65Å; Y158-Y394 AromaticContact CZ-CE1 3.62Å; N161-Y394 WeakPolarHBondContact CB-OH 3.45Å; Y162-Y394 HydrophobicContact CD1-CD1 4.17Å; Y162-Y394 AromaticContact CD2-CD1 3.37Å; Y162-Y394 HydrophobicContact CD2-CD1 3.37Å; Y162-Y394 HydrophobicContact CD2-CD2 4.01Å; Y162-Y394 HydrophobicContact CD2-CE1 4.06Å; Y162-Y394 AromaticContact CD2-CG 3.35Å; Y162-Y394 HydrophobicContact CD2-CG 3.35Å; Y162-Y394 AromaticContact CE2-CD1 3.91Å; Y162-Y394 HydrophobicContact CE2-CD1 3.91Å; Y162-Y394 AromaticContact CE2-CG 3.77Å; Y162-Y394 HydrophobicContact CE2-CG 3.77Å; Y162-Y394 AromaticContact CG-CD1 3.51Å; Y162-Y394 HydrophobicContact CG-CD1 3.51Å; Y162-Y394 AromaticContact CG-CE1 3.83Å; Y162-Y394 HydrophobicContact CG-CE1 3.83Å; Y162-Y394 AromaticContact CG-CG 4Å; Y162-Y394 HydrophobicContact CG-CG 4Å; Y165-Y394 AromaticContact CD1-CD2 3.8Å; Y165-Y394 HydrophobicContact CD1-CD2 3.8Å; Y165-Y394 AromaticContact CD2-CD2 4Å; Y165-Y394 HydrophobicContact CD2-CD2 4Å; Y165-Y394 HydrophobicContact CD2-CE2 4.26Å; Y165-Y394 HydrophobicContact CE1-CD2 4.43Å; Y165-Y394 AromaticContact CG-CD2 3.57Å; Y165-Y394 HydrophobicContact CG-CD2 3.57Å; Y165-Y394 HydrophobicContact CG-CE2 4.02Å; A390-Y394 PolarHBondContact O-N 3.04Å; Y394-N396 VanDerWaalsContact C-N 3.29Å; Y394-N396 PolarHBondContact O-N 3.41Å; Y394-R400 HydrophobicContact CD2-CG 4.32Å
395	P	92.1	Very high	91.5	Very high	78 Å²	78	35 Å²	35	51%	0.506	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-29.2	-177.7	-24.3	35.8	0	0	0	114.3	L391 L392	L391-P395 WeakPolarHBondContact O-CD 3.24Å; L392-P395 WeakPolarHBondContact O-CD 3.49Å
396	N	91.4	Very high	91.3	Very high	19 Å²	19	34.2 Å²	34.2	10%	0.102	18%	0.181	C	C	.	.	S	Bend	trans	-102.4	120.3	-179	174.6	-1.4	0	0	0	110	Y394 Y398 T399 R400 Q453	Y394-N396 VanDerWaalsContact C-N 3.29Å; Y394-N396 PolarHBondContact O-N 3.41Å; N396-Y398 VanDerWaalsContact C-N 3.29Å; N396-Y398 PolarHBondContact O-N 3.16Å; N396-Y398 PolarHBondContact OD1-N 3.19Å; N396-Y398 VanDerWaalsContact OD1-N 3.15Å; N396-T399 HydrophobicContact CB-CG2 4.46Å; N396-T399 VanDerWaalsContact CB-OG1 3.29Å; N396-T399 WeakPolarHBondContact CB-OG1 3.43Å; N396-T399 PolarHBondContact O-N 3.31Å; N396-T399 VanDerWaalsContact O-N 3.14Å; N396-T399 PolarHBondContact O-OG1 3.41Å; N396-R400 PolarHBondContact O-N 2.9Å; N396-Q453 PolarHBondContact ND2-O 3.45Å
397	P	88.1	Confident	91.1	Very high	33 Å²	33	34.1 Å²	34.1	21%	0.214	18%	0.181	C	C	.	.	H	α-helix	trans	-60.3	-36.3	-174.9	24.6	-34.5	0	0	0	112.9	T399 R400 R401	P397-T399 VanDerWaalsContact C-N 3.33Å; P397-T399 PolarHBondContact O-N 3.41Å; P397-R400 PolarHBondContact O-N 3.4Å; P397-R401 PolarHBondContact O-N 3.24Å
398	Y	90.1	Very high	90.7	Very high	4 Å²	4	34 Å²	34	2%	0.016	18%	0.177	C	C	.	.	H	α-helix	trans	-70.3	-28.7	179.7	-62.2	-69.3	0	0	0	113.1	N396 L406 L422 A450 Q453 L454	N396-Y398 VanDerWaalsContact C-N 3.29Å; N396-Y398 PolarHBondContact O-N 3.16Å; N396-Y398 PolarHBondContact OD1-N 3.19Å; N396-Y398 VanDerWaalsContact OD1-N 3.15Å; Y398-L406 HydrophobicContact CD1-CD1 3.78Å; Y398-L406 HydrophobicContact CG-CD1 4.33Å; Y398-L406 WeakPolarHBondContact O-CD2 3.44Å; Y398-L422 HydrophobicContact CE1-CD1 3.67Å; Y398-A450 HydrophobicContact CE2-CB 4.32Å; Y398-A450 VanDerWaalsContact OH-CB 3.27Å; Y398-A450 WeakPolarHBondContact OH-CB 3.05Å; Y398-Q453 HydrophobicContact CD2-CB 3.68Å; Y398-Q453 HydrophobicContact CE2-CB 3.78Å; Y398-Q453 VanDerWaalsContact CE2-OE1 3.27Å; Y398-L454 HydrophobicContact CD1-CD2 3.97Å; Y398-L454 HydrophobicContact CD2-CD2 4.08Å; Y398-L454 HydrophobicContact CD2-CG 4.3Å; Y398-L454 HydrophobicContact CE1-CD2 4.33Å; Y398-L454 HydrophobicContact CE2-CD2 4.43Å; Y398-L454 HydrophobicContact CE2-CG 4.3Å; Y398-L454 HydrophobicContact CG-CD2 3.84Å
399	T	89.6	Confident	90.3	Very high	8 Å²	8	31.5 Å²	31.5	5%	0.049	16%	0.164	C	C	.	.	H	α-helix	trans	-84.9	-23.5	175.5	52	0	0	0	0	112.9	A393 N396 P397 A457 F460	A393-T399 WeakPolarHBondContact CA-OG1 3.43Å; A393-T399 PolarHBondContact O-OG1 3.42Å; N396-T399 HydrophobicContact CB-CG2 4.46Å; N396-T399 VanDerWaalsContact CB-OG1 3.29Å; N396-T399 WeakPolarHBondContact CB-OG1 3.43Å; N396-T399 PolarHBondContact O-N 3.31Å; N396-T399 VanDerWaalsContact O-N 3.14Å; N396-T399 PolarHBondContact O-OG1 3.41Å; P397-T399 VanDerWaalsContact C-N 3.33Å; P397-T399 PolarHBondContact O-N 3.41Å; T399-A457 HydrophobicContact CG2-CB 3.58Å; T399-F460 HydrophobicContact CG2-CB 4.47Å; T399-F460 HydrophobicContact CG2-CD1 3.55Å; T399-F460 HydrophobicContact CG2-CE1 4.17Å; T399-F460 HydrophobicContact CG2-CG 4.31Å
400	R	89.1	Confident	90.1	Very high	63 Å²	63	31.4 Å²	31.4	24%	0.238	16%	0.163	C	C	.	.	H	α-helix	trans	-74.3	-37.6	-179.9	-168.3	178.1	76.1	-148.2	-2.8	112.9	E109 Y165 A393 Y394 N396 P397	E109-R400 IonicContact OE1-CZ 2.71Å; E109-R400 IonicContact OE1-NE 3.34Å; E109-R400 PolarHBondContact OE1-NE 3.18Å; E109-R400 IonicContact OE1-NH2 2.71Å; Y165-R400 HydrophobicContact CD2-CG 4.47Å; Y165-R400 HydrophobicContact CE2-CG 3.76Å; Y165-R400 PolarHBondContact OH-O 3.18Å; A393-R400 PolarHBondContact O-N 3.03Å; Y394-R400 HydrophobicContact CD2-CG 4.32Å; N396-R400 PolarHBondContact O-N 2.9Å; P397-R400 PolarHBondContact O-N 3.4Å
401	R	85.8	Confident	89.9	Confident	95 Å²	95	31.4 Å²	31.4	36%	0.358	16%	0.163	S	C	.	.	S	Bend	trans	-62.4	158.8	178.6	-75.3	178.2	176.1	159.6	-3.9	112.6	P397 E409	P397-R401 PolarHBondContact O-N 3.24Å; R401-E409 IonicContact CZ-OE1 3.75Å; R401-E409 IonicContact CZ-OE2 2.78Å; R401-E409 IonicContact NH1-OE1 2.82Å; R401-E409 PolarHBondContact NH1-OE1 2.85Å; R401-E409 IonicContact NH1-OE2 3.68Å; R401-E409 PolarHBondContact NH1-OE2 3.46Å
402	S	86.6	Confident	89.4	Confident	19 Å²	19	29.7 Å²	29.7	13%	0.133	15%	0.154	C	C	.	.			trans	-62.2	146.9	172.6	86.3	0	0	0	0	109.7	S404 E405 L406	S402-S404 PolarHBondContact O-N 2.89Å; S402-S404 PolarHBondContact OG-OG 3.47Å; S402-E405 VanDerWaalsContact CB-OE1 3.29Å; S402-E405 WeakPolarHBondContact CB-OE1 3.37Å; S402-E405 PolarHBondContact O-N 3.24Å; S402-E405 WeakPolarHBondContact OG-CB 3.28Å; S402-E405 VanDerWaalsContact OG-CG 3.23Å; S402-E405 WeakPolarHBondContact OG-CG 3.36Å; S402-E405 PolarHBondContact OG-N 2.82Å; S402-E405 PolarHBondContact OG-OE1 2.92Å; S402-L406 WeakPolarHBondContact O-CB 3.2Å; S402-L406 PolarHBondContact O-N 2.91Å
403	T	89.5	Confident	88.7	Confident	15 Å²	15	27.7 Å²	27.7	9%	0.092	14%	0.143	C	C	.	.	H	α-helix	trans	-70.3	-26.2	-174.2	-54.1	0	0	0	0	111.5	I407 K461 I479 A483	T403-I407 VanDerWaalsContact O-CG1 3.3Å; T403-I407 WeakPolarHBondContact O-CG1 3.5Å; T403-I407 PolarHBondContact O-N 3.29Å; T403-I407 VanDerWaalsContact O-N 3.14Å; T403-K461 PolarHBondContact OG1-NZ 3.1Å; T403-I479 HydrophobicContact CG2-CG2 3.54Å; T403-A483 HydrophobicContact CG2-CB 3.37Å
404	S	87.9	Confident	87.9	Confident	20 Å²	20	28.7 Å²	28.7	14%	0.14	15%	0.15	C	C	.	.	H	α-helix	trans	-70.6	-43.8	173.4	37.7	0	0	0	0	112.7	S402 L406 I407 S408	S402-S404 PolarHBondContact O-N 2.89Å; S402-S404 PolarHBondContact OG-OG 3.47Å; S404-L406 VanDerWaalsContact C-N 3.34Å; S404-I407 PolarHBondContact O-N 3.44Å; S404-S408 PolarHBondContact O-N 3.05Å
405	E	86.6	Confident	86.6	Confident	55 Å²	55	29.6 Å²	29.6	26%	0.257	17%	0.165	S	C	.	.	H	α-helix	trans	-61.7	-43.8	173	-77.3	153	-128.5	0	0	111.1	L327 S402 I407 S408 E409	L327-E405 HydrophobicContact CD2-CG 3.96Å; S402-E405 VanDerWaalsContact CB-OE1 3.29Å; S402-E405 WeakPolarHBondContact CB-OE1 3.37Å; S402-E405 PolarHBondContact O-N 3.24Å; S402-E405 WeakPolarHBondContact OG-CB 3.28Å; S402-E405 VanDerWaalsContact OG-CG 3.23Å; S402-E405 WeakPolarHBondContact OG-CG 3.36Å; S402-E405 PolarHBondContact OG-N 2.82Å; S402-E405 PolarHBondContact OG-OE1 2.92Å; E405-I407 VanDerWaalsContact C-N 3.31Å; E405-I407 PolarHBondContact O-N 2.99Å; E405-S408 WeakPolarHBondContact O-CB 3.36Å; E405-S408 PolarHBondContact O-N 3.23Å; E405-S408 VanDerWaalsContact O-N 3.12Å; E405-E409 PolarHBondContact O-N 3.18Å
406	L	90.6	Very high	84.7	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.005	17%	0.165	C	C	.	.	H	α-helix	trans	-57.9	-43.8	177.3	178.1	65.3	0	0	0	111.6	Y398 S402 S404 E409 L410 I487	Y398-L406 HydrophobicContact CD1-CD1 3.78Å; Y398-L406 HydrophobicContact CG-CD1 4.33Å; Y398-L406 WeakPolarHBondContact O-CD2 3.44Å; S402-L406 WeakPolarHBondContact O-CB 3.2Å; S402-L406 PolarHBondContact O-N 2.91Å; S404-L406 VanDerWaalsContact C-N 3.34Å; L406-E409 PolarHBondContact O-N 3.41Å; L406-L410 HydrophobicContact CD1-CD1 4.11Å; L406-L410 HydrophobicContact CD1-CG 4.32Å; L406-L410 HydrophobicContact CG-CD1 3.88Å; L406-L410 HydrophobicContact CG-CG 4.5Å; L406-L410 WeakPolarHBondContact O-CB 3.5Å; L406-L410 WeakPolarHBondContact O-CD1 3.44Å; L406-L410 WeakPolarHBondContact O-CG 3.31Å; L406-L410 PolarHBondContact O-N 2.94Å; L406-I487 HydrophobicContact CD2-CD1 4.15Å
407	I	92	Very high	82.8	Confident	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-64.6	-42.1	176.9	-69.9	168	0	0	0	110.8	F328 T403 S404 E405 E409 L410 F411 I479 M482 A483	F328-I407 HydrophobicContact CB-CG2 4.18Å; F328-I407 HydrophobicContact CD2-CG2 4.48Å; F328-I407 HydrophobicContact CG-CG2 4.19Å; T403-I407 VanDerWaalsContact O-CG1 3.3Å; T403-I407 WeakPolarHBondContact O-CG1 3.5Å; T403-I407 PolarHBondContact O-N 3.29Å; T403-I407 VanDerWaalsContact O-N 3.14Å; S404-I407 PolarHBondContact O-N 3.44Å; E405-I407 VanDerWaalsContact C-N 3.31Å; E405-I407 PolarHBondContact O-N 2.99Å; I407-E409 PolarHBondContact O-N 3.4Å; I407-L410 PolarHBondContact O-N 2.9Å; I407-F411 HydrophobicContact CG2-CD1 4.25Å; I407-F411 HydrophobicContact CG2-CD2 3.85Å; I407-F411 HydrophobicContact CG2-CE1 3.88Å; I407-F411 HydrophobicContact CG2-CE2 3.45Å; I407-F411 VanDerWaalsContact CG2-CE2 3.45Å; I407-F411 HydrophobicContact CG2-CG 4.24Å; I407-F411 HydrophobicContact CG2-CZ 3.48Å; I407-F411 VanDerWaalsContact CG2-CZ 3.48Å; I407-F411 WeakPolarHBondContact O-CG 3.37Å; I407-F411 PolarHBondContact O-N 3.08Å; I407-I479 HydrophobicContact CD1-CG2 3.97Å; I407-M482 HydrophobicContact CD1-CB 3.97Å; I407-M482 HydrophobicContact CD1-CE 4.4Å; I407-A483 HydrophobicContact CD1-CB 4.14Å; I407-A483 HydrophobicContact CG1-CB 4.11Å
408	S	88.6	Confident	81.5	Confident	16 Å²	16	35.7 Å²	35.7	11%	0.112	20%	0.196	C	C	.	.	H	α-helix	trans	-58.3	-48.3	177.6	-170.3	0	0	0	0	111.4	L327 S404 E405 L410 F411 N412	L327-S408 PolarHBondContact O-OG 3.23Å; S404-S408 PolarHBondContact O-N 3.05Å; E405-S408 WeakPolarHBondContact O-CB 3.36Å; E405-S408 PolarHBondContact O-N 3.23Å; E405-S408 VanDerWaalsContact O-N 3.12Å; S408-L410 VanDerWaalsContact C-N 3.32Å; S408-L410 PolarHBondContact O-N 3.45Å; S408-F411 PolarHBondContact O-N 3.28Å; S408-N412 VanDerWaalsContact O-CG 3.26Å; S408-N412 PolarHBondContact O-N 2.87Å; S408-N412 PolarHBondContact O-ND2 3.48Å
409	E	87.6	Confident	80.1	Confident	30 Å²	30	39.3 Å²	39.3	14%	0.14	22%	0.222	C	C	.	.	H	α-helix	trans	-64.2	-33.1	177	-171.4	-179.6	-164.9	0	0	113.1	R401 E405 L406 I407 L422	R401-E409 IonicContact CZ-OE1 3.75Å; R401-E409 IonicContact CZ-OE2 2.78Å; R401-E409 IonicContact NH1-OE1 2.82Å; R401-E409 PolarHBondContact NH1-OE1 2.85Å; R401-E409 IonicContact NH1-OE2 3.68Å; R401-E409 PolarHBondContact NH1-OE2 3.46Å; E405-E409 PolarHBondContact O-N 3.18Å; L406-E409 PolarHBondContact O-N 3.41Å; I407-E409 PolarHBondContact O-N 3.4Å; E409-L422 HydrophobicContact CG-CD1 4.04Å
410	L	90.6	Very high	79.3	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-73.9	-29.7	177.2	-70.4	167.6	0	0	0	112.9	L406 I407 S408 L454 A486 I487 R490 A526	L406-L410 HydrophobicContact CD1-CD1 4.11Å; L406-L410 HydrophobicContact CD1-CG 4.32Å; L406-L410 HydrophobicContact CG-CD1 3.88Å; L406-L410 HydrophobicContact CG-CG 4.5Å; L406-L410 WeakPolarHBondContact O-CB 3.5Å; L406-L410 WeakPolarHBondContact O-CD1 3.44Å; L406-L410 WeakPolarHBondContact O-CG 3.31Å; L406-L410 PolarHBondContact O-N 2.94Å; I407-L410 PolarHBondContact O-N 2.9Å; S408-L410 VanDerWaalsContact C-N 3.32Å; S408-L410 PolarHBondContact O-N 3.45Å; L410-L454 HydrophobicContact CD2-CD1 4.28Å; L410-L454 HydrophobicContact CD2-CD2 4.06Å; L410-A486 HydrophobicContact CB-CB 4.33Å; L410-A486 HydrophobicContact CD1-CB 3.77Å; L410-I487 HydrophobicContact CD1-CG1 3.7Å; L410-R490 HydrophobicContact CD2-CB 3.77Å; L410-R490 HydrophobicContact CD2-CG 3.79Å; L410-R490 PolarHBondContact O-NH1 3.21Å; L410-A526 HydrophobicContact CB-CB 4.36Å; L410-A526 WeakPolarHBondContact O-CB 3.02Å
411	F	89.9	Confident	78.7	Confident	4 Å²	4	41.1 Å²	41.1	2%	0.018	24%	0.235	C	C	.	.	H	α-helix	trans	-82.6	-31.6	177.8	-69	-2.8	0	0	0	111.9	F328 V330 Y332 I407 S408 A486 G523 A526 M527 A530	F328-F411 HydrophobicContact CB-CD2 4.2Å; F328-F411 HydrophobicContact CD2-CD2 4.34Å; F328-F411 HydrophobicContact CD2-CE2 4.05Å; V330-F411 HydrophobicContact CG2-CB 3.65Å; Y332-F411 PolarHBondContact OH-O 3.25Å; I407-F411 HydrophobicContact CG2-CD1 4.25Å; I407-F411 HydrophobicContact CG2-CD2 3.85Å; I407-F411 HydrophobicContact CG2-CE1 3.88Å; I407-F411 HydrophobicContact CG2-CE2 3.45Å; I407-F411 VanDerWaalsContact CG2-CE2 3.45Å; I407-F411 HydrophobicContact CG2-CG 4.24Å; I407-F411 HydrophobicContact CG2-CZ 3.48Å; I407-F411 VanDerWaalsContact CG2-CZ 3.48Å; I407-F411 WeakPolarHBondContact O-CG 3.37Å; I407-F411 PolarHBondContact O-N 3.08Å; S408-F411 PolarHBondContact O-N 3.28Å; F411-A486 HydrophobicContact CE1-CB 3.89Å; F411-G523 WeakPolarHBondContact O-CA 2.97Å; F411-A526 HydrophobicContact CD1-CB 3.89Å; F411-A526 HydrophobicContact CE1-CB 4.2Å; F411-M527 HydrophobicContact CB-CG 4.37Å; F411-M527 HydrophobicContact CD1-CG 3.59Å; F411-M527 HydrophobicContact CD2-CG 3.86Å; F411-M527 HydrophobicContact CD2-SD 4.34Å; F411-M527 HydrophobicContact CE1-CB 4.24Å; F411-M527 HydrophobicContact CE1-CG 3.69Å; F411-M527 HydrophobicContact CE2-CG 3.95Å; F411-M527 HydrophobicContact CG-CG 3.69Å; F411-M527 HydrophobicContact CZ-CB 4.38Å; F411-M527 HydrophobicContact CZ-CG 3.86Å; F411-A530 HydrophobicContact CE1-CB 4.06Å; F411-A530 HydrophobicContact CZ-CB 3.84Å
412	N	84.9	Confident	78.5	Confident	49 Å²	49	36.7 Å²	36.7	26%	0.262	22%	0.219	S	C	.	.	S	Bend	trans	-64.5	141.2	179	-71.2	-28.2	0	0	0	112.1	V330 S408 R490	V330-N412 VanDerWaalsContact CG2-OD1 3.32Å; V330-N412 WeakPolarHBondContact CG2-OD1 3.38Å; S408-N412 VanDerWaalsContact O-CG 3.26Å; S408-N412 PolarHBondContact O-N 2.87Å; S408-N412 PolarHBondContact O-ND2 3.48Å; N412-R490 PolarHBondContact O-NH1 3.05Å; N412-R490 PolarHBondContact O-NH2 3.48Å
413	D	77.8	Confident	78.1	Confident	53 Å²	53	36.6 Å²	36.6	28%	0.283	22%	0.218	S	C	.	.			trans	-86.7	153.4	168.2	-69.8	-31.4	0	0	0	110.2	Y332 G415 G523	Y332-D413 WeakPolarHBondContact CD1-OD2 3.39Å; Y332-D413 WeakPolarHBondContact CE1-OD2 3.17Å; D413-G415 PolarHBondContact O-N 2.63Å; D413-G415 VanDerWaalsContact O-N 3.14Å; D413-G523 PolarHBondContact OD1-N 2.69Å
414	C	74.9	Confident	77.8	Confident	24 Å²	24	39.3 Å²	39.3	16%	0.162	23%	0.232	C	C	.	.			trans	-76.3	103.5	-172.2	-73.2	0	0	0	0	112.2	L422 C423	C414-L422 PolarHBondContact SG-O 3.44Å; C414-C423 WeakPolarHBondContact CA-SG 3.42Å; C414-C423 HydrophobicContact CB-CB 3.54Å; C414-C423 WeakPolarHBondContact CB-SG 3.48Å; C414-C423 WeakPolarHBondContact SG-CA 3.46Å; C414-C423 WeakPolarHBondContact SG-CB 3.36Å; C414-C423 CovalentContact SG-SG 2.04Å; C414-C423 PolarHBondContact SG-SG 3.02Å
415	G	64.6	Low	77.5	Confident	36 Å²	36	39 Å²	39	37%	0.371	23%	0.228	S	C	.	.			trans	-75.4	165.1	174.4	0	0	0	0	0	114	D413 L417 E418	D413-G415 PolarHBondContact O-N 2.63Å; D413-G415 VanDerWaalsContact O-N 3.14Å; G415-L417 PolarHBondContact O-N 3.25Å; G415-E418 PolarHBondContact O-N 3.04Å
416	A	52.7	Low	77.1	Confident	62 Å²	62	43.3 Å²	43.3	51%	0.512	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-16.8	-178.3	0	0	0	0	0	114.8	V435 I438	A416-V435 HydrophobicContact CB-CG1 4.11Å; A416-I438 HydrophobicContact CB-CD1 4.04Å
417	L	52.2	Low	76.1	Confident	113 Å²	113	48.5 Å²	48.5	59%	0.592	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	1.8	-178.2	-85.6	84.9	0	0	0	113.5	F132 G415	F132-L417 HydrophobicContact CE1-CD2 3.81Å; F132-L417 HydrophobicContact CZ-CD2 4.33Å; G415-L417 PolarHBondContact O-N 3.25Å
418	E	61	Low	74.8	Confident	82 Å²	82	53.9 Å²	53.9	38%	0.383	30%	0.299	S	S	.	.			trans	-93.8	121.3	-172.3	-160.2	160.1	-160.7	0	0	111	G415	G415-E418 PolarHBondContact O-N 3.04Å
419	S	59.9	Low	73.3	Confident	80 Å²	80	59 Å²	59	56%	0.559	33%	0.332	S	S	*	.			trans	-93.8	15.6	-173.6	59	0	0	0	0	113.7	D136	D136-S419 WeakPolarHBondContact OD2-CB 3.48Å; D136-S419 PolarHBondContact OD2-OG 3.22Å
420	S	72.5	Confident	71.9	Confident	21 Å²	21	64.8 Å²	64.8	15%	0.147	36%	0.364	C	S	.	.			trans	-68.2	149.4	-177.4	79.5	0	0	0	0	111.3	L422 C423 D424	S420-L422 PolarHBondContact O-N 3.09Å; S420-L422 VanDerWaalsContact O-N 3.15Å; S420-C423 PolarHBondContact O-N 2.89Å; S420-C423 PolarHBondContact OG-N 3.42Å; S420-C423 PolarHBondContact OG-SG 2.92Å; S420-D424 PolarHBondContact O-N 3.21Å
421	Q	76.6	Confident	70.2	Confident	88 Å²	88	69.7 Å²	69.7	41%	0.411	39%	0.388	S	S	.	.	G	3₁₀ helix	trans	-61.2	-24.6	177	-65.8	-176.8	-5.4	0	0	112.5	C423 G446 V447 A450	Q421-C423 PolarHBondContact O-N 3.33Å; Q421-G446 CarbonylContact O-C 3.22Å; Q421-G446 VanDerWaalsContact O-C 3.22Å; Q421-V447 PolarHBondContact O-N 3.1Å; Q421-A450 HydrophobicContact CB-CB 4.18Å
422	L	81.9	Confident	68.2	Low	2 Å²	2	75.3 Å²	75.3	1%	0.01	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-68.9	-19.1	173.7	-86.4	146.4	0	0	0	113.1	Y398 E409 C414 S420 Y425 A450 L454 R490 I494	Y398-L422 HydrophobicContact CE1-CD1 3.67Å; E409-L422 HydrophobicContact CG-CD1 4.04Å; C414-L422 PolarHBondContact SG-O 3.44Å; S420-L422 PolarHBondContact O-N 3.09Å; S420-L422 VanDerWaalsContact O-N 3.15Å; L422-Y425 VanDerWaalsContact O-CE2 3.3Å; L422-Y425 WeakPolarHBondContact O-CE2 3.21Å; L422-A450 HydrophobicContact CG-CB 4.37Å; L422-L454 HydrophobicContact CD2-CD1 4.04Å; L422-R490 HydrophobicContact CD2-CG 4.1Å; L422-I494 HydrophobicContact CD2-CD1 3.99Å
423	C	78.6	Confident	66.7	Low	17 Å²	17	80.6 Å²	80.6	12%	0.115	44%	0.444	C	S	.	.	G	3₁₀ helix	trans	-112.8	10.5	-175.6	-59.5	0	0	0	0	113.5	C414 S420 Q421 Y425	C414-C423 WeakPolarHBondContact CA-SG 3.42Å; C414-C423 HydrophobicContact CB-CB 3.54Å; C414-C423 WeakPolarHBondContact CB-SG 3.48Å; C414-C423 WeakPolarHBondContact SG-CA 3.46Å; C414-C423 WeakPolarHBondContact SG-CB 3.36Å; C414-C423 CovalentContact SG-SG 2.04Å; C414-C423 PolarHBondContact SG-SG 3.02Å; S420-C423 PolarHBondContact O-N 2.89Å; S420-C423 PolarHBondContact OG-N 3.42Å; S420-C423 PolarHBondContact OG-SG 2.92Å; Q421-C423 PolarHBondContact O-N 3.33Å; C423-Y425 VanDerWaalsContact C-N 3.25Å; C423-Y425 PolarHBondContact O-N 2.96Å
424	D	82.6	Confident	65.4	Low	73 Å²	73	82.7 Å²	82.7	39%	0.39	46%	0.461	S	S	.	.			trans	-77.8	71.5	175.2	-174	32.7	0	0	0	111.7	S420 G444 G446 V447	S420-D424 PolarHBondContact O-N 3.21Å; D424-G444 WeakPolarHBondContact O-CA 3.3Å; D424-G444 PolarHBondContact O-N 2.97Å; D424-G446 WeakPolarHBondContact OD2-CA 3.48Å; D424-G446 PolarHBondContact OD2-N 3.08Å; D424-V447 VanDerWaalsContact O-CG2 3.31Å; D424-V447 WeakPolarHBondContact O-CG2 3.44Å
425	Y	81.4	Confident	64.3	Low	13 Å²	13	85.8 Å²	85.8	5%	0.051	48%	0.479	C	S	.	.	B	Isolated β-bridge	trans	-97.3	151.4	173.8	-71.4	-100.3	0	0	0	110.9	L422 C423 N427 R441 V447 E497	L422-Y425 VanDerWaalsContact O-CE2 3.3Å; L422-Y425 WeakPolarHBondContact O-CE2 3.21Å; C423-Y425 VanDerWaalsContact C-N 3.25Å; C423-Y425 PolarHBondContact O-N 2.96Å; Y425-N427 PolarHBondContact O-N 3.42Å; Y425-N427 PolarHBondContact O-OD1 3.35Å; Y425-R441 HydrophobicContact CD1-CB 3.89Å; Y425-R441 WeakPolarHBondContact CD1-O 3.41Å; Y425-R441 HydrophobicContact CG-CB 4.23Å; Y425-V447 HydrophobicContact CD2-CG2 3.99Å; Y425-V447 HydrophobicContact CE2-CG2 3.82Å; Y425-V447 HydrophobicContact CG-CG2 4.45Å; Y425-E497 VanDerWaalsContact CE1-OE1 3.28Å; Y425-E497 WeakPolarHBondContact CE1-OE1 3.41Å; Y425-E497 PolarHBondContact OH-OE2 3.48Å
426	Y	78.3	Confident	63.7	Low	145 Å²	145	90.6 Å²	90.6	57%	0.569	50%	0.496	S	S	*	.			trans	-67.7	111.3	175.7	-76.6	-73.7	0	0	0	110.9	P442	Y426-P442 PolarHBondContact N-O 3.28Å; Y426-P442 VanDerWaalsContact N-O 3.13Å
427	N	69.8	Low	63.8	Low	111 Å²	111	92.4 Å²	92.4	59%	0.594	50%	0.497	S	S	*	.			trans	-87.4	126.7	178.2	-68	-20	0	0	0	110.9	Y425 P429 R441	Y425-N427 PolarHBondContact O-N 3.42Å; Y425-N427 PolarHBondContact O-OD1 3.35Å; N427-P429 WeakPolarHBondContact O-CD 3.46Å; N427-R441 PolarHBondContact OD1-NH1 3.19Å
428	N	64.6	Low	64.4	Low	112 Å²	112	88.9 Å²	88.9	60%	0.599	48%	0.478	S	S	*	.			trans	-90.3	113.6	173.4	-148.2	-9.6	0	0	0	108.8	N430 M431	N428-N430 PolarHBondContact O-N 3.46Å; N428-M431 WeakPolarHBondContact O-CB 3.33Å; N428-M431 PolarHBondContact O-N 3.19Å; N428-M431 VanDerWaalsContact O-N 3.12Å
429	P	57.7	Low	64.9	Low	124 Å²	124	85.5 Å²	85.5	81%	0.805	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-9.8	-172	24.5	-33.6	0	0	0	114.4	N427 M431	N427-P429 WeakPolarHBondContact O-CD 3.46Å; P429-M431 VanDerWaalsContact C-N 3.33Å
430	N	56.6	Low	65.5	Low	151 Å²	151	82.4 Å²	82.4	81%	0.807	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	1.3	175.3	-79	-9.9	0	0	0	114.2	N428 S432	N428-N430 PolarHBondContact O-N 3.46Å; N430-S432 PolarHBondContact O-N 2.89Å
431	M	56.1	Low	65.8	Low	104 Å²	104	83.4 Å²	83.4	51%	0.512	44%	0.441	S	S	.	.			trans	-89.4	89.9	-177.6	-159.9	74.9	74.1	0	0	111.3	N428 P429 R433 P439	N428-M431 WeakPolarHBondContact O-CB 3.33Å; N428-M431 PolarHBondContact O-N 3.19Å; N428-M431 VanDerWaalsContact O-N 3.12Å; P429-M431 VanDerWaalsContact C-N 3.33Å; M431-R433 PolarHBondContact O-N 3.09Å; M431-P439 HydrophobicContact CE-CG 4.21Å
432	S	48.2	Very low	66	Low	122 Å²	122	80.8 Å²	80.8	85%	0.853	43%	0.432	S	S	*	.			trans	-86.9	73	173.7	60.3	0	0	0	0	111	N430	N430-S432 PolarHBondContact O-N 2.89Å
433	R	52.2	Low	66.2	Low	159 Å²	159	81 Å²	81	60%	0.6	43%	0.434	S	S	*	.			trans	-120.1	156.7	169.5	-80.9	-167.4	-179.6	170.1	4.8	111	M431 G516	M431-R433 PolarHBondContact O-N 3.09Å; R433-G516 PolarHBondContact NH1-O 3.05Å; R433-G516 VanDerWaalsContact NH1-O 3.15Å
434	P	51.1	Low	66.5	Low	98 Å²	98	80.2 Å²	80.2	64%	0.636	43%	0.429	S	S	*	.			trans	-58.4	157.1	-177.8	-16.5	29.8	0	0	0	111.8	D436	P434-D436 PolarHBondContact O-N 3.27Å
435	V	52.7	Low	66.6	Low	88 Å²	88	80.1 Å²	80.1	53%	0.533	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-15.8	-171.7	173.9	0	0	0	0	114.2	A416	A416-V435 HydrophobicContact CB-CG1 4.11Å
436	D	50.4	Low	66.8	Low	138 Å²	138	80 Å²	80	74%	0.738	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.8	-10.1	-166.5	-54.9	-35.1	0	0	0	115.1	P434	P434-D436 PolarHBondContact O-N 3.27Å
437	D	56.5	Low	67.2	Low	99 Å²	99	73.1 Å²	73.1	53%	0.529	41%	0.408	S	S	.	.			trans	-128.1	75.3	177.6	-87.2	-27.1	0	0	0	109.7
438	I	64.9	Low	68.1	Low	39 Å²	39	74.4 Å²	74.4	20%	0.2	41%	0.406	C	S	.	.	P	Polyproline II helix	trans	-87.5	120.5	-178.9	-44.7	172.3	0	0	0	108.9	A416	A416-I438 HydrophobicContact CB-CD1 4.04Å
439	P	69.5	Low	69.3	Low	12 Å²	12	73.6 Å²	73.6	8%	0.078	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-67.2	159.7	-177.2	28.1	-35.4	0	0	0	112.4	M431 R441	M431-P439 HydrophobicContact CE-CG 4.21Å; P439-R441 WeakPolarHBondContact O-CG 3.48Å; P439-R441 PolarHBondContact O-N 2.84Å
440	D	73.5	Confident	70.9	Confident	14 Å²	14	67.8 Å²	67.8	8%	0.075	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-52	133.5	173.4	-63.3	1.2	0	0	0	110.7	Y501 D518 C519	D440-Y501 HydrophobicContact CB-CD2 4.15Å; D440-Y501 WeakPolarHBondContact O-CD2 3.38Å; D440-Y501 WeakPolarHBondContact O-CE2 3.44Å; D440-D518 WeakPolarHBondContact OD1-CA 3.17Å; D440-C519 PolarHBondContact OD1-N 2.9Å; D440-C519 WeakPolarHBondContact OD2-CB 2.97Å
441	R	78.1	Confident	72.5	Confident	42 Å²	42	62.3 Å²	62.3	16%	0.158	33%	0.334	C	S	.	.			trans	-128.5	155.8	-174.4	-78.4	167.8	-68.8	178.9	1.8	110.9	Y425 N427 P439 A443 Q498	Y425-R441 HydrophobicContact CD1-CB 3.89Å; Y425-R441 WeakPolarHBondContact CD1-O 3.41Å; Y425-R441 HydrophobicContact CG-CB 4.23Å; N427-R441 PolarHBondContact OD1-NH1 3.19Å; P439-R441 WeakPolarHBondContact O-CG 3.48Å; P439-R441 PolarHBondContact O-N 2.84Å; R441-A443 PolarHBondContact O-N 2.92Å; R441-Q498 PolarHBondContact O-NE2 2.99Å
442	P	82.5	Confident	74.2	Confident	33 Å²	33	65.3 Å²	65.3	21%	0.214	34%	0.339	C	S	.	.			trans	-70	135.3	172.6	23.9	-21	0	0	0	109.8	Y426 G444 Y501	Y426-P442 PolarHBondContact N-O 3.28Å; Y426-P442 VanDerWaalsContact N-O 3.13Å; P442-G444 PolarHBondContact O-N 3.36Å; P442-Y501 HydrophobicContact CB-CD1 4.27Å; P442-Y501 HydrophobicContact CB-CE1 3.77Å; P442-Y501 HydrophobicContact CG-CE1 3.93Å
443	A	84.4	Confident	76.3	Confident	6 Å²	6	61.6 Å²	61.6	5%	0.05	31%	0.308	C	S	.	.	B	Isolated β-bridge	trans	-58.1	130.5	177.9	0	0	0	0	0	111.4	R441 V447 Y448 Q498	R441-A443 PolarHBondContact O-N 2.92Å; A443-V447 HydrophobicContact CB-CB 3.96Å; A443-V447 HydrophobicContact CB-CG1 3.78Å; A443-Y448 HydrophobicContact CB-CE2 3.97Å; A443-Y448 WeakPolarHBondContact O-CE2 3.17Å; A443-Q498 HydrophobicContact CB-CG 4.19Å
444	G	85	Confident	78.4	Confident	1 Å²	1	54 Å²	54	1%	0.01	28%	0.28	C	S	.	.			trans	-82.8	174.9	171.8	0	0	0	0	0	112.9	D424 P442 G446 V447 Y448	D424-G444 WeakPolarHBondContact O-CA 3.3Å; D424-G444 PolarHBondContact O-N 2.97Å; P442-G444 PolarHBondContact O-N 3.36Å; G444-G446 PolarHBondContact O-N 3.48Å; G444-V447 PolarHBondContact O-N 3.43Å; G444-V447 VanDerWaalsContact O-N 3.14Å; G444-Y448 WeakPolarHBondContact O-CD2 3.27Å; G444-Y448 PolarHBondContact O-N 2.92Å
445	P	85.3	Confident	80.4	Confident	71 Å²	71	51.8 Å²	51.8	46%	0.461	27%	0.265	S	S	.	.	H	α-helix	trans	-60.1	-30.7	179.4	25.5	-33.8	0	0	0	112.9	Y448 N449	P445-Y448 PolarHBondContact O-N 3.08Å; P445-N449 PolarHBondContact O-N 2.95Å; P445-N449 VanDerWaalsContact O-N 3.09Å; P445-N449 PolarHBondContact O-ND2 2.97Å
446	G	85.3	Confident	82.4	Confident	10 Å²	10	51.3 Å²	51.3	10%	0.103	26%	0.259	C	S	.	.	H	α-helix	trans	-63.7	-42.3	174.1	0	0	0	0	0	113	Q421 D424 G444 Y448 N449 A450	Q421-G446 CarbonylContact O-C 3.22Å; Q421-G446 VanDerWaalsContact O-C 3.22Å; D424-G446 WeakPolarHBondContact OD2-CA 3.48Å; D424-G446 PolarHBondContact OD2-N 3.08Å; G444-G446 PolarHBondContact O-N 3.48Å; G446-Y448 PolarHBondContact O-N 3.09Å; G446-N449 PolarHBondContact O-N 3.48Å; G446-A450 WeakPolarHBondContact O-CB 3.29Å; G446-A450 PolarHBondContact O-N 3.46Å
447	V	87.3	Confident	84.6	Confident	2 Å²	2	44.8 Å²	44.8	1%	0.012	22%	0.223	C	C	.	.	H	α-helix	trans	-64.3	-41.7	177.6	173.9	0	0	0	0	111.1	Q421 D424 Y425 A443 G444 N449 A450 M451 I494	Q421-V447 PolarHBondContact O-N 3.1Å; D424-V447 VanDerWaalsContact O-CG2 3.31Å; D424-V447 WeakPolarHBondContact O-CG2 3.44Å; Y425-V447 HydrophobicContact CD2-CG2 3.99Å; Y425-V447 HydrophobicContact CE2-CG2 3.82Å; Y425-V447 HydrophobicContact CG-CG2 4.45Å; A443-V447 HydrophobicContact CB-CB 3.96Å; A443-V447 HydrophobicContact CB-CG1 3.78Å; G444-V447 PolarHBondContact O-N 3.43Å; G444-V447 VanDerWaalsContact O-N 3.14Å; V447-N449 PolarHBondContact O-N 3.4Å; V447-A450 WeakPolarHBondContact O-CB 3.28Å; V447-A450 PolarHBondContact O-N 3.03Å; V447-M451 HydrophobicContact CG1-CG 4.41Å; V447-M451 WeakPolarHBondContact O-CB 3.37Å; V447-M451 VanDerWaalsContact O-CG 3.24Å; V447-M451 WeakPolarHBondContact O-CG 3.49Å; V447-M451 PolarHBondContact O-N 3.3Å; V447-I494 HydrophobicContact CG1-CG2 4.02Å
448	Y	88.6	Confident	86.4	Confident	138 Å²	138	41.2 Å²	41.2	54%	0.541	20%	0.204	S	C	.	.	H	α-helix	trans	-62.9	-41.6	175	-70.3	-70.8	0	0	0	112.5	A443 G444 P445 G446 M451 W452	A443-Y448 HydrophobicContact CB-CE2 3.97Å; A443-Y448 WeakPolarHBondContact O-CE2 3.17Å; G444-Y448 WeakPolarHBondContact O-CD2 3.27Å; G444-Y448 PolarHBondContact O-N 2.92Å; P445-Y448 PolarHBondContact O-N 3.08Å; G446-Y448 PolarHBondContact O-N 3.09Å; Y448-M451 PolarHBondContact O-N 3.12Å; Y448-W452 PolarHBondContact O-N 3.41Å; Y448-W452 VanDerWaalsContact O-N 3.14Å
449	N	90.3	Very high	87.9	Confident	95 Å²	95	44.1 Å²	44.1	51%	0.508	22%	0.219	S	C	.	.	H	α-helix	trans	-63.4	-43.1	174.4	-76.8	-22.4	0	0	0	111.5	P445 G446 V447 W452 Q453	P445-N449 PolarHBondContact O-N 2.95Å; P445-N449 VanDerWaalsContact O-N 3.09Å; P445-N449 PolarHBondContact O-ND2 2.97Å; G446-N449 PolarHBondContact O-N 3.48Å; V447-N449 PolarHBondContact O-N 3.4Å; N449-W452 PolarHBondContact O-N 2.9Å; N449-Q453 VanDerWaalsContact O-CG 3.29Å; N449-Q453 WeakPolarHBondContact O-CG 3.22Å; N449-Q453 PolarHBondContact O-N 3.02Å
450	A	89.6	Confident	89.1	Confident	1 Å²	1	45 Å²	45	1%	0.008	22%	0.222	C	C	.	.	H	α-helix	trans	-60.3	-45	175.8	0	0	0	0	0	111.4	Y398 Q421 L422 G446 V447 W452 Q453 L454	Y398-A450 HydrophobicContact CE2-CB 4.32Å; Y398-A450 VanDerWaalsContact OH-CB 3.27Å; Y398-A450 WeakPolarHBondContact OH-CB 3.05Å; Q421-A450 HydrophobicContact CB-CB 4.18Å; L422-A450 HydrophobicContact CG-CB 4.37Å; G446-A450 WeakPolarHBondContact O-CB 3.29Å; G446-A450 PolarHBondContact O-N 3.46Å; V447-A450 WeakPolarHBondContact O-CB 3.28Å; V447-A450 PolarHBondContact O-N 3.03Å; A450-W452 VanDerWaalsContact C-N 3.34Å; A450-W452 PolarHBondContact O-N 3.47Å; A450-Q453 PolarHBondContact O-N 3.18Å; A450-L454 WeakPolarHBondContact O-CB 3.44Å; A450-L454 VanDerWaalsContact O-CG 3.29Å; A450-L454 WeakPolarHBondContact O-CG 3.43Å; A450-L454 PolarHBondContact O-N 3.1Å
451	M	91.1	Very high	90.1	Very high	37 Å²	37	44.7 Å²	44.7	18%	0.182	22%	0.22	C	C	.	.	H	α-helix	trans	-59.1	-42.5	177.5	-74.7	-68.3	-71.8	0	0	112.6	V447 Y448 T455 I491 I494	V447-M451 HydrophobicContact CG1-CG 4.41Å; V447-M451 WeakPolarHBondContact O-CB 3.37Å; V447-M451 VanDerWaalsContact O-CG 3.24Å; V447-M451 WeakPolarHBondContact O-CG 3.49Å; V447-M451 PolarHBondContact O-N 3.3Å; Y448-M451 PolarHBondContact O-N 3.12Å; M451-T455 WeakPolarHBondContact O-CB 3.33Å; M451-T455 PolarHBondContact O-N 3.28Å; M451-T455 PolarHBondContact O-OG1 3.22Å; M451-I491 HydrophobicContact CE-CB 4.08Å; M451-I491 HydrophobicContact CE-CG1 4.2Å; M451-I491 HydrophobicContact CE-CG2 3.68Å; M451-I491 HydrophobicContact SD-CB 4.47Å; M451-I491 HydrophobicContact SD-CG1 4.16Å; M451-I494 HydrophobicContact CG-CG2 4.45Å; M451-I494 HydrophobicContact SD-CB 4.04Å; M451-I494 HydrophobicContact SD-CD1 3.76Å; M451-I494 HydrophobicContact SD-CG1 4.48Å; M451-I494 HydrophobicContact SD-CG2 4.06Å
452	W	91.9	Very high	90.9	Very high	167 Å²	167	44.5 Å²	44.5	63%	0.633	22%	0.221	S	C	*	.	H	α-helix	trans	-65.1	-46.3	174.8	178.5	-110	0	0	0	112	Y448 N449 A450 L454 T455 L456	Y448-W452 PolarHBondContact O-N 3.41Å; Y448-W452 VanDerWaalsContact O-N 3.14Å; N449-W452 PolarHBondContact O-N 2.9Å; A450-W452 VanDerWaalsContact C-N 3.34Å; A450-W452 PolarHBondContact O-N 3.47Å; W452-L454 VanDerWaalsContact C-N 3.34Å; W452-L454 PolarHBondContact O-N 3.26Å; W452-T455 PolarHBondContact O-N 3.32Å; W452-L456 HydrophobicContact CZ2-CD1 4.39Å; W452-L456 HydrophobicContact CZ2-CD2 4.31Å; W452-L456 HydrophobicContact CZ2-CG 4.47Å; W452-L456 PolarHBondContact O-N 2.74Å
453	Q	93.1	Very high	91.5	Very high	43 Å²	43	46.4 Å²	46.4	20%	0.201	23%	0.232	C	C	.	.	H	α-helix	trans	-64.9	-36.8	178.4	-68.4	174.9	18.4	0	0	112.4	N396 Y398 N449 A450 L456 A457	N396-Q453 PolarHBondContact ND2-O 3.45Å; Y398-Q453 HydrophobicContact CD2-CB 3.68Å; Y398-Q453 HydrophobicContact CE2-CB 3.78Å; Y398-Q453 VanDerWaalsContact CE2-OE1 3.27Å; N449-Q453 VanDerWaalsContact O-CG 3.29Å; N449-Q453 WeakPolarHBondContact O-CG 3.22Å; N449-Q453 PolarHBondContact O-N 3.02Å; A450-Q453 PolarHBondContact O-N 3.18Å; Q453-L456 PolarHBondContact O-N 2.74Å; Q453-A457 WeakPolarHBondContact O-CB 3.5Å; Q453-A457 PolarHBondContact O-N 3.48Å
454	L	94.2	Very high	92	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-66.5	-38.8	173.5	-76.2	178.3	0	0	0	111.7	Y398 L410 L422 A450 W452 A457 L458 I487 I491	Y398-L454 HydrophobicContact CD1-CD2 3.97Å; Y398-L454 HydrophobicContact CD2-CD2 4.08Å; Y398-L454 HydrophobicContact CD2-CG 4.3Å; Y398-L454 HydrophobicContact CE1-CD2 4.33Å; Y398-L454 HydrophobicContact CE2-CD2 4.43Å; Y398-L454 HydrophobicContact CE2-CG 4.3Å; Y398-L454 HydrophobicContact CG-CD2 3.84Å; L410-L454 HydrophobicContact CD2-CD1 4.28Å; L410-L454 HydrophobicContact CD2-CD2 4.06Å; L422-L454 HydrophobicContact CD2-CD1 4.04Å; A450-L454 WeakPolarHBondContact O-CB 3.44Å; A450-L454 VanDerWaalsContact O-CG 3.29Å; A450-L454 WeakPolarHBondContact O-CG 3.43Å; A450-L454 PolarHBondContact O-N 3.1Å; W452-L454 VanDerWaalsContact C-N 3.34Å; W452-L454 PolarHBondContact O-N 3.26Å; L454-A457 CarbonylContact O-C 3.59Å; L454-A457 WeakPolarHBondContact O-CB 3.21Å; L454-A457 PolarHBondContact O-N 2.66Å; L454-L458 WeakPolarHBondContact O-CB 3.44Å; L454-L458 PolarHBondContact O-N 3.28Å; L454-I487 HydrophobicContact CB-CG2 4.07Å; L454-I487 HydrophobicContact CD2-CG1 4.45Å; L454-I487 HydrophobicContact CD2-CG2 4.23Å; L454-I487 WeakPolarHBondContact O-CG2 3.32Å; L454-I491 HydrophobicContact CB-CD1 4.13Å; L454-I491 HydrophobicContact CB-CG1 4.24Å
455	T	94.9	Very high	92.4	Very high	52 Å²	52	46.8 Å²	46.8	32%	0.319	23%	0.233	S	C	.	.	H	α-helix	trans	-63.2	-43.3	175.3	-57.7	0	0	0	0	111.2	M451 W452 L458 I459	M451-T455 WeakPolarHBondContact O-CB 3.33Å; M451-T455 PolarHBondContact O-N 3.28Å; M451-T455 PolarHBondContact O-OG1 3.22Å; W452-T455 PolarHBondContact O-N 3.32Å; T455-L458 WeakPolarHBondContact O-CB 3.48Å; T455-L458 PolarHBondContact O-N 3.1Å; T455-I459 WeakPolarHBondContact O-CG1 3.44Å; T455-I459 PolarHBondContact O-N 3.14Å
456	L	94.8	Very high	92.9	Very high	78 Å²	78	44.3 Å²	44.3	41%	0.408	22%	0.216	S	C	.	.	H	α-helix	trans	-64.1	-40.4	173	-68.4	176.8	0	0	0	111.9	W452 Q453 L458 I459 F460	W452-L456 HydrophobicContact CZ2-CD1 4.39Å; W452-L456 HydrophobicContact CZ2-CD2 4.31Å; W452-L456 HydrophobicContact CZ2-CG 4.47Å; W452-L456 PolarHBondContact O-N 2.74Å; Q453-L456 PolarHBondContact O-N 2.74Å; L456-L458 VanDerWaalsContact C-N 3.33Å; L456-L458 PolarHBondContact O-N 3.44Å; L456-I459 PolarHBondContact O-N 3.32Å; L456-F460 WeakPolarHBondContact O-CB 3.48Å; L456-F460 PolarHBondContact O-N 3.25Å
457	A	94.8	Very high	93.3	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-62.7	-39.3	176	0	0	0	0	0	111.9	T399 Q453 L454 F460 K461 I487	T399-A457 HydrophobicContact CG2-CB 3.58Å; Q453-A457 WeakPolarHBondContact O-CB 3.5Å; Q453-A457 PolarHBondContact O-N 3.48Å; L454-A457 CarbonylContact O-C 3.59Å; L454-A457 WeakPolarHBondContact O-CB 3.21Å; L454-A457 PolarHBondContact O-N 2.66Å; A457-F460 PolarHBondContact O-N 3.24Å; A457-K461 WeakPolarHBondContact O-CB 3.48Å; A457-K461 VanDerWaalsContact O-CG 3.26Å; A457-K461 WeakPolarHBondContact O-CG 3.41Å; A457-K461 PolarHBondContact O-N 3.29Å; A457-I487 HydrophobicContact CB-CD1 4.38Å
458	L	95.9	Very high	93.5	Very high	25 Å²	25	47.1 Å²	47.1	13%	0.131	23%	0.225	C	C	.	.	H	α-helix	trans	-60.6	-51.3	177.1	-178.5	63.5	0	0	0	111	L454 T455 L456 F460 K461 I462 V484 I487 A488 I491	L454-L458 WeakPolarHBondContact O-CB 3.44Å; L454-L458 PolarHBondContact O-N 3.28Å; T455-L458 WeakPolarHBondContact O-CB 3.48Å; T455-L458 PolarHBondContact O-N 3.1Å; L456-L458 VanDerWaalsContact C-N 3.33Å; L456-L458 PolarHBondContact O-N 3.44Å; L458-F460 VanDerWaalsContact C-N 3.33Å; L458-F460 PolarHBondContact O-N 3.47Å; L458-K461 PolarHBondContact O-N 3.18Å; L458-I462 HydrophobicContact CD1-CD1 4.08Å; L458-I462 HydrophobicContact CD1-CG1 4.49Å; L458-I462 HydrophobicContact CG-CD1 4Å; L458-I462 WeakPolarHBondContact O-CB 3.44Å; L458-I462 WeakPolarHBondContact O-CG1 3.29Å; L458-I462 PolarHBondContact O-N 3.4Å; L458-V484 HydrophobicContact CD1-CG1 3.84Å; L458-V484 WeakPolarHBondContact CD1-O 3.45Å; L458-I487 HydrophobicContact CB-CG2 3.82Å; L458-I487 HydrophobicContact CD1-CB 4.28Å; L458-I487 HydrophobicContact CD1-CG2 4.25Å; L458-A488 HydrophobicContact CD1-CB 4.3Å; L458-A488 HydrophobicContact CD2-CB 4.38Å; L458-I491 HydrophobicContact CD2-CD1 4.49Å
459	I	95.6	Very high	93.7	Very high	99 Å²	99	40.9 Å²	40.9	51%	0.508	20%	0.201	S	C	.	.	H	α-helix	trans	-60.5	-46.4	178.6	-64.4	168	0	0	0	110.1	T455 L456 I462 V463	T455-I459 WeakPolarHBondContact O-CG1 3.44Å; T455-I459 PolarHBondContact O-N 3.14Å; L456-I459 PolarHBondContact O-N 3.32Å; I459-I462 PolarHBondContact O-N 3.37Å; I459-V463 WeakPolarHBondContact O-CG2 3.34Å; I459-V463 PolarHBondContact O-N 3.47Å; I459-V463 VanDerWaalsContact O-N 3.1Å
460	F	94.6	Very high	93.6	Very high	31 Å²	31	37.7 Å²	37.7	14%	0.136	19%	0.19	C	C	.	.	H	α-helix	trans	-59.7	-49	178.2	174	-106.7	0	0	0	112.1	T389 L392 A393 T399 L456 A457 L458 I462 V463 I464	T389-F460 HydrophobicContact CG2-CZ 4.04Å; L392-F460 HydrophobicContact CB-CD2 4.09Å; L392-F460 HydrophobicContact CB-CE2 3.5Å; L392-F460 HydrophobicContact CB-CZ 4.19Å; L392-F460 HydrophobicContact CD1-CD2 4.38Å; L392-F460 HydrophobicContact CD1-CE2 4Å; L392-F460 HydrophobicContact CG-CE2 4.41Å; A393-F460 HydrophobicContact CB-CE1 4.16Å; A393-F460 HydrophobicContact CB-CZ 4.16Å; T399-F460 HydrophobicContact CG2-CB 4.47Å; T399-F460 HydrophobicContact CG2-CD1 3.55Å; T399-F460 HydrophobicContact CG2-CE1 4.17Å; T399-F460 HydrophobicContact CG2-CG 4.31Å; L456-F460 WeakPolarHBondContact O-CB 3.48Å; L456-F460 PolarHBondContact O-N 3.25Å; A457-F460 PolarHBondContact O-N 3.24Å; L458-F460 VanDerWaalsContact C-N 3.33Å; L458-F460 PolarHBondContact O-N 3.47Å; F460-I462 PolarHBondContact O-N 3.41Å; F460-V463 PolarHBondContact O-N 2.85Å; F460-I464 HydrophobicContact CD1-CG2 4.45Å; F460-I464 HydrophobicContact CE1-CG2 4.17Å; F460-I464 HydrophobicContact CE2-CB 4.33Å; F460-I464 HydrophobicContact CE2-CG1 4.49Å; F460-I464 HydrophobicContact CZ-CB 4.35Å; F460-I464 HydrophobicContact CZ-CG1 4.34Å; F460-I464 HydrophobicContact CZ-CG2 4.27Å; F460-I464 WeakPolarHBondContact O-CB 3.49Å; F460-I464 WeakPolarHBondContact O-CG2 3.36Å; F460-I464 PolarHBondContact O-N 3.08Å
461	K	95.1	Very high	93.7	Very high	8 Å²	8	37.8 Å²	37.8	4%	0.035	19%	0.191	C	C	.	.	H	α-helix	trans	-64.3	-40.3	179.9	-72.6	-76	-176.4	176.1	0	111.6	T403 A457 L458 V463 T465 V484 I487	T403-K461 PolarHBondContact OG1-NZ 3.1Å; A457-K461 WeakPolarHBondContact O-CB 3.48Å; A457-K461 VanDerWaalsContact O-CG 3.26Å; A457-K461 WeakPolarHBondContact O-CG 3.41Å; A457-K461 PolarHBondContact O-N 3.29Å; L458-K461 PolarHBondContact O-N 3.18Å; K461-V463 VanDerWaalsContact C-N 3.35Å; K461-V463 PolarHBondContact O-N 3.17Å; K461-T465 VanDerWaalsContact O-CB 3.28Å; K461-T465 WeakPolarHBondContact O-CB 3.22Å; K461-T465 WeakPolarHBondContact O-CG2 3.2Å; K461-T465 PolarHBondContact O-N 3.14Å; K461-T465 VanDerWaalsContact O-N 3.08Å; K461-T465 PolarHBondContact O-OG1 2.93Å; K461-V484 HydrophobicContact CB-CG2 3.9Å; K461-I487 HydrophobicContact CG-CD1 4.43Å
462	I	94.6	Very high	93.6	Very high	37 Å²	37	41.1 Å²	41.1	19%	0.19	20%	0.204	C	C	.	.	H	α-helix	trans	-56.5	-47.5	174.1	-81.2	171.7	0	0	0	111.2	W354 L458 I459 F460 T465 I466 V484	W354-I462 HydrophobicContact CD2-CG1 4.42Å; W354-I462 HydrophobicContact CE3-CG1 4.04Å; W354-I462 HydrophobicContact CE3-CG2 4.23Å; W354-I462 HydrophobicContact CH2-CB 4.07Å; W354-I462 HydrophobicContact CH2-CG1 4.04Å; W354-I462 HydrophobicContact CH2-CG2 4.04Å; W354-I462 VanDerWaalsContact CH2-O 3.29Å; W354-I462 WeakPolarHBondContact CH2-O 3.29Å; W354-I462 HydrophobicContact CZ2-CG1 4.39Å; W354-I462 HydrophobicContact CZ3-CB 3.98Å; W354-I462 HydrophobicContact CZ3-CG1 3.88Å; W354-I462 HydrophobicContact CZ3-CG2 3.54Å; L458-I462 HydrophobicContact CD1-CD1 4.08Å; L458-I462 HydrophobicContact CD1-CG1 4.49Å; L458-I462 HydrophobicContact CG-CD1 4Å; L458-I462 WeakPolarHBondContact O-CB 3.44Å; L458-I462 WeakPolarHBondContact O-CG1 3.29Å; L458-I462 PolarHBondContact O-N 3.4Å; I459-I462 PolarHBondContact O-N 3.37Å; F460-I462 PolarHBondContact O-N 3.41Å; I462-T465 PolarHBondContact O-OG1 3.45Å; I462-I466 WeakPolarHBondContact O-CD1 3.28Å; I462-I466 WeakPolarHBondContact O-CG1 3.12Å; I462-V484 HydrophobicContact CD1-CG1 4.32Å; I462-V484 HydrophobicContact CG1-CG1 3.83Å; I462-V484 HydrophobicContact CG1-CG2 4.38Å
463	V	95	Very high	93.7	Very high	73 Å²	73	33.3 Å²	33.3	44%	0.442	18%	0.175	S	C	.	.	H	α-helix	trans	-73.5	-49.3	-177.2	176.7	0	0	0	0	111.2	I459 F460 K461 T465 I466 F467	I459-V463 WeakPolarHBondContact O-CG2 3.34Å; I459-V463 PolarHBondContact O-N 3.47Å; I459-V463 VanDerWaalsContact O-N 3.1Å; F460-V463 PolarHBondContact O-N 2.85Å; K461-V463 VanDerWaalsContact C-N 3.35Å; K461-V463 PolarHBondContact O-N 3.17Å; V463-T465 PolarHBondContact O-N 3.35Å; V463-I466 PolarHBondContact O-N 3.18Å; V463-F467 HydrophobicContact CG1-CD2 4.26Å; V463-F467 HydrophobicContact CG1-CE2 3.82Å; V463-F467 WeakPolarHBondContact O-CD2 3.15Å
464	I	94.5	Very high	93.7	Very high	12 Å²	12	31.3 Å²	31.3	6%	0.062	17%	0.165	C	C	.	.	H	α-helix	trans	-69.2	-34.5	-171.2	-157.8	62.1	0	0	0	112.1	V385 T389 F460 I466 F467 T468	V385-I464 HydrophobicContact CG1-CD1 4.48Å; T389-I464 HydrophobicContact CG2-CG1 4.18Å; T389-I464 WeakPolarHBondContact OG1-CD1 3.44Å; T389-I464 WeakPolarHBondContact OG1-CG1 3.28Å; F460-I464 HydrophobicContact CD1-CG2 4.45Å; F460-I464 HydrophobicContact CE1-CG2 4.17Å; F460-I464 HydrophobicContact CE2-CB 4.33Å; F460-I464 HydrophobicContact CE2-CG1 4.49Å; F460-I464 HydrophobicContact CZ-CB 4.35Å; F460-I464 HydrophobicContact CZ-CG1 4.34Å; F460-I464 HydrophobicContact CZ-CG2 4.27Å; F460-I464 WeakPolarHBondContact O-CB 3.49Å; F460-I464 WeakPolarHBondContact O-CG2 3.36Å; F460-I464 PolarHBondContact O-N 3.08Å; I464-I466 VanDerWaalsContact C-N 3.28Å; I464-I466 PolarHBondContact O-N 3.42Å; I464-F467 PolarHBondContact O-N 3.27Å; I464-F467 VanDerWaalsContact O-N 3.14Å; I464-T468 HydrophobicContact CG1-CG2 4.07Å; I464-T468 WeakPolarHBondContact O-CG2 3.32Å; I464-T468 PolarHBondContact O-N 3.19Å; I464-T468 PolarHBondContact O-OG1 3.27Å
465	T	93.9	Very high	93.6	Very high	3 Å²	3	31.3 Å²	31.3	2%	0.018	17%	0.165	C	C	.	.	H	α-helix	trans	-60.9	-35.7	178.9	48.8	0	0	0	0	113.2	S229 K461 I462 V463 F467 T468 F469 P480	S229-T465 WeakPolarHBondContact OG-CG2 3.36Å; K461-T465 VanDerWaalsContact O-CB 3.28Å; K461-T465 WeakPolarHBondContact O-CB 3.22Å; K461-T465 WeakPolarHBondContact O-CG2 3.2Å; K461-T465 PolarHBondContact O-N 3.14Å; K461-T465 VanDerWaalsContact O-N 3.08Å; K461-T465 PolarHBondContact O-OG1 2.93Å; I462-T465 PolarHBondContact O-OG1 3.45Å; V463-T465 PolarHBondContact O-N 3.35Å; T465-F467 VanDerWaalsContact C-N 3.28Å; T465-F467 PolarHBondContact O-N 2.93Å; T465-T468 WeakPolarHBondContact CA-OG1 3.33Å; T465-T468 PolarHBondContact O-N 2.91Å; T465-T468 PolarHBondContact O-OG1 2.67Å; T465-F469 PolarHBondContact O-N 3Å; T465-P480 HydrophobicContact CG2-CB 3.61Å
466	I	94.8	Very high	93.5	Very high	20 Å²	20	28.9 Å²	28.9	10%	0.103	15%	0.151	C	C	.	.	H	α-helix	trans	-60.8	-40.6	177.6	-65.9	167.3	0	0	0	110.5	W354 F358 A361 N362 I462 V463 I464	W354-I466 HydrophobicContact CH2-CD1 4.4Å; W354-I466 HydrophobicContact CH2-CG1 4.23Å; W354-I466 HydrophobicContact CZ3-CD1 4.35Å; F358-I466 HydrophobicContact CD2-CG1 3.79Å; F358-I466 HydrophobicContact CE2-CG1 4.28Å; A361-I466 HydrophobicContact CB-CD1 4.04Å; A361-I466 HydrophobicContact CB-CG1 4.43Å; A361-I466 HydrophobicContact CB-CG2 3.76Å; N362-I466 PolarHBondContact ND2-O 3Å; I462-I466 WeakPolarHBondContact O-CD1 3.28Å; I462-I466 WeakPolarHBondContact O-CG1 3.12Å; V463-I466 PolarHBondContact O-N 3.18Å; I464-I466 VanDerWaalsContact C-N 3.28Å; I464-I466 PolarHBondContact O-N 3.42Å
467	F	93.7	Very high	93.4	Very high	69 Å²	69	25.3 Å²	25.3	30%	0.303	13%	0.132	S	C	.	.	H	α-helix	trans	-83	-33.5	-178.6	-63	-70	0	0	0	112.9	W365 R369 V463 I464 T465	W365-F467 AromaticContact CD2-CD1 3.76Å; W365-F467 HydrophobicContact CD2-CD1 3.76Å; W365-F467 AromaticContact CD2-CE1 3.76Å; W365-F467 HydrophobicContact CD2-CE1 3.76Å; W365-F467 AromaticContact CE2-CD1 3.54Å; W365-F467 AromaticContact CE2-CE1 3.89Å; W365-F467 HydrophobicContact CE3-CD1 4.24Å; W365-F467 AromaticContact CE3-CE1 3.76Å; W365-F467 HydrophobicContact CE3-CE1 3.76Å; W365-F467 HydrophobicContact CG-CD1 4.12Å; W365-F467 HydrophobicContact CG-CE1 4.38Å; W365-F467 HydrophobicContact CH2-CD1 4.33Å; W365-F467 HydrophobicContact CH2-CE1 4.03Å; W365-F467 AromaticContact CZ2-CD1 3.86Å; W365-F467 HydrophobicContact CZ2-CD1 3.86Å; W365-F467 HydrophobicContact CZ2-CE1 4.04Å; W365-F467 HydrophobicContact CZ3-CD1 4.5Å; W365-F467 AromaticContact CZ3-CE1 3.89Å; W365-F467 HydrophobicContact CZ3-CE1 3.89Å; W365-F467 AromaticContact NE1-CD1 3.76Å; R369-F467 PolarHBondContact NH1-O 3.03Å; R369-F467 PolarHBondContact NH2-O 2.97Å; V463-F467 HydrophobicContact CG1-CD2 4.26Å; V463-F467 HydrophobicContact CG1-CE2 3.82Å; V463-F467 WeakPolarHBondContact O-CD2 3.15Å; I464-F467 PolarHBondContact O-N 3.27Å; I464-F467 VanDerWaalsContact O-N 3.14Å; T465-F467 VanDerWaalsContact C-N 3.28Å; T465-F467 PolarHBondContact O-N 2.93Å
468	T	93.2	Very high	93.4	Very high	1 Å²	1	25.5 Å²	25.5	1%	0.006	13%	0.133	C	C	.	.	H	α-helix	trans	-70.9	-37.7	-177.5	55.8	0	0	0	0	112.8	L228 S229 V385 I464 T465 M471	L228-T468 HydrophobicContact CD2-CG2 4.08Å; S229-T468 PolarHBondContact O-OG1 2.95Å; V385-T468 HydrophobicContact CG1-CG2 4.02Å; I464-T468 HydrophobicContact CG1-CG2 4.07Å; I464-T468 WeakPolarHBondContact O-CG2 3.32Å; I464-T468 PolarHBondContact O-N 3.19Å; I464-T468 PolarHBondContact O-OG1 3.27Å; T465-T468 WeakPolarHBondContact CA-OG1 3.33Å; T465-T468 PolarHBondContact O-N 2.91Å; T465-T468 PolarHBondContact O-OG1 2.67Å; T468-M471 VanDerWaalsContact CA-SD 3.55Å; T468-M471 WeakPolarHBondContact O-CG 3.39Å; T468-M471 PolarHBondContact O-N 3.49Å
469	F	92.1	Very high	93.3	Very high	8 Å²	8	24.6 Å²	24.6	4%	0.035	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.3	132.8	-179.9	-167.3	-113.6	0	0	0	111.5	F358 N362 R369 T465 L477 I580 H584	F358-F469 HydrophobicContact CZ-CB 4.1Å; F358-F469 HydrophobicContact CZ-CD1 4.22Å; F358-F469 HydrophobicContact CZ-CG 4.36Å; N362-F469 PolarHBondContact ND2-O 2.95Å; N362-F469 WeakPolarHBondContact OD1-CD1 3.19Å; R369-F469 PolarHBondContact NH1-O 3.18Å; R369-F469 VanDerWaalsContact NH1-O 3.1Å; T465-F469 PolarHBondContact O-N 3Å; F469-L477 HydrophobicContact CD1-CD2 4.22Å; F469-L477 HydrophobicContact CD2-CB 4.03Å; F469-L477 HydrophobicContact CD2-CD1 4.37Å; F469-L477 HydrophobicContact CD2-CD2 4.46Å; F469-L477 HydrophobicContact CE1-CD2 4.07Å; F469-L477 HydrophobicContact CE2-CB 3.85Å; F469-L477 HydrophobicContact CE2-CD2 4.34Å; F469-L477 HydrophobicContact CG-CD1 4.34Å; F469-L477 HydrophobicContact CG-CD2 4.42Å; F469-L477 HydrophobicContact CZ-CB 4.35Å; F469-L477 HydrophobicContact CZ-CD2 4.14Å; F469-I580 HydrophobicContact CD1-CD1 4.27Å; F469-I580 HydrophobicContact CD1-CG1 4.24Å; F469-I580 HydrophobicContact CE1-CD1 3.98Å; F469-I580 HydrophobicContact CE1-CG1 3.59Å; F469-I580 HydrophobicContact CZ-CG1 4.36Å; F469-H584 AromaticContact CD1-NE2 3.65Å; F469-H584 AromaticContact CE1-CD2 3.68Å; F469-H584 AromaticContact CE1-CE1 3.77Å; F469-H584 AromaticContact CE1-NE2 3.28Å; F469-H584 VanDerWaalsContact CE1-NE2 3.28Å; F469-H584 WeakPolarHBondContact CE1-NE2 3.37Å
470	G	88.2	Confident	93.3	Very high	27 Å²	27	20 Å²	20	28%	0.278	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.8	10.4	-176.3	0	0	0	0	0	115.3	R369	R369-G470 PolarHBondContact NH1-O 3.18Å
471	M	90.8	Very high	93.3	Very high	4 Å²	4	18.6 Å²	18.6	2%	0.02	10%	0.099	C	C	.	.	S	Bend	trans	-72.3	158.6	166.4	-69.3	171.3	53.9	0	0	110.8	L228 V382 V385 T468 I473	L228-M471 HydrophobicContact CD1-CE 4.49Å; V382-M471 HydrophobicContact CB-CE 3.74Å; V382-M471 HydrophobicContact CG1-CE 3.89Å; V382-M471 HydrophobicContact CG2-CB 4.38Å; V382-M471 HydrophobicContact CG2-CE 3.44Å; V382-M471 VanDerWaalsContact CG2-CE 3.44Å; V385-M471 HydrophobicContact CB-CE 4Å; V385-M471 HydrophobicContact CB-SD 4.04Å; V385-M471 HydrophobicContact CG1-CE 4.24Å; V385-M471 HydrophobicContact CG1-SD 3.79Å; V385-M471 HydrophobicContact CG2-CE 4.45Å; V385-M471 HydrophobicContact CG2-SD 4.22Å; T468-M471 VanDerWaalsContact CA-SD 3.55Å; T468-M471 WeakPolarHBondContact O-CG 3.39Å; T468-M471 PolarHBondContact O-N 3.49Å; M471-I473 HydrophobicContact CB-CD1 4.39Å; M471-I473 HydrophobicContact CB-CG1 3.94Å; M471-I473 HydrophobicContact CE-CD1 4.12Å; M471-I473 PolarHBondContact O-N 3.42Å
472	K	90.1	Very high	93.3	Very high	107 Å²	107	18.3 Å²	18.3	47%	0.465	10%	0.098	S	C	.	.	S	Bend	trans	-77.9	50.7	-179	-65.1	-69.4	-172.4	171.8	0	113.1	P378	P378-K472 HydrophobicContact CB-CB 3.92Å; P378-K472 HydrophobicContact CB-CG 3.7Å
473	I	92.9	Very high	93.3	Very high	2 Å²	2	16.5 Å²	16.5	1%	0.01	9%	0.089	C	C	.	.	S	Bend	trans	-140.3	158.5	176.6	52.5	173.8	0	0	0	109.5	V177 G189 L228 L230 V382 M471 S475	V177-I473 HydrophobicContact CB-CG2 3.86Å; V177-I473 HydrophobicContact CG2-CG2 4.22Å; G189-I473 PolarHBondContact N-O 3.39Å; L228-I473 HydrophobicContact CD1-CD1 3.4Å; L230-I473 HydrophobicContact CD1-CD1 3.57Å; L230-I473 HydrophobicContact CD1-CG1 4.34Å; V382-I473 HydrophobicContact CG1-CD1 4.36Å; V382-I473 HydrophobicContact CG1-CG2 4.1Å; V382-I473 HydrophobicContact CG2-CG2 4.01Å; M471-I473 HydrophobicContact CB-CD1 4.39Å; M471-I473 HydrophobicContact CB-CG1 3.94Å; M471-I473 HydrophobicContact CE-CD1 4.12Å; M471-I473 PolarHBondContact O-N 3.42Å; I473-S475 PolarHBondContact O-N 3.22Å; I473-S475 PolarHBondContact O-OG 3.5Å
474	P	94.4	Very high	93.4	Very high	1 Å²	1	13 Å²	13	1%	0.006	7%	0.067	C	C	.	.			trans	-63.6	125	174.4	-15.5	31.4	0	0	0	109	V180 K216 T219 L220	V180-P474 HydrophobicContact CG2-CG 4.2Å; K216-P474 HydrophobicContact CG-CB 4.38Å; K216-P474 HydrophobicContact CG-CG 4.49Å; T219-P474 VanDerWaalsContact OG1-CG 3.23Å; T219-P474 WeakPolarHBondContact OG1-CG 3.34Å; L220-P474 HydrophobicContact CD1-CB 4.07Å
475	S	91.7	Very high	93.5	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.065	C	C	.	.			trans	-145.5	120.8	-171.3	39.5	0	0	0	0	111	G189 S190 I473	G189-S475 CarbonylContact C-O 3.55Å; G189-S475 PolarHBondContact O-N 3.23Å; S190-S475 WeakPolarHBondContact CA-O 3.05Å; S190-S475 VanDerWaalsContact CB-O 3.29Å; S190-S475 WeakPolarHBondContact CB-O 3.15Å; S190-S475 PolarHBondContact N-O 2.95Å; I473-S475 PolarHBondContact O-N 3.22Å; I473-S475 PolarHBondContact O-OG 3.5Å
476	G	92.9	Very high	93.7	Very high	1 Å²	1	12.3 Å²	12.3	1%	0.01	6%	0.064	C	C	.	.	B	Isolated β-bridge	trans	-100.2	147.3	167.9	0	0	0	0	0	111.6	G231	G231-G476 PolarHBondContact N-O 3.26Å; G231-G476 WeakPolarHBondContact O-CA 3.21Å; G231-G476 PolarHBondContact O-N 3.19Å
477	L	93.6	Very high	93.7	Very high	4 Å²	4	11.4 Å²	11.4	2%	0.021	6%	0.059	C	C	.	.	S	Bend	trans	-106.5	-13.9	-175.2	-177.8	59.7	0	0	0	114	F358 F469 P480 S481 V537 I580	F358-L477 HydrophobicContact CE1-CD1 3.92Å; F358-L477 HydrophobicContact CE1-CD2 3.55Å; F358-L477 HydrophobicContact CE1-CG 4.34Å; F358-L477 HydrophobicContact CE2-CD1 4.14Å; F358-L477 HydrophobicContact CZ-CD1 3.44Å; F358-L477 VanDerWaalsContact CZ-CD1 3.44Å; F358-L477 HydrophobicContact CZ-CD2 3.89Å; F358-L477 HydrophobicContact CZ-CG 4.31Å; F469-L477 HydrophobicContact CD1-CD2 4.22Å; F469-L477 HydrophobicContact CD2-CB 4.03Å; F469-L477 HydrophobicContact CD2-CD1 4.37Å; F469-L477 HydrophobicContact CD2-CD2 4.46Å; F469-L477 HydrophobicContact CE1-CD2 4.07Å; F469-L477 HydrophobicContact CE2-CB 3.85Å; F469-L477 HydrophobicContact CE2-CD2 4.34Å; F469-L477 HydrophobicContact CG-CD1 4.34Å; F469-L477 HydrophobicContact CG-CD2 4.42Å; F469-L477 HydrophobicContact CZ-CB 4.35Å; F469-L477 HydrophobicContact CZ-CD2 4.14Å; L477-P480 WeakPolarHBondContact O-CD 3.38Å; L477-S481 WeakPolarHBondContact O-CB 3.5Å; L477-S481 PolarHBondContact O-N 3.16Å; L477-S481 VanDerWaalsContact O-N 3.16Å; L477-S481 PolarHBondContact O-OG 2.89Å; L477-V537 HydrophobicContact CD2-CG1 3.6Å; L477-V537 HydrophobicContact CG-CG1 4.19Å; L477-I580 HydrophobicContact CD2-CB 4.19Å; L477-I580 HydrophobicContact CD2-CG1 3.7Å; L477-I580 HydrophobicContact CD2-CG2 3.8Å
478	F	93.9	Very high	93.9	Very high	4 Å²	4	8.5 Å²	8.5	2%	0.018	5%	0.048	C	C	.	.	H	α-helix	trans	-60.5	-57.1	-176.3	-65.9	-18.2	0	0	0	112.7	I192 E233 F277 F286 S481 M482 L534 T538 Y581	I192-F478 HydrophobicContact CD1-CE2 4.25Å; I192-F478 HydrophobicContact CD1-CZ 3.91Å; E233-F478 HydrophobicContact CB-CB 4.47Å; E233-F478 HydrophobicContact CB-CD2 4.06Å; F277-F478 HydrophobicContact CE1-CB 4.5Å; F277-F478 AromaticContact CE2-CD2 3.52Å; F277-F478 HydrophobicContact CE2-CD2 3.52Å; F277-F478 AromaticContact CE2-CE2 3.89Å; F277-F478 HydrophobicContact CE2-CE2 3.89Å; F277-F478 HydrophobicContact CZ-CB 3.83Å; F277-F478 AromaticContact CZ-CD2 3.3Å; F277-F478 HydrophobicContact CZ-CD2 3.3Å; F277-F478 HydrophobicContact CZ-CE2 4.09Å; F277-F478 AromaticContact CZ-CG 3.88Å; F277-F478 HydrophobicContact CZ-CG 3.88Å; F286-F478 HydrophobicContact CE2-CE1 4.44Å; F286-F478 AromaticContact CE2-CE2 3.79Å; F286-F478 HydrophobicContact CE2-CE2 3.79Å; F286-F478 AromaticContact CE2-CZ 3.39Å; F286-F478 HydrophobicContact CE2-CZ 3.39Å; F286-F478 HydrophobicContact CZ-CE2 4.06Å; F286-F478 AromaticContact CZ-CZ 3.63Å; F286-F478 HydrophobicContact CZ-CZ 3.63Å; F478-S481 PolarHBondContact O-N 3.42Å; F478-M482 WeakPolarHBondContact O-CG 3.47Å; F478-M482 PolarHBondContact O-N 2.84Å; F478-L534 HydrophobicContact CB-CD1 4.37Å; F478-L534 HydrophobicContact CD1-CD1 3.69Å; F478-L534 HydrophobicContact CE1-CD1 4.4Å; F478-L534 HydrophobicContact CG-CD1 4.35Å; F478-T538 HydrophobicContact CD1-CG2 4.07Å; F478-T538 HydrophobicContact CE1-CG2 3.68Å; F478-Y581 AromaticContact CE1-CE2 3.84Å; F478-Y581 HydrophobicContact CE1-CE2 3.84Å; F478-Y581 AromaticContact CE1-CZ 3.8Å; F478-Y581 WeakPolarHBondContact CE1-OH 3.21Å; F478-Y581 HydrophobicContact CZ-CE2 4.19Å; F478-Y581 WeakPolarHBondContact CZ-OH 3.33Å
479	I	93.4	Very high	94	Very high	6 Å²	6	8.5 Å²	8.5	3%	0.031	5%	0.048	C	C	.	.	H	α-helix	trans	-59.8	-48.4	-178.2	-60.8	-63.8	0	0	0	112.3	E233 F328 T403 I407 S481 M482 A483	E233-I479 HydrophobicContact CG-CD1 3.78Å; E233-I479 HydrophobicContact CG-CG1 3.62Å; F328-I479 HydrophobicContact CE1-CD1 4.36Å; T403-I479 HydrophobicContact CG2-CG2 3.54Å; I407-I479 HydrophobicContact CD1-CG2 3.97Å; I479-S481 VanDerWaalsContact C-N 3.32Å; I479-S481 PolarHBondContact O-N 3.3Å; I479-M482 HydrophobicContact CD1-CE 3.31Å; I479-M482 HydrophobicContact CG1-CE 4.29Å; I479-M482 PolarHBondContact O-N 2.93Å; I479-A483 WeakPolarHBondContact O-CB 3.47Å; I479-A483 PolarHBondContact O-N 3.34Å
480	P	94.9	Very high	94.2	Very high	1 Å²	1	8.2 Å²	8.2	1%	0.006	5%	0.046	C	C	.	.	H	α-helix	trans	-61.2	-37.1	177.5	-24.2	33.4	0	0	0	114.3	S229 T465 L477 A483 V484	S229-P480 WeakPolarHBondContact O-CG 3.46Å; T465-P480 HydrophobicContact CG2-CB 3.61Å; L477-P480 WeakPolarHBondContact O-CD 3.38Å; P480-A483 PolarHBondContact O-N 3.26Å; P480-V484 WeakPolarHBondContact O-CG2 3.13Å; P480-V484 PolarHBondContact O-N 2.9Å
481	S	95.3	Very high	94.5	Very high	2 Å²	2	8.4 Å²	8.4	1%	0.014	4%	0.041	C	C	.	.	H	α-helix	trans	-70.5	-40.5	178.2	-54.4	0	0	0	0	111.7	L477 F478 I479 A483 V484 G485 C533	L477-S481 WeakPolarHBondContact O-CB 3.5Å; L477-S481 PolarHBondContact O-N 3.16Å; L477-S481 VanDerWaalsContact O-N 3.16Å; L477-S481 PolarHBondContact O-OG 2.89Å; F478-S481 PolarHBondContact O-N 3.42Å; I479-S481 VanDerWaalsContact C-N 3.32Å; I479-S481 PolarHBondContact O-N 3.3Å; S481-A483 VanDerWaalsContact C-N 3.33Å; S481-V484 PolarHBondContact O-N 3.13Å; S481-G485 PolarHBondContact O-N 2.82Å; S481-C533 WeakPolarHBondContact O-CB 3.33Å
482	M	95.2	Very high	94.7	Very high	2 Å²	2	10.5 Å²	10.5	1%	0.01	5%	0.054	C	C	.	.	H	α-helix	trans	-62.5	-40.2	172.8	-72.1	-170.1	-53.7	0	0	111.5	F277 I407 F478 I479 G485 A486 A530 L534 M548	F277-M482 HydrophobicContact CE1-CE 3.84Å; F277-M482 HydrophobicContact CE1-SD 4.33Å; I407-M482 HydrophobicContact CD1-CB 3.97Å; I407-M482 HydrophobicContact CD1-CE 4.4Å; F478-M482 WeakPolarHBondContact O-CG 3.47Å; F478-M482 PolarHBondContact O-N 2.84Å; I479-M482 HydrophobicContact CD1-CE 3.31Å; I479-M482 HydrophobicContact CG1-CE 4.29Å; I479-M482 PolarHBondContact O-N 2.93Å; M482-G485 CarbonylContact O-C 3.44Å; M482-G485 PolarHBondContact O-N 3.45Å; M482-A486 VanDerWaalsContact O-CB 3.32Å; M482-A486 WeakPolarHBondContact O-CB 3.01Å; M482-A486 PolarHBondContact O-N 3.02Å; M482-A530 HydrophobicContact CB-CB 4.11Å; M482-A530 HydrophobicContact CG-CB 4.43Å; M482-A530 WeakPolarHBondContact O-CB 3.09Å; M482-L534 HydrophobicContact CG-CB 3.99Å; M482-L534 HydrophobicContact CG-CD2 3.6Å; M482-L534 HydrophobicContact CG-CG 4.3Å; M482-L534 HydrophobicContact SD-CD2 3.77Å; M482-M548 HydrophobicContact CG-CE 4.21Å; M482-M548 HydrophobicContact SD-CE 3.5Å; M482-M548 VanDerWaalsContact SD-CE 3.5Å
483	A	95.6	Very high	94.8	Very high	0 Å²	0	5.4 Å²	5.4	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-63.6	-43.3	179	0	0	0	0	0	112.9	T403 I407 I479 P480 S481 G485 A486 I487	T403-A483 HydrophobicContact CG2-CB 3.37Å; I407-A483 HydrophobicContact CD1-CB 4.14Å; I407-A483 HydrophobicContact CG1-CB 4.11Å; I479-A483 WeakPolarHBondContact O-CB 3.47Å; I479-A483 PolarHBondContact O-N 3.34Å; P480-A483 PolarHBondContact O-N 3.26Å; S481-A483 VanDerWaalsContact C-N 3.33Å; A483-G485 VanDerWaalsContact C-N 3.27Å; A483-G485 PolarHBondContact O-N 3.48Å; A483-A486 PolarHBondContact O-N 2.86Å; A483-I487 WeakPolarHBondContact O-CD1 3.46Å; A483-I487 WeakPolarHBondContact O-CG1 3.21Å; A483-I487 PolarHBondContact O-N 2.87Å
484	V	97	Very high	94.8	Very high	0 Å²	0	5.5 Å²	5.5	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-58.1	-43.7	174.2	171.1	0	0	0	0	110.6	W354 L458 K461 I462 P480 S481 A488	W354-V484 HydrophobicContact CD2-CG1 4.25Å; W354-V484 HydrophobicContact CG-CG1 4.32Å; W354-V484 HydrophobicContact CZ2-CG1 4.4Å; W354-V484 HydrophobicContact CZ2-CG2 4.25Å; L458-V484 HydrophobicContact CD1-CG1 3.84Å; L458-V484 WeakPolarHBondContact CD1-O 3.45Å; K461-V484 HydrophobicContact CB-CG2 3.9Å; I462-V484 HydrophobicContact CD1-CG1 4.32Å; I462-V484 HydrophobicContact CG1-CG1 3.83Å; I462-V484 HydrophobicContact CG1-CG2 4.38Å; P480-V484 WeakPolarHBondContact O-CG2 3.13Å; P480-V484 PolarHBondContact O-N 2.9Å; S481-V484 PolarHBondContact O-N 3.13Å; V484-A488 WeakPolarHBondContact O-CB 3.27Å; V484-A488 PolarHBondContact O-N 2.88Å
485	G	96.8	Very high	94.6	Very high	0 Å²	0	8 Å²	8	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-66.9	-41.4	175.7	0	0	0	0	0	114.2	S481 M482 A483 A488 G489 G529 C533	S481-G485 PolarHBondContact O-N 2.82Å; M482-G485 CarbonylContact O-C 3.44Å; M482-G485 PolarHBondContact O-N 3.45Å; A483-G485 VanDerWaalsContact C-N 3.27Å; A483-G485 PolarHBondContact O-N 3.48Å; G485-A488 PolarHBondContact O-N 3.47Å; G485-G489 PolarHBondContact O-N 3.22Å; G485-G529 VanDerWaalsContact CA-C 3.43Å; G485-G529 WeakPolarHBondContact CA-O 3.29Å; G485-G529 CarbonylContact O-C 3.49Å; G485-G529 WeakPolarHBondContact O-CA 3.16Å; G485-C533 WeakPolarHBondContact CA-SG 3.27Å
486	A	96.3	Very high	94.6	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-64.9	-42.6	179.5	0	0	0	0	0	111.5	L410 F411 M482 A483 G489 R490 A526 A530	L410-A486 HydrophobicContact CB-CB 4.33Å; L410-A486 HydrophobicContact CD1-CB 3.77Å; F411-A486 HydrophobicContact CE1-CB 3.89Å; M482-A486 VanDerWaalsContact O-CB 3.32Å; M482-A486 WeakPolarHBondContact O-CB 3.01Å; M482-A486 PolarHBondContact O-N 3.02Å; A483-A486 PolarHBondContact O-N 2.86Å; A486-G489 PolarHBondContact O-N 3.23Å; A486-R490 WeakPolarHBondContact O-CB 3.24Å; A486-R490 PolarHBondContact O-N 3.39Å; A486-A526 WeakPolarHBondContact CA-O 3.29Å; A486-A526 WeakPolarHBondContact O-CB 3.35Å; A486-A530 HydrophobicContact CB-CB 4.21Å
487	I	96.5	Very high	94.3	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-63.5	-49.1	176.6	-64.3	163.4	0	0	0	110	L406 L410 L454 A457 L458 K461 A483 G489 R490 I491	L406-I487 HydrophobicContact CD2-CD1 4.15Å; L410-I487 HydrophobicContact CD1-CG1 3.7Å; L454-I487 HydrophobicContact CB-CG2 4.07Å; L454-I487 HydrophobicContact CD2-CG1 4.45Å; L454-I487 HydrophobicContact CD2-CG2 4.23Å; L454-I487 WeakPolarHBondContact O-CG2 3.32Å; A457-I487 HydrophobicContact CB-CD1 4.38Å; L458-I487 HydrophobicContact CB-CG2 3.82Å; L458-I487 HydrophobicContact CD1-CB 4.28Å; L458-I487 HydrophobicContact CD1-CG2 4.25Å; K461-I487 HydrophobicContact CG-CD1 4.43Å; A483-I487 WeakPolarHBondContact O-CD1 3.46Å; A483-I487 WeakPolarHBondContact O-CG1 3.21Å; A483-I487 PolarHBondContact O-N 2.87Å; I487-G489 VanDerWaalsContact C-N 3.33Å; I487-G489 PolarHBondContact O-N 3.06Å; I487-R490 PolarHBondContact O-N 2.78Å; I487-I491 HydrophobicContact CG2-CD1 3.89Å; I487-I491 VanDerWaalsContact O-CG1 3.26Å; I487-I491 WeakPolarHBondContact O-CG1 3.49Å; I487-I491 PolarHBondContact O-N 3.45Å
488	A	97.1	Very high	94.1	Very high	9 Å²	9	10 Å²	10	7%	0.074	6%	0.062	C	C	.	.	H	α-helix	trans	-62.1	-42.2	178.2	0	0	0	0	0	111.9	F350 L458 V484 G485 I491 V492	F350-A488 HydrophobicContact CD1-CB 4.09Å; F350-A488 HydrophobicContact CE1-CB 3.52Å; F350-A488 HydrophobicContact CZ-CB 4.07Å; L458-A488 HydrophobicContact CD1-CB 4.3Å; L458-A488 HydrophobicContact CD2-CB 4.38Å; V484-A488 WeakPolarHBondContact O-CB 3.27Å; V484-A488 PolarHBondContact O-N 2.88Å; G485-A488 PolarHBondContact O-N 3.47Å; A488-I491 PolarHBondContact O-N 3.47Å; A488-V492 WeakPolarHBondContact O-CG2 3.45Å; A488-V492 PolarHBondContact O-N 3.39Å
489	G	96.4	Very high	93.8	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-62	-47.3	176.1	0	0	0	0	0	112.4	G485 A486 I487 I491 V492 G493 Y525	G485-G489 PolarHBondContact O-N 3.22Å; A486-G489 PolarHBondContact O-N 3.23Å; I487-G489 VanDerWaalsContact C-N 3.33Å; I487-G489 PolarHBondContact O-N 3.06Å; G489-I491 PolarHBondContact O-N 3.02Å; G489-V492 PolarHBondContact O-N 2.82Å; G489-G493 PolarHBondContact O-N 3.43Å; G489-Y525 VanDerWaalsContact CA-O 3.25Å; G489-Y525 WeakPolarHBondContact CA-O 3.25Å; G489-Y525 VanDerWaalsContact O-CB 3.27Å; G489-Y525 WeakPolarHBondContact O-CB 3.34Å
490	R	94.9	Very high	93.4	Very high	2 Å²	2	13 Å²	13	1%	0.008	8%	0.077	C	C	.	.	H	α-helix	trans	-62.7	-41.4	178	-169.8	66.7	175	-151.2	4.8	112.1	L410 N412 L422 A486 I487 V492 G493 I494 A526	L410-R490 HydrophobicContact CD2-CB 3.77Å; L410-R490 HydrophobicContact CD2-CG 3.79Å; L410-R490 PolarHBondContact O-NH1 3.21Å; N412-R490 PolarHBondContact O-NH1 3.05Å; N412-R490 PolarHBondContact O-NH2 3.48Å; L422-R490 HydrophobicContact CD2-CG 4.1Å; A486-R490 WeakPolarHBondContact O-CB 3.24Å; A486-R490 PolarHBondContact O-N 3.39Å; I487-R490 PolarHBondContact O-N 2.78Å; R490-V492 VanDerWaalsContact C-N 3.34Å; R490-V492 PolarHBondContact O-N 3.46Å; R490-G493 PolarHBondContact O-N 2.79Å; R490-I494 HydrophobicContact CG-CD1 4.02Å; R490-I494 WeakPolarHBondContact O-CG1 3.4Å; R490-I494 PolarHBondContact O-N 3.28Å; R490-A526 HydrophobicContact CB-CB 4.01Å
491	I	95.1	Very high	92.9	Very high	31 Å²	31	16.7 Å²	16.7	16%	0.159	9%	0.092	C	C	.	.	H	α-helix	trans	-58.7	-46.4	174.9	-72.1	168.5	0	0	0	110.5	M451 L454 L458 I487 A488 G489 A495	M451-I491 HydrophobicContact CE-CB 4.08Å; M451-I491 HydrophobicContact CE-CG1 4.2Å; M451-I491 HydrophobicContact CE-CG2 3.68Å; M451-I491 HydrophobicContact SD-CB 4.47Å; M451-I491 HydrophobicContact SD-CG1 4.16Å; L454-I491 HydrophobicContact CB-CD1 4.13Å; L454-I491 HydrophobicContact CB-CG1 4.24Å; L458-I491 HydrophobicContact CD2-CD1 4.49Å; I487-I491 HydrophobicContact CG2-CD1 3.89Å; I487-I491 VanDerWaalsContact O-CG1 3.26Å; I487-I491 WeakPolarHBondContact O-CG1 3.49Å; I487-I491 PolarHBondContact O-N 3.45Å; A488-I491 PolarHBondContact O-N 3.47Å; G489-I491 PolarHBondContact O-N 3.02Å; I491-A495 WeakPolarHBondContact O-CB 3.32Å; I491-A495 PolarHBondContact O-N 3.33Å
492	V	95.3	Very high	92.3	Very high	48 Å²	48	22 Å²	22	29%	0.291	12%	0.116	S	C	.	.	H	α-helix	trans	-67.6	-40.6	177.5	173.4	0	0	0	0	111.3	P343 L347 A488 G489 R490 A495 V496 Y525	P343-V492 HydrophobicContact CB-CG1 4.34Å; L347-V492 HydrophobicContact CD2-CB 4.18Å; L347-V492 HydrophobicContact CD2-CG2 3.88Å; A488-V492 WeakPolarHBondContact O-CG2 3.45Å; A488-V492 PolarHBondContact O-N 3.39Å; G489-V492 PolarHBondContact O-N 2.82Å; R490-V492 VanDerWaalsContact C-N 3.34Å; R490-V492 PolarHBondContact O-N 3.46Å; V492-A495 PolarHBondContact O-N 3.45Å; V492-V496 HydrophobicContact CG1-CG2 4.22Å; V492-V496 VanDerWaalsContact O-CG2 3.32Å; V492-V496 WeakPolarHBondContact O-CG2 3.34Å; V492-V496 PolarHBondContact O-N 2.92Å; V492-Y525 HydrophobicContact CG1-CD1 4.04Å; V492-Y525 HydrophobicContact CG1-CE1 4.39Å
493	G	92.7	Very high	91.8	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-58.7	-51.7	177.7	0	0	0	0	0	112.2	G489 R490 A495 V496 E497	G489-G493 PolarHBondContact O-N 3.43Å; R490-G493 PolarHBondContact O-N 2.79Å; G493-A495 VanDerWaalsContact C-N 3.3Å; G493-A495 PolarHBondContact O-N 2.99Å; G493-V496 PolarHBondContact O-N 3.33Å; G493-E497 WeakPolarHBondContact O-CB 3.47Å; G493-E497 PolarHBondContact O-N 3.31Å
494	I	91.4	Very high	90.9	Very high	5 Å²	5	27.4 Å²	27.4	3%	0.026	14%	0.141	C	C	.	.	H	α-helix	trans	-61.8	-39.7	176.2	-64.7	169.2	0	0	0	110.4	L422 V447 M451 R490 V496 E497 Q498 P522	L422-I494 HydrophobicContact CD2-CD1 3.99Å; V447-I494 HydrophobicContact CG1-CG2 4.02Å; M451-I494 HydrophobicContact CG-CG2 4.45Å; M451-I494 HydrophobicContact SD-CB 4.04Å; M451-I494 HydrophobicContact SD-CD1 3.76Å; M451-I494 HydrophobicContact SD-CG1 4.48Å; M451-I494 HydrophobicContact SD-CG2 4.06Å; R490-I494 HydrophobicContact CG-CD1 4.02Å; R490-I494 WeakPolarHBondContact O-CG1 3.4Å; R490-I494 PolarHBondContact O-N 3.28Å; I494-V496 PolarHBondContact O-N 2.93Å; I494-E497 PolarHBondContact O-N 2.74Å; I494-Q498 HydrophobicContact CG2-CG 4.23Å; I494-Q498 WeakPolarHBondContact O-CB 3.45Å; I494-Q498 VanDerWaalsContact O-CG 3.26Å; I494-Q498 WeakPolarHBondContact O-CG 3.39Å; I494-Q498 PolarHBondContact O-N 2.93Å; I494-P522 HydrophobicContact CG1-CB 4.02Å; I494-P522 HydrophobicContact CG1-CG 4.32Å
495	A	91.3	Very high	89.7	Confident	52 Å²	52	34.4 Å²	34.4	43%	0.43	18%	0.178	S	C	.	.	H	α-helix	trans	-63.8	-39.8	177.3	0	0	0	0	0	112.8	I491 V492 G493 M499	I491-A495 WeakPolarHBondContact O-CB 3.32Å; I491-A495 PolarHBondContact O-N 3.33Å; V492-A495 PolarHBondContact O-N 3.45Å; G493-A495 VanDerWaalsContact C-N 3.3Å; G493-A495 PolarHBondContact O-N 2.99Å; A495-M499 VanDerWaalsContact O-CB 3.24Å; A495-M499 WeakPolarHBondContact O-CB 3.46Å; A495-M499 PolarHBondContact O-N 3.37Å
496	V	90.3	Very high	89	Confident	15 Å²	15	40.3 Å²	40.3	9%	0.091	20%	0.201	C	C	.	.	H	α-helix	trans	-70.6	-42.2	177	175	0	0	0	0	111	P343 V492 G493 I494 M499 A500 V520 Y525	P343-V496 HydrophobicContact CB-CG2 4.43Å; V492-V496 HydrophobicContact CG1-CG2 4.22Å; V492-V496 VanDerWaalsContact O-CG2 3.32Å; V492-V496 WeakPolarHBondContact O-CG2 3.34Å; V492-V496 PolarHBondContact O-N 2.92Å; G493-V496 PolarHBondContact O-N 3.33Å; I494-V496 PolarHBondContact O-N 2.93Å; V496-M499 HydrophobicContact CG2-CE 4.39Å; V496-M499 PolarHBondContact O-N 3.07Å; V496-A500 WeakPolarHBondContact O-CB 3.36Å; V496-A500 PolarHBondContact O-N 2.99Å; V496-V520 HydrophobicContact CB-CG1 4.41Å; V496-V520 HydrophobicContact CG1-CG1 4.11Å; V496-V520 HydrophobicContact CG1-CG2 4.24Å; V496-Y525 HydrophobicContact CB-CE1 4.44Å; V496-Y525 HydrophobicContact CG2-CE1 4.15Å
497	E	87.8	Confident	88	Confident	12 Å²	12	47.7 Å²	47.7	6%	0.056	24%	0.238	C	C	.	.	H	α-helix	trans	-56.2	-52.5	173.9	-174.5	-156.8	165	0	0	110.9	Y425 G493 I494 M499 A500 Y501 V520 P522	Y425-E497 VanDerWaalsContact CE1-OE1 3.28Å; Y425-E497 WeakPolarHBondContact CE1-OE1 3.41Å; Y425-E497 PolarHBondContact OH-OE2 3.48Å; G493-E497 WeakPolarHBondContact O-CB 3.47Å; G493-E497 PolarHBondContact O-N 3.31Å; I494-E497 PolarHBondContact O-N 2.74Å; E497-M499 VanDerWaalsContact C-N 3.32Å; E497-M499 PolarHBondContact O-N 3.05Å; E497-A500 PolarHBondContact O-N 3.46Å; E497-Y501 WeakPolarHBondContact O-CB 3.38Å; E497-Y501 PolarHBondContact O-N 2.89Å; E497-V520 HydrophobicContact CB-CB 4.27Å; E497-V520 HydrophobicContact CB-CG1 4.2Å; E497-P522 HydrophobicContact CB-CG 4.4Å; E497-P522 WeakPolarHBondContact OE2-CG 3.45Å
498	Q	88.8	Confident	87.1	Confident	21 Å²	21	52.5 Å²	52.5	10%	0.098	26%	0.263	C	S	.	.	H	α-helix	trans	-66.2	-34.6	-179.8	-65.6	-52.7	-65.8	0	0	112.5	R441 A443 I494 Y501 H502	R441-Q498 PolarHBondContact O-NE2 2.99Å; A443-Q498 HydrophobicContact CB-CG 4.19Å; I494-Q498 HydrophobicContact CG2-CG 4.23Å; I494-Q498 WeakPolarHBondContact O-CB 3.45Å; I494-Q498 VanDerWaalsContact O-CG 3.26Å; I494-Q498 WeakPolarHBondContact O-CG 3.39Å; I494-Q498 PolarHBondContact O-N 2.93Å; Q498-Y501 PolarHBondContact O-N 2.84Å; Q498-H502 PolarHBondContact O-CD2 2.88Å; Q498-H502 VanDerWaalsContact O-CD2 3.29Å; Q498-H502 PolarHBondContact O-N 3.38Å
499	M	87.9	Confident	86.2	Confident	73 Å²	73	52.5 Å²	52.5	36%	0.36	26%	0.261	S	S	.	.	H	α-helix	trans	-66.9	-42.2	174.2	179.7	175.6	49.7	0	0	111.7	A495 V496 E497 Y501 H503 W506 F509	A495-M499 VanDerWaalsContact O-CB 3.24Å; A495-M499 WeakPolarHBondContact O-CB 3.46Å; A495-M499 PolarHBondContact O-N 3.37Å; V496-M499 HydrophobicContact CG2-CE 4.39Å; V496-M499 PolarHBondContact O-N 3.07Å; E497-M499 VanDerWaalsContact C-N 3.32Å; E497-M499 PolarHBondContact O-N 3.05Å; M499-Y501 VanDerWaalsContact C-N 3.33Å; M499-H503 WeakPolarHBondContact O-CB 3.34Å; M499-H503 PolarHBondContact O-N 3.34Å; M499-W506 HydrophobicContact CG-CZ3 4.32Å; M499-W506 HydrophobicContact SD-CZ3 4.01Å; M499-F509 HydrophobicContact CE-CE2 4.37Å; M499-F509 HydrophobicContact CE-CZ 3.84Å; M499-F509 HydrophobicContact CG-CE2 4.04Å; M499-F509 HydrophobicContact CG-CZ 4.32Å; M499-F509 HydrophobicContact SD-CE2 4.4Å; M499-F509 HydrophobicContact SD-CZ 4.45Å
500	A	84.7	Confident	85	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-62.7	-42.1	175	0	0	0	0	0	110.8	V496 E497 H504 F509 V520	V496-A500 WeakPolarHBondContact O-CB 3.36Å; V496-A500 PolarHBondContact O-N 2.99Å; E497-A500 PolarHBondContact O-N 3.46Å; A500-H504 PolarHBondContact O-N 3.22Å; A500-H504 PolarHBondContact O-ND1 3.02Å; A500-F509 HydrophobicContact CB-CD1 3.95Å; A500-F509 HydrophobicContact CB-CE1 4.09Å; A500-F509 HydrophobicContact CB-CG 4.33Å; A500-V520 HydrophobicContact CB-CG2 4.32Å
501	Y	83.8	Confident	84	Confident	79 Å²	79	66 Å²	66	31%	0.31	33%	0.327	S	S	.	.	H	α-helix	trans	-64.2	-42.2	178.2	-175.1	-94	0	0	0	113.6	D440 P442 E497 Q498 M499 H504	D440-Y501 HydrophobicContact CB-CD2 4.15Å; D440-Y501 WeakPolarHBondContact O-CD2 3.38Å; D440-Y501 WeakPolarHBondContact O-CE2 3.44Å; P442-Y501 HydrophobicContact CB-CD1 4.27Å; P442-Y501 HydrophobicContact CB-CE1 3.77Å; P442-Y501 HydrophobicContact CG-CE1 3.93Å; E497-Y501 WeakPolarHBondContact O-CB 3.38Å; E497-Y501 PolarHBondContact O-N 2.89Å; Q498-Y501 PolarHBondContact O-N 2.84Å; M499-Y501 VanDerWaalsContact C-N 3.33Å; Y501-H504 VanDerWaalsContact C-CE1 3.45Å; Y501-H504 WeakPolarHBondContact CA-CE1 3.43Å; Y501-H504 AromaticContact CD2-CE1 3.98Å; Y501-H504 PolarHBondContact O-CE1 3.32Å; Y501-H504 PolarHBondContact O-ND1 3.21Å
502	H	84.6	Confident	83.1	Confident	112 Å²	112	66.3 Å²	66.3	52%	0.519	33%	0.326	S	S	.	.	H	α-helix	trans	-81.9	-25.3	-179.7	-77.9	-66.4	0	0	0	113.8	Q498	Q498-H502 PolarHBondContact O-CD2 2.88Å; Q498-H502 VanDerWaalsContact O-CD2 3.29Å; Q498-H502 PolarHBondContact O-N 3.38Å
503	H	84.3	Confident	82.1	Confident	82 Å²	82	64.2 Å²	64.2	38%	0.38	31%	0.314	S	S	.	.			trans	-125.7	45.4	-173.7	-63.9	-56.1	0	0	0	113.6	M499 D505 W506	M499-H503 WeakPolarHBondContact O-CB 3.34Å; M499-H503 PolarHBondContact O-N 3.34Å; H503-D505 PolarHBondContact O-N 3.39Å; H503-D505 VanDerWaalsContact O-N 3.07Å; H503-W506 HydrophobicContact CB-CD2 3.75Å; H503-W506 HydrophobicContact CB-CE3 4.14Å; H503-W506 HydrophobicContact CB-CG 3.91Å; H503-W506 AromaticContact CD2-CZ2 3.91Å; H503-W506 AromaticContact CG-CE2 3.84Å; H503-W506 WeakPolarHBondContact O-CB 3.47Å; H503-W506 PolarHBondContact O-N 3.13Å
504	H	75.2	Confident	81.1	Confident	35 Å²	35	73.8 Å²	73.8	16%	0.162	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	-30.8	175	-67.8	96.2	0	0	0	113.9	A500 Y501 W506 K510	A500-H504 PolarHBondContact O-N 3.22Å; A500-H504 PolarHBondContact O-ND1 3.02Å; Y501-H504 VanDerWaalsContact C-CE1 3.45Å; Y501-H504 WeakPolarHBondContact CA-CE1 3.43Å; Y501-H504 AromaticContact CD2-CE1 3.98Å; Y501-H504 PolarHBondContact O-CE1 3.32Å; Y501-H504 PolarHBondContact O-ND1 3.21Å; H504-W506 VanDerWaalsContact C-N 3.31Å; H504-W506 PolarHBondContact O-N 3.45Å; H504-K510 WeakPolarHBondContact O-CA 3.35Å; H504-K510 PolarHBondContact O-N 2.04Å
505	D	73.6	Confident	79.9	Confident	146 Å²	146	78.6 Å²	78.6	78%	0.781	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-11.3	-177.8	-67.4	-38.8	0	0	0	114.3	H503	H503-D505 PolarHBondContact O-N 3.39Å; H503-D505 VanDerWaalsContact O-N 3.07Å
506	W	81.8	Confident	78.6	Confident	125 Å²	125	77.9 Å²	77.9	47%	0.473	38%	0.379	S	S	.	.	S	Bend	trans	-63.5	143.5	177.9	-82.3	7.5	0	0	0	111.2	M499 H503 H504 I508 F509 K510	M499-W506 HydrophobicContact CG-CZ3 4.32Å; M499-W506 HydrophobicContact SD-CZ3 4.01Å; H503-W506 HydrophobicContact CB-CD2 3.75Å; H503-W506 HydrophobicContact CB-CE3 4.14Å; H503-W506 HydrophobicContact CB-CG 3.91Å; H503-W506 AromaticContact CD2-CZ2 3.91Å; H503-W506 AromaticContact CG-CE2 3.84Å; H503-W506 WeakPolarHBondContact O-CB 3.47Å; H503-W506 PolarHBondContact O-N 3.13Å; H504-W506 VanDerWaalsContact C-N 3.31Å; H504-W506 PolarHBondContact O-N 3.45Å; W506-I508 PolarHBondContact O-N 3.13Å; W506-F509 HydrophobicContact CB-CD2 4.15Å; W506-F509 HydrophobicContact CE3-CD2 4.47Å; W506-F509 HydrophobicContact CE3-CE2 4.09Å; W506-F509 PolarHBondContact O-N 3.04Å; W506-K510 VanDerWaalsContact O-CB 3.3Å; W506-K510 WeakPolarHBondContact O-CB 3.24Å; W506-K510 PolarHBondContact O-N 3.11Å
507	I	74.3	Confident	77.5	Confident	154 Å²	154	79 Å²	79	79%	0.79	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	-32.8	-177.9	-63.7	157.3	0	0	0	111.8
508	I	77.6	Confident	76.8	Confident	101 Å²	101	80.8 Å²	80.8	52%	0.518	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-56.9	177.2	-57.9	172.1	0	0	0	109.4	W506 W512	W506-I508 PolarHBondContact O-N 3.13Å; I508-W512 HydrophobicContact CG2-CZ2 4.44Å; I508-W512 PolarHBondContact O-NE1 3.2Å
509	F	78.6	Confident	76.3	Confident	9 Å²	9	80.1 Å²	80.1	4%	0.039	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-24.9	-170.5	-58.2	-64.8	0	0	0	114.8	M499 A500 W506 N511 W512 C513	M499-F509 HydrophobicContact CE-CE2 4.37Å; M499-F509 HydrophobicContact CE-CZ 3.84Å; M499-F509 HydrophobicContact CG-CE2 4.04Å; M499-F509 HydrophobicContact CG-CZ 4.32Å; M499-F509 HydrophobicContact SD-CE2 4.4Å; M499-F509 HydrophobicContact SD-CZ 4.45Å; A500-F509 HydrophobicContact CB-CD1 3.95Å; A500-F509 HydrophobicContact CB-CE1 4.09Å; A500-F509 HydrophobicContact CB-CG 4.33Å; W506-F509 HydrophobicContact CB-CD2 4.15Å; W506-F509 HydrophobicContact CE3-CD2 4.47Å; W506-F509 HydrophobicContact CE3-CE2 4.09Å; W506-F509 PolarHBondContact O-N 3.04Å; F509-N511 PolarHBondContact O-N 3.49Å; F509-W512 HydrophobicContact CD1-CH2 4.16Å; F509-W512 AromaticContact CD1-CZ2 3.61Å; F509-W512 HydrophobicContact CD1-CZ2 3.61Å; F509-W512 HydrophobicContact CE1-CH2 4.12Å; F509-W512 AromaticContact CE1-CZ2 3.75Å; F509-W512 HydrophobicContact CE1-CZ2 3.75Å; F509-W512 PolarHBondContact O-N 3.36Å; F509-C513 HydrophobicContact CB-CB 4.48Å; F509-C513 PolarHBondContact O-N 3.18Å
510	K	71.8	Confident	76.2	Confident	144 Å²	144	76.7 Å²	76.7	63%	0.626	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.7	-29.4	-174.3	-175.3	174.4	-177.8	174.5	0	114.9	H504 W506	H504-K510 WeakPolarHBondContact O-CA 3.35Å; H504-K510 PolarHBondContact O-N 2.04Å; W506-K510 VanDerWaalsContact O-CB 3.3Å; W506-K510 WeakPolarHBondContact O-CB 3.24Å; W506-K510 PolarHBondContact O-N 3.11Å
511	N	72.7	Confident	76.4	Confident	142 Å²	142	77 Å²	77	76%	0.759	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-19.7	-173.3	-69.1	-16.3	0	0	0	114.3	F509	F509-N511 PolarHBondContact O-N 3.49Å
512	W	76.6	Confident	76.7	Confident	37 Å²	37	73.7 Å²	73.7	14%	0.14	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.4	-20.6	-172	53.2	-70.8	0	0	0	114.4	Y337 A339 E340 I508 F509	Y337-W512 VanDerWaalsContact CB-CE3 3.42Å; Y337-W512 HydrophobicContact CD1-CB 3.61Å; Y337-W512 HydrophobicContact CD1-CD2 4.44Å; Y337-W512 HydrophobicContact CD1-CE3 4.13Å; Y337-W512 HydrophobicContact CD1-CG 4.31Å; Y337-W512 HydrophobicContact CD2-CD2 4.27Å; Y337-W512 AromaticContact CD2-CE3 3.24Å; Y337-W512 HydrophobicContact CD2-CE3 3.24Å; Y337-W512 AromaticContact CD2-CZ3 3.74Å; Y337-W512 HydrophobicContact CD2-CZ3 3.74Å; Y337-W512 HydrophobicContact CE1-CB 3.8Å; Y337-W512 AromaticContact CE2-CE3 3.94Å; Y337-W512 HydrophobicContact CE2-CE3 3.94Å; Y337-W512 HydrophobicContact CG-CB 4.06Å; Y337-W512 AromaticContact CG-CD2 3.96Å; Y337-W512 HydrophobicContact CG-CD2 3.96Å; Y337-W512 AromaticContact CG-CE3 3.33Å; Y337-W512 HydrophobicContact CG-CE3 3.33Å; Y337-W512 HydrophobicContact CG-CG 4.31Å; Y337-W512 HydrophobicContact CG-CZ3 4.04Å; A339-W512 HydrophobicContact CB-CH2 4.18Å; A339-W512 HydrophobicContact CB-CZ2 3.42Å; A339-W512 VanDerWaalsContact CB-CZ2 3.42Å; E340-W512 HydrophobicContact CG-CH2 3.55Å; E340-W512 HydrophobicContact CG-CZ3 3.6Å; I508-W512 HydrophobicContact CG2-CZ2 4.44Å; I508-W512 PolarHBondContact O-NE1 3.2Å; F509-W512 HydrophobicContact CD1-CH2 4.16Å; F509-W512 AromaticContact CD1-CZ2 3.61Å; F509-W512 HydrophobicContact CD1-CZ2 3.61Å; F509-W512 HydrophobicContact CE1-CH2 4.12Å; F509-W512 AromaticContact CE1-CZ2 3.75Å; F509-W512 HydrophobicContact CE1-CZ2 3.75Å; F509-W512 PolarHBondContact O-N 3.36Å
513	C	75.3	Confident	76.9	Confident	5 Å²	5	68.4 Å²	68.4	3%	0.034	35%	0.346	C	S	.	.			trans	-107.2	116.7	173.4	-173.6	0	0	0	0	111.2	F509 C519	F509-C513 HydrophobicContact CB-CB 4.48Å; F509-C513 PolarHBondContact O-N 3.18Å; C513-C519 WeakPolarHBondContact CA-SG 3.49Å; C513-C519 HydrophobicContact CB-CB 3.69Å; C513-C519 WeakPolarHBondContact CB-SG 2.97Å; C513-C519 WeakPolarHBondContact SG-CB 3.2Å; C513-C519 CovalentContact SG-SG 2.04Å; C513-C519 PolarHBondContact SG-SG 2.85Å
514	R	70.1	Confident	77.2	Confident	201 Å²	201	64.5 Å²	64.5	76%	0.758	33%	0.328	S	S	*	.			trans	-96.1	142.6	175	-69.1	-176.7	-178.5	170.9	2.5	109.7	G516 A517	R514-G516 PolarHBondContact O-N 3.35Å; R514-G516 VanDerWaalsContact O-N 3.15Å; R514-A517 HydrophobicContact CB-CB 4.43Å; R514-A517 PolarHBondContact O-N 3.29Å; R514-A517 VanDerWaalsContact O-N 3.09Å
515	P	66.3	Low	78.1	Confident	106 Å²	106	62.9 Å²	62.9	69%	0.688	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	120.8	174.8	-23.8	32.8	0	0	0	111.4
516	G	63.9	Low	79.2	Confident	37 Å²	37	55.9 Å²	55.9	38%	0.381	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.9	22.8	-179.6	0	0	0	0	0	115.5	R433 R514	R433-G516 PolarHBondContact NH1-O 3.05Å; R433-G516 VanDerWaalsContact NH1-O 3.15Å; R514-G516 PolarHBondContact O-N 3.35Å; R514-G516 VanDerWaalsContact O-N 3.15Å
517	A	68.6	Low	79.7	Confident	39 Å²	39	50.1 Å²	50.1	32%	0.322	26%	0.262	S	S	.	.	S	Bend	trans	-105	157.9	162.1	0	0	0	0	0	110.1	R514 C519	R514-A517 HydrophobicContact CB-CB 4.43Å; R514-A517 PolarHBondContact O-N 3.29Å; R514-A517 VanDerWaalsContact O-N 3.09Å; A517-C519 PolarHBondContact O-N 3.24Å
518	D	73.1	Confident	80.7	Confident	49 Å²	49	42.8 Å²	42.8	26%	0.262	22%	0.224	S	C	.	.			trans	-81.1	104.8	166.1	-179.6	3.5	0	0	0	107.6	T334 D440	T334-D518 HydrophobicContact CG2-CB 4.3Å; T334-D518 WeakPolarHBondContact CG2-OD2 3.26Å; D440-D518 WeakPolarHBondContact OD1-CA 3.17Å
519	C	78.6	Confident	81.6	Confident	7 Å²	7	38.1 Å²	38.1	5%	0.047	20%	0.201	C	C	.	.			trans	-101.6	-32.7	-170.3	-63.7	0	0	0	0	113.1	D440 C513 A517	D440-C519 PolarHBondContact OD1-N 2.9Å; D440-C519 WeakPolarHBondContact OD2-CB 2.97Å; C513-C519 WeakPolarHBondContact CA-SG 3.49Å; C513-C519 HydrophobicContact CB-CB 3.69Å; C513-C519 WeakPolarHBondContact CB-SG 2.97Å; C513-C519 WeakPolarHBondContact SG-CB 3.2Å; C513-C519 CovalentContact SG-SG 2.04Å; C513-C519 PolarHBondContact SG-SG 2.85Å; A517-C519 PolarHBondContact O-N 3.24Å
520	V	85.8	Confident	82.5	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.006	20%	0.199	C	C	.	.			trans	-138.2	118	-169.6	179.4	0	0	0	0	107.9	V496 E497 A500 P522 Y525	V496-V520 HydrophobicContact CB-CG1 4.41Å; V496-V520 HydrophobicContact CG1-CG1 4.11Å; V496-V520 HydrophobicContact CG1-CG2 4.24Å; E497-V520 HydrophobicContact CB-CB 4.27Å; E497-V520 HydrophobicContact CB-CG1 4.2Å; A500-V520 HydrophobicContact CB-CG2 4.32Å; V520-P522 VanDerWaalsContact O-CD 3.28Å; V520-P522 WeakPolarHBondContact O-CD 3.47Å; V520-Y525 HydrophobicContact CG1-CD2 4.36Å; V520-Y525 HydrophobicContact CG1-CE2 3.67Å
521	T	87.6	Confident	83.6	Confident	5 Å²	5	30.8 Å²	30.8	3%	0.031	17%	0.169	C	C	.	.			trans	-94.8	107.8	176.4	40.9	0	0	0	0	111.2	T334 G523 L524 Y525	T334-T521 WeakPolarHBondContact OG1-CG2 3.49Å; T521-G523 PolarHBondContact O-N 3.46Å; T521-L524 WeakPolarHBondContact O-CB 3.43Å; T521-L524 PolarHBondContact O-N 2.93Å; T521-L524 VanDerWaalsContact O-N 3.11Å; T521-L524 WeakPolarHBondContact OG1-CB 3.02Å; T521-Y525 WeakPolarHBondContact O-CD2 3.28Å
522	P	89.6	Confident	84.8	Confident	11 Å²	11	24 Å²	24	7%	0.071	13%	0.133	C	C	.	.	H	α-helix	trans	-63.6	-26.3	-178.2	-22.9	36	0	0	0	113.4	I494 E497 V520 L524 Y525 A526	I494-P522 HydrophobicContact CG1-CB 4.02Å; I494-P522 HydrophobicContact CG1-CG 4.32Å; E497-P522 HydrophobicContact CB-CG 4.4Å; E497-P522 WeakPolarHBondContact OE2-CG 3.45Å; V520-P522 VanDerWaalsContact O-CD 3.28Å; V520-P522 WeakPolarHBondContact O-CD 3.47Å; P522-L524 VanDerWaalsContact C-N 3.35Å; P522-Y525 PolarHBondContact O-N 3Å; P522-A526 PolarHBondContact O-N 3.04Å; P522-A526 VanDerWaalsContact O-N 3.13Å
523	G	89.4	Confident	85.7	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-60.9	-40.6	173.6	0	0	0	0	0	112.6	Y332 F411 D413 T521 Y525 A526 M527	Y332-G523 PolarHBondContact OH-O 2.89Å; F411-G523 WeakPolarHBondContact O-CA 2.97Å; D413-G523 PolarHBondContact OD1-N 2.69Å; T521-G523 PolarHBondContact O-N 3.46Å; G523-Y525 VanDerWaalsContact C-N 3.34Å; G523-Y525 PolarHBondContact O-N 2.93Å; G523-A526 WeakPolarHBondContact O-CB 3.44Å; G523-A526 PolarHBondContact O-N 2.92Å; G523-A526 VanDerWaalsContact O-N 3.13Å; G523-M527 PolarHBondContact O-N 3.41Å
524	L	91.1	Very high	86.7	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-61.1	-42.3	176.5	179.3	60.7	0	0	0	111.8	W336 F344 T521 P522 A526 M527 V528 Y557	W336-L524 HydrophobicContact CB-CD2 3.93Å; F344-L524 HydrophobicContact CZ-CD2 4.04Å; F344-L524 HydrophobicContact CZ-CG 4.24Å; T521-L524 WeakPolarHBondContact O-CB 3.43Å; T521-L524 PolarHBondContact O-N 2.93Å; T521-L524 VanDerWaalsContact O-N 3.11Å; T521-L524 WeakPolarHBondContact OG1-CB 3.02Å; P522-L524 VanDerWaalsContact C-N 3.35Å; L524-A526 VanDerWaalsContact C-N 3.32Å; L524-A526 PolarHBondContact O-N 3.46Å; L524-M527 HydrophobicContact CD1-CE 3.69Å; L524-M527 PolarHBondContact O-N 3.15Å; L524-V528 HydrophobicContact CD1-CG2 4.37Å; L524-V528 WeakPolarHBondContact O-CG2 3.22Å; L524-V528 PolarHBondContact O-N 3.09Å; L524-Y557 HydrophobicContact CD1-CD1 3.66Å; L524-Y557 HydrophobicContact CD1-CE1 4.3Å; L524-Y557 HydrophobicContact CD1-CG 3.98Å; L524-Y557 HydrophobicContact CD2-CD1 3.95Å; L524-Y557 HydrophobicContact CD2-CE1 4.12Å; L524-Y557 HydrophobicContact CG-CD1 4.49Å
525	Y	94.5	Very high	87.9	Confident	1 Å²	1	12.7 Å²	12.7	0%	0.004	9%	0.09	C	C	.	.	H	α-helix	trans	-64.3	-38.1	176.3	-75.5	-109.9	0	0	0	111.8	E340 P343 F344 L347 G489 V492 V496 V520 T521 P522 G523 M527 V528 G529	E340-Y525 WeakPolarHBondContact CB-OH 3.46Å; E340-Y525 VanDerWaalsContact CD-OH 3.3Å; E340-Y525 WeakPolarHBondContact CG-OH 3.46Å; E340-Y525 PolarHBondContact OE1-OH 3.28Å; P343-Y525 HydrophobicContact CB-CE1 3.87Å; P343-Y525 HydrophobicContact CG-CE1 3.75Å; F344-Y525 HydrophobicContact CD1-CD1 4.11Å; F344-Y525 HydrophobicContact CD1-CE1 4.1Å; F344-Y525 AromaticContact CE1-CD1 3.71Å; F344-Y525 HydrophobicContact CE1-CD1 3.71Å; F344-Y525 AromaticContact CE1-CD2 3.81Å; F344-Y525 HydrophobicContact CE1-CD2 3.81Å; F344-Y525 AromaticContact CE1-CE1 3.68Å; F344-Y525 HydrophobicContact CE1-CE1 3.68Å; F344-Y525 AromaticContact CE1-CE2 3.75Å; F344-Y525 HydrophobicContact CE1-CE2 3.75Å; F344-Y525 AromaticContact CE1-CG 3.78Å; F344-Y525 HydrophobicContact CE1-CG 3.78Å; F344-Y525 AromaticContact CE1-CZ 3.7Å; F344-Y525 HydrophobicContact CZ-CD2 4.33Å; F344-Y525 HydrophobicContact CZ-CE1 4.47Å; F344-Y525 AromaticContact CZ-CE2 3.97Å; F344-Y525 HydrophobicContact CZ-CE2 3.97Å; L347-Y525 HydrophobicContact CD1-CD1 4.19Å; G489-Y525 VanDerWaalsContact CA-O 3.25Å; G489-Y525 WeakPolarHBondContact CA-O 3.25Å; G489-Y525 VanDerWaalsContact O-CB 3.27Å; G489-Y525 WeakPolarHBondContact O-CB 3.34Å; V492-Y525 HydrophobicContact CG1-CD1 4.04Å; V492-Y525 HydrophobicContact CG1-CE1 4.39Å; V496-Y525 HydrophobicContact CB-CE1 4.44Å; V496-Y525 HydrophobicContact CG2-CE1 4.15Å; V520-Y525 HydrophobicContact CG1-CD2 4.36Å; V520-Y525 HydrophobicContact CG1-CE2 3.67Å; T521-Y525 WeakPolarHBondContact O-CD2 3.28Å; P522-Y525 PolarHBondContact O-N 3Å; G523-Y525 VanDerWaalsContact C-N 3.34Å; G523-Y525 PolarHBondContact O-N 2.93Å; Y525-M527 VanDerWaalsContact C-N 3.35Å; Y525-V528 PolarHBondContact O-N 3.45Å; Y525-G529 PolarHBondContact O-N 3.04Å
526	A	95	Very high	89.3	Confident	0 Å²	0	7.7 Å²	7.7	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-60.2	-44.2	173.6	0	0	0	0	0	111.4	L410 F411 A486 R490 P522 G523 L524 G529 A530	L410-A526 HydrophobicContact CB-CB 4.36Å; L410-A526 WeakPolarHBondContact O-CB 3.02Å; F411-A526 HydrophobicContact CD1-CB 3.89Å; F411-A526 HydrophobicContact CE1-CB 4.2Å; A486-A526 WeakPolarHBondContact CA-O 3.29Å; A486-A526 WeakPolarHBondContact O-CB 3.35Å; R490-A526 HydrophobicContact CB-CB 4.01Å; P522-A526 PolarHBondContact O-N 3.04Å; P522-A526 VanDerWaalsContact O-N 3.13Å; G523-A526 WeakPolarHBondContact O-CB 3.44Å; G523-A526 PolarHBondContact O-N 2.92Å; G523-A526 VanDerWaalsContact O-N 3.13Å; L524-A526 VanDerWaalsContact C-N 3.32Å; L524-A526 PolarHBondContact O-N 3.46Å; A526-G529 PolarHBondContact O-N 2.97Å; A526-A530 WeakPolarHBondContact O-CB 3.25Å; A526-A530 PolarHBondContact O-N 2.87Å
527	M	93.3	Very high	90.8	Very high	4 Å²	4	5.9 Å²	5.9	2%	0.02	4%	0.039	C	C	.	.	H	α-helix	trans	-65	-44.1	176.2	-65.7	-163.7	-52.9	0	0	113.2	Y332 F411 G523 L524 Y525 G529 A530 A531 T552	Y332-M527 HydrophobicContact CD2-CE 3.71Å; Y332-M527 HydrophobicContact CE2-CE 2.99Å; Y332-M527 HydrophobicContact CE2-SD 3.44Å; Y332-M527 WeakPolarHBondContact CE2-SD 3.29Å; Y332-M527 WeakPolarHBondContact OH-CG 3.44Å; Y332-M527 PolarHBondContact OH-SD 3.06Å; Y332-M527 VanDerWaalsContact OH-SD 3.35Å; F411-M527 HydrophobicContact CB-CG 4.37Å; F411-M527 HydrophobicContact CD1-CG 3.59Å; F411-M527 HydrophobicContact CD2-CG 3.86Å; F411-M527 HydrophobicContact CD2-SD 4.34Å; F411-M527 HydrophobicContact CE1-CB 4.24Å; F411-M527 HydrophobicContact CE1-CG 3.69Å; F411-M527 HydrophobicContact CE2-CG 3.95Å; F411-M527 HydrophobicContact CG-CG 3.69Å; F411-M527 HydrophobicContact CZ-CB 4.38Å; F411-M527 HydrophobicContact CZ-CG 3.86Å; G523-M527 PolarHBondContact O-N 3.41Å; L524-M527 HydrophobicContact CD1-CE 3.69Å; L524-M527 PolarHBondContact O-N 3.15Å; Y525-M527 VanDerWaalsContact C-N 3.35Å; M527-G529 VanDerWaalsContact C-N 3.32Å; M527-G529 PolarHBondContact O-N 3.42Å; M527-A530 WeakPolarHBondContact O-CB 3.35Å; M527-A530 PolarHBondContact O-N 3.49Å; M527-A531 PolarHBondContact O-N 2.88Å; M527-T552 HydrophobicContact CE-CG2 3.44Å; M527-T552 VanDerWaalsContact CE-CG2 3.44Å; M527-T552 HydrophobicContact SD-CG2 3.16Å; M527-T552 WeakPolarHBondContact SD-CG2 3.3Å
528	V	95.4	Very high	92	Very high	0 Å²	0	4 Å²	4	0%	0	2%	0.023	C	C	.	.	H	α-helix	trans	-62	-42.2	176.8	174.1	0	0	0	0	110.7	F344 L347 L524 Y525 A531 A532 P560 L561 A564	F344-V528 HydrophobicContact CB-CG1 3.95Å; F344-V528 HydrophobicContact CD1-CB 4.01Å; F344-V528 HydrophobicContact CD1-CG1 3.73Å; F344-V528 HydrophobicContact CD1-CG2 3.99Å; F344-V528 HydrophobicContact CE1-CB 4.36Å; F344-V528 HydrophobicContact CE1-CG2 4.04Å; F344-V528 HydrophobicContact CG-CG1 4.01Å; F344-V528 HydrophobicContact CG-CG2 4.43Å; L347-V528 HydrophobicContact CD1-CG1 4.45Å; L524-V528 HydrophobicContact CD1-CG2 4.37Å; L524-V528 WeakPolarHBondContact O-CG2 3.22Å; L524-V528 PolarHBondContact O-N 3.09Å; Y525-V528 PolarHBondContact O-N 3.45Å; V528-A531 PolarHBondContact O-N 2.98Å; V528-A532 WeakPolarHBondContact O-CB 3.3Å; V528-A532 PolarHBondContact O-N 2.91Å; V528-P560 HydrophobicContact CG2-CB 4.46Å; V528-L561 HydrophobicContact CG2-CD2 4.02Å; V528-L561 HydrophobicContact CG2-CG 4.47Å; V528-A564 HydrophobicContact CG1-CB 3.43Å; V528-A564 VanDerWaalsContact CG1-CB 3.43Å
529	G	96.8	Very high	92.9	Very high	2 Å²	2	2 Å²	2	2%	0.021	1%	0.012	C	C	.	.	H	α-helix	trans	-61.9	-43.7	173.6	0	0	0	0	0	112.7	G485 Y525 A526 M527 A531 A532 C533	G485-G529 VanDerWaalsContact CA-C 3.43Å; G485-G529 WeakPolarHBondContact CA-O 3.29Å; G485-G529 CarbonylContact O-C 3.49Å; G485-G529 WeakPolarHBondContact O-CA 3.16Å; Y525-G529 PolarHBondContact O-N 3.04Å; A526-G529 PolarHBondContact O-N 2.97Å; M527-G529 VanDerWaalsContact C-N 3.32Å; M527-G529 PolarHBondContact O-N 3.42Å; G529-A531 PolarHBondContact O-N 3.25Å; G529-A532 PolarHBondContact O-N 2.68Å; G529-C533 PolarHBondContact O-N 2.93Å
530	A	96	Very high	93.4	Very high	0 Å²	0	1.9 Å²	1.9	0%	0	1%	0.011	C	C	.	.	H	α-helix	trans	-59.7	-46	176.2	0	0	0	0	0	111.8	F411 M482 A486 A526 M527 L534 M548	F411-A530 HydrophobicContact CE1-CB 4.06Å; F411-A530 HydrophobicContact CZ-CB 3.84Å; M482-A530 HydrophobicContact CB-CB 4.11Å; M482-A530 HydrophobicContact CG-CB 4.43Å; M482-A530 WeakPolarHBondContact O-CB 3.09Å; A486-A530 HydrophobicContact CB-CB 4.21Å; A526-A530 WeakPolarHBondContact O-CB 3.25Å; A526-A530 PolarHBondContact O-N 2.87Å; M527-A530 WeakPolarHBondContact O-CB 3.35Å; M527-A530 PolarHBondContact O-N 3.49Å; A530-L534 VanDerWaalsContact O-CB 3.28Å; A530-L534 WeakPolarHBondContact O-CB 3.5Å; A530-L534 PolarHBondContact O-N 3.11Å; A530-M548 HydrophobicContact CB-CE 4.32Å
531	A	95.9	Very high	93.7	Very high	0 Å²	0	2.9 Å²	2.9	0%	0	2%	0.017	C	C	.	.	H	α-helix	trans	-64.3	-42.4	175.5	0	0	0	0	0	112	M527 V528 G529 G535 L544 M548 L561	M527-A531 PolarHBondContact O-N 2.88Å; V528-A531 PolarHBondContact O-N 2.98Å; G529-A531 PolarHBondContact O-N 3.25Å; A531-G535 PolarHBondContact O-N 3.17Å; A531-L544 VanDerWaalsContact O-CD2 3.26Å; A531-L544 WeakPolarHBondContact O-CD2 3.37Å; A531-M548 HydrophobicContact CB-CE 4.3Å; A531-M548 HydrophobicContact CB-CG 4.21Å; A531-L561 HydrophobicContact CB-CD2 3.78Å
532	A	97.4	Very high	94	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-61	-50.7	177.5	0	0	0	0	0	112.2	L347 V528 G529 G535 G536 A564 S568	L347-A532 WeakPolarHBondContact O-CB 3.22Å; V528-A532 WeakPolarHBondContact O-CB 3.3Å; V528-A532 PolarHBondContact O-N 2.91Å; G529-A532 PolarHBondContact O-N 2.68Å; A532-G535 PolarHBondContact O-N 3.44Å; A532-G536 PolarHBondContact O-N 2.57Å; A532-A564 HydrophobicContact CB-CB 4.33Å; A532-S568 VanDerWaalsContact O-CB 3.29Å; A532-S568 WeakPolarHBondContact O-CB 3.47Å; A532-S568 PolarHBondContact O-OG 3.2Å
533	C	96.8	Very high	94.2	Very high	0 Å²	0	6.1 Å²	6.1	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-66	-41.7	179.8	-77.3	0	0	0	0	112.4	S481 G485 G529 G536 V537	S481-C533 WeakPolarHBondContact O-CB 3.33Å; G485-C533 WeakPolarHBondContact CA-SG 3.27Å; G529-C533 PolarHBondContact O-N 2.93Å; C533-G536 PolarHBondContact O-N 3.28Å; C533-V537 WeakPolarHBondContact O-CG2 3.39Å; C533-V537 PolarHBondContact O-N 3.08Å
534	L	95.4	Very high	94.4	Very high	5 Å²	5	6.3 Å²	6.3	3%	0.026	4%	0.037	C	C	.	.	H	α-helix	trans	-64	-46.5	176.7	-178.6	55.7	0	0	0	111	F478 M482 A530 G536 V537 T538 L544	F478-L534 HydrophobicContact CB-CD1 4.37Å; F478-L534 HydrophobicContact CD1-CD1 3.69Å; F478-L534 HydrophobicContact CE1-CD1 4.4Å; F478-L534 HydrophobicContact CG-CD1 4.35Å; M482-L534 HydrophobicContact CG-CB 3.99Å; M482-L534 HydrophobicContact CG-CD2 3.6Å; M482-L534 HydrophobicContact CG-CG 4.3Å; M482-L534 HydrophobicContact SD-CD2 3.77Å; A530-L534 VanDerWaalsContact O-CB 3.28Å; A530-L534 WeakPolarHBondContact O-CB 3.5Å; A530-L534 PolarHBondContact O-N 3.11Å; L534-G536 VanDerWaalsContact C-N 3.29Å; L534-G536 PolarHBondContact O-N 3.32Å; L534-V537 PolarHBondContact O-N 3.37Å; L534-T538 HydrophobicContact CD1-CG2 3.67Å; L534-T538 PolarHBondContact O-N 3.07Å; L534-T538 PolarHBondContact O-OG1 3.27Å; L534-L544 HydrophobicContact CB-CD1 4.43Å; L534-L544 HydrophobicContact CB-CD2 4.15Å; L534-L544 HydrophobicContact CD2-CD1 3.44Å; L534-L544 VanDerWaalsContact CD2-CD1 3.44Å; L534-L544 HydrophobicContact CD2-CD2 4.5Å; L534-L544 HydrophobicContact CG-CD1 4.02Å; L534-L544 HydrophobicContact CG-CD2 4.18Å
535	G	95.1	Very high	94.5	Very high	0 Å²	0	6.7 Å²	6.7	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-61	-33.6	176.5	0	0	0	0	0	113.4	A531 A532 R539	A531-G535 PolarHBondContact O-N 3.17Å; A532-G535 PolarHBondContact O-N 3.44Å; G535-R539 WeakPolarHBondContact O-CA 3.41Å; G535-R539 PolarHBondContact O-N 3.11Å
536	G	95.4	Very high	94.5	Very high	0 Å²	0	8 Å²	8	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-70	-35.8	175.8	0	0	0	0	0	113.4	A532 C533 L534 R539 S568	A532-G536 PolarHBondContact O-N 2.57Å; C533-G536 PolarHBondContact O-N 3.28Å; L534-G536 VanDerWaalsContact C-N 3.29Å; L534-G536 PolarHBondContact O-N 3.32Å; G536-R539 WeakPolarHBondContact O-CD 3Å; G536-R539 PolarHBondContact O-NE 3.3Å; G536-S568 WeakPolarHBondContact CA-OG 3.49Å; G536-S568 PolarHBondContact N-OG 3.4Å; G536-S568 VanDerWaalsContact N-OG 3.13Å
537	V	95.5	Very high	94.4	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-79.4	-43.2	179.8	172	0	0	0	0	112	F358 L477 C533 L534 I580	F358-V537 HydrophobicContact CD1-CG1 4Å; F358-V537 HydrophobicContact CD1-CG2 4.22Å; F358-V537 HydrophobicContact CE1-CG1 4.12Å; L477-V537 HydrophobicContact CD2-CG1 3.6Å; L477-V537 HydrophobicContact CG-CG1 4.19Å; C533-V537 WeakPolarHBondContact O-CG2 3.39Å; C533-V537 PolarHBondContact O-N 3.08Å; L534-V537 PolarHBondContact O-N 3.37Å; V537-I580 HydrophobicContact CG1-CB 4.17Å; V537-I580 HydrophobicContact CG1-CG2 3.92Å; V537-I580 WeakPolarHBondContact O-CG2 3.42Å; V537-I580 PolarHBondContact O-N 2.73Å; V537-I580 VanDerWaalsContact O-N 3.16Å
538	T	93.3	Very high	94.2	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-97.1	-15.2	-174.3	62.6	0	0	0	0	113.8	F478 L534 M540 Y581	F478-T538 HydrophobicContact CD1-CG2 4.07Å; F478-T538 HydrophobicContact CE1-CG2 3.68Å; L534-T538 HydrophobicContact CD1-CG2 3.67Å; L534-T538 PolarHBondContact O-N 3.07Å; L534-T538 PolarHBondContact O-OG1 3.27Å; T538-M540 HydrophobicContact CG2-SD 4.5Å; T538-M540 PolarHBondContact O-N 3.44Å; T538-M540 WeakPolarHBondContact OG1-CB 3.18Å; T538-M540 VanDerWaalsContact OG1-CG 3.22Å; T538-M540 WeakPolarHBondContact OG1-CG 3.22Å; T538-M540 PolarHBondContact OG1-N 3.44Å; T538-Y581 HydrophobicContact CG2-CE2 4.11Å
539	R	92.3	Very high	93.9	Very high	6 Å²	6	10.3 Å²	10.3	2%	0.023	6%	0.058	C	C	.	.			trans	62.1	20.3	-174.2	-48.6	-53.8	178	97.8	6.1	114.7	G535 G536 A572 D573 G576 E578	G535-R539 WeakPolarHBondContact O-CA 3.41Å; G535-R539 PolarHBondContact O-N 3.11Å; G536-R539 WeakPolarHBondContact O-CD 3Å; G536-R539 PolarHBondContact O-NE 3.3Å; R539-A572 VanDerWaalsContact CZ-C 3.46Å; R539-A572 VanDerWaalsContact NH1-CB 3.33Å; R539-A572 PolarHBondContact NH1-O 3.11Å; R539-A572 VanDerWaalsContact NH1-O 3.15Å; R539-A572 VanDerWaalsContact NH2-CB 3.31Å; R539-A572 PolarHBondContact NH2-O 3.38Å; R539-A572 VanDerWaalsContact NH2-O 3.16Å; R539-D573 IonicContact CZ-OD1 2.82Å; R539-D573 VanDerWaalsContact NH1-CA 3.27Å; R539-D573 IonicContact NH1-OD1 3.58Å; R539-D573 PolarHBondContact NH1-OD1 2.93Å; R539-G576 PolarHBondContact NH1-O 3.13Å; R539-G576 PolarHBondContact NH2-O 3.03Å; R539-E578 PolarHBondContact NH2-O 3.45Å
540	M	90.6	Very high	93.5	Very high	5 Å²	5	12.1 Å²	12.1	3%	0.025	7%	0.066	C	C	.	.			trans	-85.1	141.5	176	-59.7	-177.4	76.5	0	0	111.2	F286 E290 T538 S543 L544	F286-M540 HydrophobicContact CB-CE 4.29Å; F286-M540 HydrophobicContact CD2-CE 2.97Å; F286-M540 HydrophobicContact CD2-SD 3.83Å; F286-M540 HydrophobicContact CE2-CE 3.2Å; F286-M540 HydrophobicContact CE2-SD 3.43Å; F286-M540 WeakPolarHBondContact CE2-SD 3.33Å; F286-M540 HydrophobicContact CG-CE 3.79Å; F286-M540 HydrophobicContact CZ-CE 4.24Å; F286-M540 HydrophobicContact CZ-SD 4.41Å; E290-M540 HydrophobicContact CB-CE 4.09Å; E290-M540 HydrophobicContact CG-CE 3.19Å; E290-M540 HydrophobicContact CG-CG 3.4Å; E290-M540 HydrophobicContact CG-SD 3.57Å; E290-M540 VanDerWaalsContact CG-SD 3.57Å; E290-M540 WeakPolarHBondContact OE1-CG 3.3Å; T538-M540 HydrophobicContact CG2-SD 4.5Å; T538-M540 PolarHBondContact O-N 3.44Å; T538-M540 WeakPolarHBondContact OG1-CB 3.18Å; T538-M540 VanDerWaalsContact OG1-CG 3.22Å; T538-M540 WeakPolarHBondContact OG1-CG 3.22Å; T538-M540 PolarHBondContact OG1-N 3.44Å; M540-S543 WeakPolarHBondContact CE-OG 3.27Å; M540-L544 HydrophobicContact CB-CB 4.31Å
541	T	91.5	Very high	93	Very high	22 Å²	22	12.6 Å²	12.6	14%	0.135	7%	0.068	C	C	.	.			trans	-125.4	-74.5	-177.1	50.5	0	0	0	0	112.1	E289 L544 V545 V566 K569	E289-T541 PolarHBondContact OE1-N 2.93Å; E289-T541 PolarHBondContact OE1-OG1 3.46Å; T541-L544 PolarHBondContact O-N 3.48Å; T541-V545 WeakPolarHBondContact O-CG2 3.5Å; T541-V545 PolarHBondContact O-N 2.99Å; T541-V545 VanDerWaalsContact O-N 3.12Å; T541-V566 HydrophobicContact CG2-CG2 4.38Å; T541-K569 HydrophobicContact CG2-CB 4.26Å; T541-K569 HydrophobicContact CG2-CD 3.5Å
542	V	93.1	Very high	92.4	Very high	83 Å²	83	12.8 Å²	12.8	50%	0.503	7%	0.069	S	C	.	.	H	α-helix	trans	-67.9	-48.4	-169.2	179	0	0	0	0	110.7	L285 E289 L544 V545 V546	L285-V542 HydrophobicContact CD1-CG1 4.48Å; E289-V542 PolarHBondContact OE1-N 3.41Å; E289-V542 PolarHBondContact OE2-N 3.49Å; V542-L544 VanDerWaalsContact C-N 3.26Å; V542-L544 PolarHBondContact O-N 2.96Å; V542-V545 PolarHBondContact O-N 2.99Å; V542-V546 WeakPolarHBondContact O-CG2 3.4Å; V542-V546 PolarHBondContact O-N 2.8Å
543	S	93.6	Very high	91.5	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-61.3	-37.5	178.8	63.3	0	0	0	0	112.2	E289 M540 V546 I547	E289-S543 WeakPolarHBondContact OE2-CB 3.28Å; E289-S543 PolarHBondContact OE2-N 2.9Å; E289-S543 PolarHBondContact OE2-OG 3.01Å; M540-S543 WeakPolarHBondContact CE-OG 3.27Å; S543-V546 PolarHBondContact O-N 3.22Å; S543-I547 WeakPolarHBondContact O-CD1 3.25Å; S543-I547 WeakPolarHBondContact O-CG1 3.41Å; S543-I547 PolarHBondContact O-N 3.41Å
544	L	93.4	Very high	90.6	Very high	5 Å²	5	15.9 Å²	15.9	3%	0.026	10%	0.102	C	C	.	.	H	α-helix	trans	-65.8	-46.2	-179.9	175	58.5	0	0	0	111.4	A531 L534 M540 T541 V542 V546 I547 M548	A531-L544 VanDerWaalsContact O-CD2 3.26Å; A531-L544 WeakPolarHBondContact O-CD2 3.37Å; L534-L544 HydrophobicContact CB-CD1 4.43Å; L534-L544 HydrophobicContact CB-CD2 4.15Å; L534-L544 HydrophobicContact CD2-CD1 3.44Å; L534-L544 VanDerWaalsContact CD2-CD1 3.44Å; L534-L544 HydrophobicContact CD2-CD2 4.5Å; L534-L544 HydrophobicContact CG-CD1 4.02Å; L534-L544 HydrophobicContact CG-CD2 4.18Å; M540-L544 HydrophobicContact CB-CB 4.31Å; T541-L544 PolarHBondContact O-N 3.48Å; V542-L544 VanDerWaalsContact C-N 3.26Å; V542-L544 PolarHBondContact O-N 2.96Å; L544-V546 VanDerWaalsContact C-N 3.3Å; L544-V546 PolarHBondContact O-N 3.38Å; L544-I547 PolarHBondContact O-N 3.25Å; L544-M548 HydrophobicContact CD1-CE 3.98Å; L544-M548 HydrophobicContact CD1-CG 4.23Å; L544-M548 WeakPolarHBondContact O-CG 3.31Å; L544-M548 PolarHBondContact O-N 3.03Å
545	V	94.1	Very high	90	Very high	8 Å²	8	21.4 Å²	21.4	5%	0.048	13%	0.13	C	C	.	.	H	α-helix	trans	-61.9	-40.8	177	175.4	0	0	0	0	110.7	T541 V542 M548 F549 I558 L561 M562 A565	T541-V545 WeakPolarHBondContact O-CG2 3.5Å; T541-V545 PolarHBondContact O-N 2.99Å; T541-V545 VanDerWaalsContact O-N 3.12Å; V542-V545 PolarHBondContact O-N 2.99Å; V545-M548 PolarHBondContact O-N 3.04Å; V545-F549 VanDerWaalsContact O-CB 3.32Å; V545-F549 WeakPolarHBondContact O-CB 3.49Å; V545-F549 PolarHBondContact O-N 3.44Å; V545-I558 HydrophobicContact CG1-CB 4.48Å; V545-I558 HydrophobicContact CG1-CG2 3.97Å; V545-L561 HydrophobicContact CG1-CB 4.19Å; V545-L561 HydrophobicContact CG2-CB 4.38Å; V545-M562 HydrophobicContact CG2-CB 4.15Å; V545-A565 HydrophobicContact CG2-CB 4.32Å
546	V	94.1	Very high	89.5	Confident	29 Å²	29	27 Å²	27	18%	0.176	16%	0.157	C	C	.	.	H	α-helix	trans	-67	-39.1	177.3	175.6	0	0	0	0	112.1	I281 L285 V542 S543 L544 F549 E550	I281-V546 HydrophobicContact CB-CG1 4.07Å; I281-V546 HydrophobicContact CG2-CG1 3.81Å; L285-V546 HydrophobicContact CD1-CB 3.96Å; L285-V546 HydrophobicContact CD1-CG1 4.01Å; L285-V546 HydrophobicContact CD1-CG2 3.66Å; V542-V546 WeakPolarHBondContact O-CG2 3.4Å; V542-V546 PolarHBondContact O-N 2.8Å; S543-V546 PolarHBondContact O-N 3.22Å; L544-V546 VanDerWaalsContact C-N 3.3Å; L544-V546 PolarHBondContact O-N 3.38Å; V546-F549 PolarHBondContact O-N 2.86Å; V546-E550 HydrophobicContact CG1-CG 4.5Å; V546-E550 PolarHBondContact O-N 2.97Å
547	I	92.8	Very high	89.1	Confident	7 Å²	7	27.3 Å²	27.3	4%	0.036	16%	0.158	C	C	.	.	H	α-helix	trans	-59.4	-49.3	173.4	-70.2	163.8	0	0	0	110.2	V273 F277 A279 S543 L544 F549 E550 L551	V273-I547 HydrophobicContact CG1-CD1 4.24Å; F277-I547 HydrophobicContact CB-CG2 3.77Å; F277-I547 HydrophobicContact CD1-CG2 4.08Å; F277-I547 HydrophobicContact CD2-CD1 4.43Å; F277-I547 HydrophobicContact CD2-CG2 4.48Å; F277-I547 HydrophobicContact CG-CG2 3.89Å; A279-I547 HydrophobicContact CB-CB 4.33Å; A279-I547 HydrophobicContact CB-CG1 4.14Å; A279-I547 HydrophobicContact CB-CG2 4.14Å; S543-I547 WeakPolarHBondContact O-CD1 3.25Å; S543-I547 WeakPolarHBondContact O-CG1 3.41Å; S543-I547 PolarHBondContact O-N 3.41Å; L544-I547 PolarHBondContact O-N 3.25Å; I547-F549 VanDerWaalsContact C-N 3.31Å; I547-F549 PolarHBondContact O-N 3.21Å; I547-E550 PolarHBondContact O-N 3.45Å; I547-L551 HydrophobicContact CG2-CD1 3.91Å; I547-L551 WeakPolarHBondContact O-CD1 3.36Å; I547-L551 VanDerWaalsContact O-CG 3.27Å; I547-L551 WeakPolarHBondContact O-CG 3.22Å; I547-L551 PolarHBondContact O-N 3.19Å; I547-L551 VanDerWaalsContact O-N 3.09Å
548	M	90.3	Very high	88.9	Confident	2 Å²	2	29.9 Å²	29.9	1%	0.01	17%	0.171	C	C	.	.	H	α-helix	trans	-64.3	-35.9	179.1	-66.9	-65.5	-175.7	0	0	112.4	M482 A530 A531 L544 V545 L551 T552 L561	M482-M548 HydrophobicContact CG-CE 4.21Å; M482-M548 HydrophobicContact SD-CE 3.5Å; M482-M548 VanDerWaalsContact SD-CE 3.5Å; A530-M548 HydrophobicContact CB-CE 4.32Å; A531-M548 HydrophobicContact CB-CE 4.3Å; A531-M548 HydrophobicContact CB-CG 4.21Å; L544-M548 HydrophobicContact CD1-CE 3.98Å; L544-M548 HydrophobicContact CD1-CG 4.23Å; L544-M548 WeakPolarHBondContact O-CG 3.31Å; L544-M548 PolarHBondContact O-N 3.03Å; V545-M548 PolarHBondContact O-N 3.04Å; M548-L551 PolarHBondContact O-N 3.48Å; M548-L551 HydrophobicContact SD-CD1 4.24Å; M548-T552 VanDerWaalsContact O-CG2 3.28Å; M548-T552 WeakPolarHBondContact O-CG2 3.46Å; M548-T552 PolarHBondContact O-N 3.35Å; M548-T552 PolarHBondContact O-OG1 2.79Å; M548-L561 HydrophobicContact CB-CD1 3.91Å; M548-L561 HydrophobicContact CB-CD2 4.39Å
549	F	87.9	Confident	88.9	Confident	43 Å²	43	33.7 Å²	33.7	19%	0.189	19%	0.194	C	C	.	.	H	α-helix	trans	-64.3	-46.5	172.7	156.2	-109.3	0	0	0	112.2	V545 V546 I547 L551 T552 G553 L555 I558	V545-F549 VanDerWaalsContact O-CB 3.32Å; V545-F549 WeakPolarHBondContact O-CB 3.49Å; V545-F549 PolarHBondContact O-N 3.44Å; V546-F549 PolarHBondContact O-N 2.86Å; I547-F549 VanDerWaalsContact C-N 3.31Å; I547-F549 PolarHBondContact O-N 3.21Å; F549-L551 PolarHBondContact O-N 3.01Å; F549-T552 WeakPolarHBondContact CA-OG1 3.47Å; F549-T552 PolarHBondContact O-N 2.83Å; F549-T552 VanDerWaalsContact O-N 3.1Å; F549-T552 PolarHBondContact O-OG1 2.93Å; F549-T552 VanDerWaalsContact O-OG1 3.08Å; F549-G553 PolarHBondContact O-N 2.78Å; F549-L555 HydrophobicContact CD2-CD2 4.01Å; F549-L555 HydrophobicContact CD2-CG 4.49Å; F549-L555 HydrophobicContact CE1-CD2 4.16Å; F549-L555 HydrophobicContact CE2-CB 4.36Å; F549-L555 HydrophobicContact CE2-CD2 3.3Å; F549-L555 HydrophobicContact CE2-CG 3.63Å; F549-L555 HydrophobicContact CZ-CD2 3.38Å; F549-L555 HydrophobicContact CZ-CG 4.02Å; F549-I558 HydrophobicContact CB-CD1 4.46Å; F549-I558 HydrophobicContact CB-CG1 4.18Å; F549-I558 HydrophobicContact CD2-CD1 4.18Å; F549-I558 HydrophobicContact CD2-CG1 4.36Å; F549-I558 HydrophobicContact CG-CD1 4.15Å; F549-I558 HydrophobicContact CG-CG1 4.33Å
550	E	89.8	Confident	88.9	Confident	40 Å²	40	33.4 Å²	33.4	19%	0.187	19%	0.193	C	C	.	.	H	α-helix	trans	-64.4	-28.6	178.7	-75.3	-170.7	128.2	0	0	112.3	A279 P280 I281 G282 V546 I547	A279-E550 WeakPolarHBondContact CA-OE2 3.44Å; A279-E550 HydrophobicContact CB-CB 3.98Å; A279-E550 WeakPolarHBondContact CB-OE2 3.32Å; P280-E550 WeakPolarHBondContact CD-OE1 3.32Å; I281-E550 WeakPolarHBondContact CB-OE1 3.41Å; I281-E550 WeakPolarHBondContact CD1-OE1 3.27Å; I281-E550 WeakPolarHBondContact CG1-OE1 3.26Å; I281-E550 PolarHBondContact N-OE1 2.62Å; I281-E550 VanDerWaalsContact N-OE1 3.12Å; I281-E550 PolarHBondContact N-OE2 3.13Å; I281-E550 VanDerWaalsContact N-OE2 3.09Å; G282-E550 PolarHBondContact N-OE2 3.28Å; V546-E550 HydrophobicContact CG1-CG 4.5Å; V546-E550 PolarHBondContact O-N 2.97Å; I547-E550 PolarHBondContact O-N 3.45Å
551	L	84.8	Confident	89	Confident	9 Å²	9	33.2 Å²	33.2	5%	0.047	19%	0.192	C	C	.	.	H	α-helix	trans	-74.9	-25.1	174.5	-71.3	164	0	0	0	113.9	F277 V326 F328 Y329 V330 I547 M548 F549	F277-L551 VanDerWaalsContact O-CD2 3.29Å; F277-L551 WeakPolarHBondContact O-CD2 3.38Å; V326-L551 HydrophobicContact CB-CD2 4.09Å; V326-L551 HydrophobicContact CG1-CD2 4.41Å; V326-L551 HydrophobicContact CG2-CD2 3.85Å; F328-L551 HydrophobicContact CD2-CD1 4.26Å; F328-L551 HydrophobicContact CD2-CD2 4.17Å; F328-L551 HydrophobicContact CE2-CD1 3.57Å; F328-L551 HydrophobicContact CE2-CD2 3.75Å; F328-L551 HydrophobicContact CE2-CG 4.27Å; F328-L551 HydrophobicContact CZ-CD2 4.5Å; Y329-L551 WeakPolarHBondContact CD2-O 3.44Å; Y329-L551 WeakPolarHBondContact CE2-O 3.37Å; V330-L551 PolarHBondContact N-O 3.5Å; I547-L551 HydrophobicContact CG2-CD1 3.91Å; I547-L551 WeakPolarHBondContact O-CD1 3.36Å; I547-L551 VanDerWaalsContact O-CG 3.27Å; I547-L551 WeakPolarHBondContact O-CG 3.22Å; I547-L551 PolarHBondContact O-N 3.19Å; I547-L551 VanDerWaalsContact O-N 3.09Å; M548-L551 PolarHBondContact O-N 3.48Å; M548-L551 HydrophobicContact SD-CD1 4.24Å; F549-L551 PolarHBondContact O-N 3.01Å
552	T	82.4	Confident	89.2	Confident	4 Å²	4	37.1 Å²	37.1	3%	0.025	21%	0.21	C	C	.	.	H	α-helix	trans	-101.8	-23.2	-175.1	49.6	0	0	0	0	113.8	V330 Y332 M527 M548 F549 G554	V330-T552 CarbonylContact O-C 2.99Å; V330-T552 WeakPolarHBondContact O-CA 3.44Å; V330-T552 VanDerWaalsContact O-O 3.12Å; Y332-T552 HydrophobicContact CE2-CG2 4.31Å; M527-T552 HydrophobicContact CE-CG2 3.44Å; M527-T552 VanDerWaalsContact CE-CG2 3.44Å; M527-T552 HydrophobicContact SD-CG2 3.16Å; M527-T552 WeakPolarHBondContact SD-CG2 3.3Å; M548-T552 VanDerWaalsContact O-CG2 3.28Å; M548-T552 WeakPolarHBondContact O-CG2 3.46Å; M548-T552 PolarHBondContact O-N 3.35Å; M548-T552 PolarHBondContact O-OG1 2.79Å; F549-T552 WeakPolarHBondContact CA-OG1 3.47Å; F549-T552 PolarHBondContact O-N 2.83Å; F549-T552 VanDerWaalsContact O-N 3.1Å; F549-T552 PolarHBondContact O-OG1 2.93Å; F549-T552 VanDerWaalsContact O-OG1 3.08Å; T552-G554 PolarHBondContact O-N 3.44Å; T552-G554 VanDerWaalsContact O-N 3.08Å
553	G	78.4	Confident	89.3	Confident	49 Å²	49	34.4 Å²	34.4	51%	0.505	20%	0.196	S	C	.	.			trans	70.8	-4.6	-176.3	0	0	0	0	0	114.9	F549	F549-G553 PolarHBondContact O-N 2.78Å
554	G	78.6	Confident	89.5	Confident	17 Å²	17	34.4 Å²	34.4	18%	0.175	20%	0.196	C	C	.	.			trans	-104.8	114.1	-176.1	0	0	0	0	0	113.5	T552 E556	T552-G554 PolarHBondContact O-N 3.44Å; T552-G554 VanDerWaalsContact O-N 3.08Å; G554-E556 PolarHBondContact O-N 3.04Å
555	L	82.6	Confident	89.6	Confident	120 Å²	120	34.2 Å²	34.2	63%	0.628	20%	0.195	S	C	*	.	G	3₁₀ helix	trans	-66.3	-24.2	176.2	-73.6	169.6	0	0	0	113	F549 Y557 I558	F549-L555 HydrophobicContact CD2-CD2 4.01Å; F549-L555 HydrophobicContact CD2-CG 4.49Å; F549-L555 HydrophobicContact CE1-CD2 4.16Å; F549-L555 HydrophobicContact CE2-CB 4.36Å; F549-L555 HydrophobicContact CE2-CD2 3.3Å; F549-L555 HydrophobicContact CE2-CG 3.63Å; F549-L555 HydrophobicContact CZ-CD2 3.38Å; F549-L555 HydrophobicContact CZ-CG 4.02Å; L555-Y557 VanDerWaalsContact C-N 3.26Å; L555-Y557 PolarHBondContact O-N 3.49Å; L555-I558 HydrophobicContact CD2-CD1 3.78Å; L555-I558 WeakPolarHBondContact O-CG1 3.4Å; L555-I558 PolarHBondContact O-N 2.9Å
556	E	85	Confident	89.7	Confident	119 Å²	119	35.7 Å²	35.7	56%	0.556	20%	0.204	S	C	*	.	G	3₁₀ helix	trans	-66.1	-29.3	-174.6	-60.9	-173.2	174.5	0	0	112.4	W336 G554 I558	W336-E556 PolarHBondContact NE1-O 2.93Å; G554-E556 PolarHBondContact O-N 3.04Å; E556-I558 VanDerWaalsContact C-N 3.31Å; E556-I558 PolarHBondContact O-N 3.45Å
557	Y	87.7	Confident	89.8	Confident	6 Å²	6	35.4 Å²	35.4	2%	0.024	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-82.6	-1.7	-176.5	-48.3	-59.4	0	0	0	114.2	Y332 T334 W336 L524 L555 V559 P560 L561	Y332-Y557 WeakPolarHBondContact CB-OH 3.33Å; Y332-Y557 HydrophobicContact CD2-CE2 4.26Å; Y332-Y557 HydrophobicContact CG-CE2 4.49Å; Y332-Y557 PolarHBondContact O-OH 3.44Å; T334-Y557 PolarHBondContact O-OH 2.9Å; T334-Y557 VanDerWaalsContact O-OH 3.04Å; W336-Y557 AromaticContact CD1-CD1 3.94Å; L524-Y557 HydrophobicContact CD1-CD1 3.66Å; L524-Y557 HydrophobicContact CD1-CE1 4.3Å; L524-Y557 HydrophobicContact CD1-CG 3.98Å; L524-Y557 HydrophobicContact CD2-CD1 3.95Å; L524-Y557 HydrophobicContact CD2-CE1 4.12Å; L524-Y557 HydrophobicContact CG-CD1 4.49Å; L555-Y557 VanDerWaalsContact C-N 3.26Å; L555-Y557 PolarHBondContact O-N 3.49Å; Y557-V559 VanDerWaalsContact C-N 3.32Å; Y557-V559 PolarHBondContact O-N 3.38Å; Y557-P560 VanDerWaalsContact O-CD 3.26Å; Y557-P560 WeakPolarHBondContact O-CD 3.17Å; Y557-P560 VanDerWaalsContact O-CG 3.29Å; Y557-P560 WeakPolarHBondContact O-CG 3.46Å; Y557-L561 WeakPolarHBondContact O-CB 3.47Å; Y557-L561 WeakPolarHBondContact O-CD1 3.26Å; Y557-L561 VanDerWaalsContact O-CG 3.23Å; Y557-L561 WeakPolarHBondContact O-CG 3.42Å; Y557-L561 PolarHBondContact O-N 3.17Å
558	I	91.3	Very high	90	Very high	54 Å²	54	35.1 Å²	35.1	28%	0.277	20%	0.201	S	C	.	.	H	α-helix	trans	-61.7	-40.4	-179.7	-70.9	175.4	0	0	0	111.7	V545 F549 L555 E556 M562	V545-I558 HydrophobicContact CG1-CB 4.48Å; V545-I558 HydrophobicContact CG1-CG2 3.97Å; F549-I558 HydrophobicContact CB-CD1 4.46Å; F549-I558 HydrophobicContact CB-CG1 4.18Å; F549-I558 HydrophobicContact CD2-CD1 4.18Å; F549-I558 HydrophobicContact CD2-CG1 4.36Å; F549-I558 HydrophobicContact CG-CD1 4.15Å; F549-I558 HydrophobicContact CG-CG1 4.33Å; L555-I558 HydrophobicContact CD2-CD1 3.78Å; L555-I558 WeakPolarHBondContact O-CG1 3.4Å; L555-I558 PolarHBondContact O-N 2.9Å; E556-I558 VanDerWaalsContact C-N 3.31Å; E556-I558 PolarHBondContact O-N 3.45Å; I558-M562 VanDerWaalsContact O-CB 3.24Å; I558-M562 WeakPolarHBondContact O-CB 3.23Å; I558-M562 PolarHBondContact O-N 3.44Å
559	V	92.3	Very high	90.3	Very high	79 Å²	79	37.3 Å²	37.3	48%	0.479	21%	0.211	S	C	.	.	H	α-helix	trans	-62.9	-54.2	-177.6	176.6	0	0	0	0	112.2	W336 Y557 L561 M562 A563	W336-V559 HydrophobicContact CH2-CB 4.19Å; W336-V559 HydrophobicContact CH2-CG1 3.8Å; W336-V559 HydrophobicContact CZ2-CB 3.72Å; W336-V559 HydrophobicContact CZ2-CG1 3.86Å; W336-V559 HydrophobicContact CZ2-CG2 4.46Å; Y557-V559 VanDerWaalsContact C-N 3.32Å; Y557-V559 PolarHBondContact O-N 3.38Å; V559-L561 PolarHBondContact O-N 2.91Å; V559-M562 PolarHBondContact O-N 2.98Å; V559-A563 WeakPolarHBondContact O-CB 3.32Å; V559-A563 PolarHBondContact O-N 3.37Å
560	P	92.5	Very high	90.6	Very high	0 Å²	0	44 Å²	44	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-64.6	-38.5	179	23.4	-33.7	0	0	0	112.5	W336 F344 V528 Y557 M562 A563 A564	W336-P560 HydrophobicContact CD2-CG 4.07Å; W336-P560 HydrophobicContact CG-CG 4.28Å; F344-P560 HydrophobicContact CD2-CB 3.32Å; F344-P560 HydrophobicContact CD2-CG 4.5Å; F344-P560 HydrophobicContact CE2-CB 3.54Å; F344-P560 HydrophobicContact CE2-CG 4.3Å; F344-P560 HydrophobicContact CG-CB 4.12Å; F344-P560 HydrophobicContact CZ-CB 4.47Å; V528-P560 HydrophobicContact CG2-CB 4.46Å; Y557-P560 VanDerWaalsContact O-CD 3.26Å; Y557-P560 WeakPolarHBondContact O-CD 3.17Å; Y557-P560 VanDerWaalsContact O-CG 3.29Å; Y557-P560 WeakPolarHBondContact O-CG 3.46Å; P560-M562 PolarHBondContact O-N 3.39Å; P560-A563 PolarHBondContact O-N 3.35Å; P560-A564 WeakPolarHBondContact O-CB 3.37Å; P560-A564 PolarHBondContact O-N 3.14Å
561	L	93.8	Very high	91	Very high	1 Å²	1	43.5 Å²	43.5	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-60.7	-45.7	175	-73.3	169.3	0	0	0	111.9	V528 A531 V545 M548 Y557 V559 A565	V528-L561 HydrophobicContact CG2-CD2 4.02Å; V528-L561 HydrophobicContact CG2-CG 4.47Å; A531-L561 HydrophobicContact CB-CD2 3.78Å; V545-L561 HydrophobicContact CG1-CB 4.19Å; V545-L561 HydrophobicContact CG2-CB 4.38Å; M548-L561 HydrophobicContact CB-CD1 3.91Å; M548-L561 HydrophobicContact CB-CD2 4.39Å; Y557-L561 WeakPolarHBondContact O-CB 3.47Å; Y557-L561 WeakPolarHBondContact O-CD1 3.26Å; Y557-L561 VanDerWaalsContact O-CG 3.23Å; Y557-L561 WeakPolarHBondContact O-CG 3.42Å; Y557-L561 PolarHBondContact O-N 3.17Å; V559-L561 PolarHBondContact O-N 2.91Å; L561-A565 VanDerWaalsContact O-CB 3.23Å; L561-A565 WeakPolarHBondContact O-CB 3.24Å; L561-A565 PolarHBondContact O-N 3.34Å
562	M	95	Very high	91.5	Very high	105 Å²	105	43.1 Å²	43.1	52%	0.517	23%	0.232	S	C	.	.	H	α-helix	trans	-67.9	-41.9	179.2	-168.9	172.1	82	0	0	111.7	V545 I558 V559 P560 A564 A565 V566	V545-M562 HydrophobicContact CG2-CB 4.15Å; I558-M562 VanDerWaalsContact O-CB 3.24Å; I558-M562 WeakPolarHBondContact O-CB 3.23Å; I558-M562 PolarHBondContact O-N 3.44Å; V559-M562 PolarHBondContact O-N 2.98Å; P560-M562 PolarHBondContact O-N 3.39Å; M562-A564 PolarHBondContact O-N 2.92Å; M562-A565 PolarHBondContact O-N 2.94Å; M562-V566 HydrophobicContact CG-CG2 4.03Å; M562-V566 VanDerWaalsContact O-CB 3.27Å; M562-V566 WeakPolarHBondContact O-CB 3.26Å; M562-V566 WeakPolarHBondContact O-CG2 3.32Å; M562-V566 PolarHBondContact O-N 3.25Å
563	A	95.4	Very high	91.9	Very high	26 Å²	26	45.3 Å²	45.3	22%	0.215	24%	0.244	C	C	.	.	H	α-helix	trans	-59.9	-46.6	177.1	0	0	0	0	0	111.7	L341 V559 P560 T567	L341-A563 HydrophobicContact CD1-CB 3.7Å; V559-A563 WeakPolarHBondContact O-CB 3.32Å; V559-A563 PolarHBondContact O-N 3.37Å; P560-A563 PolarHBondContact O-N 3.35Å; A563-T567 VanDerWaalsContact O-CB 3.24Å; A563-T567 WeakPolarHBondContact O-CB 3.35Å; A563-T567 PolarHBondContact O-N 3.29Å; A563-T567 PolarHBondContact O-OG1 2.73Å
564	A	96.4	Very high	92.7	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-67.7	-44.8	178.4	0	0	0	0	0	112.5	F344 G348 V528 A532 P560 M562 T567 S568	F344-A564 WeakPolarHBondContact O-CB 3.32Å; G348-A564 WeakPolarHBondContact CA-O 3.48Å; V528-A564 HydrophobicContact CG1-CB 3.43Å; V528-A564 VanDerWaalsContact CG1-CB 3.43Å; A532-A564 HydrophobicContact CB-CB 4.33Å; P560-A564 WeakPolarHBondContact O-CB 3.37Å; P560-A564 PolarHBondContact O-N 3.14Å; M562-A564 PolarHBondContact O-N 2.92Å; A564-T567 PolarHBondContact O-N 3.02Å; A564-S568 VanDerWaalsContact O-CB 3.27Å; A564-S568 WeakPolarHBondContact O-CB 3.37Å; A564-S568 PolarHBondContact O-N 3Å
565	A	95.8	Very high	93.3	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-65.3	-42.9	179.8	0	0	0	0	0	112.5	V545 L561 M562 S568 K569	V545-A565 HydrophobicContact CG2-CB 4.32Å; L561-A565 VanDerWaalsContact O-CB 3.23Å; L561-A565 WeakPolarHBondContact O-CB 3.24Å; L561-A565 PolarHBondContact O-N 3.34Å; M562-A565 PolarHBondContact O-N 2.94Å; A565-S568 PolarHBondContact O-N 2.71Å; A565-K569 PolarHBondContact O-N 2.88Å
566	V	96.3	Very high	93.5	Very high	39 Å²	39	46.7 Å²	46.7	24%	0.236	25%	0.251	C	S	.	.	H	α-helix	trans	-67.7	-42.7	176.8	172.7	0	0	0	0	111	T541 M562 S568 K569 W570	T541-V566 HydrophobicContact CG2-CG2 4.38Å; M562-V566 HydrophobicContact CG-CG2 4.03Å; M562-V566 VanDerWaalsContact O-CB 3.27Å; M562-V566 WeakPolarHBondContact O-CB 3.26Å; M562-V566 WeakPolarHBondContact O-CG2 3.32Å; M562-V566 PolarHBondContact O-N 3.25Å; V566-S568 VanDerWaalsContact C-N 3.33Å; V566-S568 PolarHBondContact O-N 3.39Å; V566-K569 PolarHBondContact O-N 2.82Å; V566-W570 HydrophobicContact CG1-CD2 4.05Å; V566-W570 HydrophobicContact CG1-CG 4.45Å; V566-W570 HydrophobicContact CG1-CH2 4.43Å; V566-W570 HydrophobicContact CG1-CZ2 3.81Å; V566-W570 PolarHBondContact O-N 3.23Å
567	T	96.9	Very high	93.2	Very high	24 Å²	24	49.5 Å²	49.5	15%	0.147	26%	0.261	C	S	.	.	H	α-helix	trans	-59.7	-46	175	-59.4	0	0	0	0	110.8	I345 V349 A563 A564 K569 W570 V571	I345-T567 HydrophobicContact CG2-CG2 4.05Å; V349-T567 HydrophobicContact CG2-CG2 3.87Å; A563-T567 VanDerWaalsContact O-CB 3.24Å; A563-T567 WeakPolarHBondContact O-CB 3.35Å; A563-T567 PolarHBondContact O-N 3.29Å; A563-T567 PolarHBondContact O-OG1 2.73Å; A564-T567 PolarHBondContact O-N 3.02Å; T567-K569 VanDerWaalsContact C-N 3.33Å; T567-K569 PolarHBondContact O-N 2.87Å; T567-W570 PolarHBondContact O-N 2.98Å; T567-V571 HydrophobicContact CG2-CG2 4.41Å; T567-V571 WeakPolarHBondContact O-CG2 3.26Å; T567-V571 PolarHBondContact O-N 3.21Å
568	S	97.1	Very high	93.1	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-57.1	-46.7	176.4	179.1	0	0	0	0	111.9	G348 G351 G352 A532 G536 A564 A565 V566 V571 A572	G348-S568 WeakPolarHBondContact O-CA 3.43Å; G348-S568 VanDerWaalsContact O-CB 3.22Å; G348-S568 WeakPolarHBondContact O-CB 3.41Å; G351-S568 VanDerWaalsContact C-OG 3.24Å; G352-S568 VanDerWaalsContact CA-O 3.25Å; G352-S568 WeakPolarHBondContact CA-O 3.42Å; G352-S568 WeakPolarHBondContact CA-OG 3.05Å; G352-S568 PolarHBondContact N-OG 3.22Å; A532-S568 VanDerWaalsContact O-CB 3.29Å; A532-S568 WeakPolarHBondContact O-CB 3.47Å; A532-S568 PolarHBondContact O-OG 3.2Å; G536-S568 WeakPolarHBondContact CA-OG 3.49Å; G536-S568 PolarHBondContact N-OG 3.4Å; G536-S568 VanDerWaalsContact N-OG 3.13Å; A564-S568 VanDerWaalsContact O-CB 3.27Å; A564-S568 WeakPolarHBondContact O-CB 3.37Å; A564-S568 PolarHBondContact O-N 3Å; A565-S568 PolarHBondContact O-N 2.71Å; V566-S568 VanDerWaalsContact C-N 3.33Å; V566-S568 PolarHBondContact O-N 3.39Å; S568-V571 PolarHBondContact O-N 3.12Å; S568-A572 VanDerWaalsContact O-CB 3.26Å; S568-A572 WeakPolarHBondContact O-CB 3.45Å; S568-A572 PolarHBondContact O-N 3.49Å
569	K	95.3	Very high	93.1	Very high	48 Å²	48	49.5 Å²	49.5	21%	0.209	26%	0.261	C	S	.	.	H	α-helix	trans	-60.3	-48.4	174.7	177.4	176.5	174.7	176	0	112.3	T541 A565 V566 T567 V571 A572 D573	T541-K569 HydrophobicContact CG2-CB 4.26Å; T541-K569 HydrophobicContact CG2-CD 3.5Å; A565-K569 PolarHBondContact O-N 2.88Å; V566-K569 PolarHBondContact O-N 2.82Å; T567-K569 VanDerWaalsContact C-N 3.33Å; T567-K569 PolarHBondContact O-N 2.87Å; K569-V571 PolarHBondContact O-N 3.05Å; K569-A572 CarbonylContact O-C 3.57Å; K569-A572 PolarHBondContact O-N 2.62Å; K569-D573 WeakPolarHBondContact CE-OD2 3.13Å; K569-D573 WeakPolarHBondContact CG-OD2 3.41Å; K569-D573 WeakPolarHBondContact O-CB 3.38Å; K569-D573 VanDerWaalsContact O-CG 3.25Å; K569-D573 PolarHBondContact O-N 2.89Å
570	W	95.8	Very high	93.1	Very high	183 Å²	183	45.7 Å²	45.7	69%	0.693	24%	0.238	S	C	*	.	H	α-helix	trans	-60.1	-44.7	-179.6	-73.7	-7	0	0	0	112.7	V566 T567 A572 D573 A574	V566-W570 HydrophobicContact CG1-CD2 4.05Å; V566-W570 HydrophobicContact CG1-CG 4.45Å; V566-W570 HydrophobicContact CG1-CH2 4.43Å; V566-W570 HydrophobicContact CG1-CZ2 3.81Å; V566-W570 PolarHBondContact O-N 3.23Å; T567-W570 PolarHBondContact O-N 2.98Å; W570-A572 VanDerWaalsContact C-N 3.3Å; W570-A572 PolarHBondContact O-N 3.36Å; W570-D573 PolarHBondContact O-N 2.95Å; W570-A574 PolarHBondContact O-N 3.38Å; W570-A574 VanDerWaalsContact O-N 3.09Å
571	V	96.8	Very high	93.1	Very high	31 Å²	31	45.8 Å²	45.8	19%	0.188	24%	0.238	C	C	.	.	H	α-helix	trans	-61	-44.9	176.1	170.9	0	0	0	0	109.9	V349 L353 T567 S568 K569 A574 F575	V349-V571 HydrophobicContact CB-CG2 4.47Å; V349-V571 HydrophobicContact CG1-CG2 4.41Å; V349-V571 HydrophobicContact CG2-CG2 4.17Å; L353-V571 HydrophobicContact CD2-CG1 4.02Å; L353-V571 HydrophobicContact CG-CG1 4.02Å; T567-V571 HydrophobicContact CG2-CG2 4.41Å; T567-V571 WeakPolarHBondContact O-CG2 3.26Å; T567-V571 PolarHBondContact O-N 3.21Å; S568-V571 PolarHBondContact O-N 3.12Å; K569-V571 PolarHBondContact O-N 3.05Å; V571-A574 WeakPolarHBondContact O-CB 3.45Å; V571-A574 PolarHBondContact O-N 3.03Å; V571-F575 HydrophobicContact CG1-CE2 4.29Å; V571-F575 WeakPolarHBondContact O-CD2 3.3Å
572	A	95.4	Very high	92.9	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-68	-38.2	-179.7	0	0	0	0	0	112	T356 R539 S568 K569 W570 A574 F575 G576	T356-A572 WeakPolarHBondContact OG1-CA 3.49Å; R539-A572 VanDerWaalsContact CZ-C 3.46Å; R539-A572 VanDerWaalsContact NH1-CB 3.33Å; R539-A572 PolarHBondContact NH1-O 3.11Å; R539-A572 VanDerWaalsContact NH1-O 3.15Å; R539-A572 VanDerWaalsContact NH2-CB 3.31Å; R539-A572 PolarHBondContact NH2-O 3.38Å; R539-A572 VanDerWaalsContact NH2-O 3.16Å; S568-A572 VanDerWaalsContact O-CB 3.26Å; S568-A572 WeakPolarHBondContact O-CB 3.45Å; S568-A572 PolarHBondContact O-N 3.49Å; K569-A572 CarbonylContact O-C 3.57Å; K569-A572 PolarHBondContact O-N 2.62Å; W570-A572 VanDerWaalsContact C-N 3.3Å; W570-A572 PolarHBondContact O-N 3.36Å; A572-A574 VanDerWaalsContact C-N 3.25Å; A572-A574 PolarHBondContact O-N 3.26Å; A572-F575 PolarHBondContact O-N 3.43Å; A572-F575 VanDerWaalsContact O-N 3.13Å; A572-G576 PolarHBondContact O-N 3.4Å
573	D	92.5	Very high	92.7	Very high	51 Å²	51	41.7 Å²	41.7	27%	0.273	22%	0.219	S	C	.	.	H	α-helix	trans	-65.6	-30.6	179.6	-76.3	-10.9	0	0	0	111	R539 K569 W570 F575 G576	R539-D573 IonicContact CZ-OD1 2.82Å; R539-D573 VanDerWaalsContact NH1-CA 3.27Å; R539-D573 IonicContact NH1-OD1 3.58Å; R539-D573 PolarHBondContact NH1-OD1 2.93Å; K569-D573 WeakPolarHBondContact CE-OD2 3.13Å; K569-D573 WeakPolarHBondContact CG-OD2 3.41Å; K569-D573 WeakPolarHBondContact O-CB 3.38Å; K569-D573 VanDerWaalsContact O-CG 3.25Å; K569-D573 PolarHBondContact O-N 2.89Å; W570-D573 PolarHBondContact O-N 2.95Å; D573-F575 VanDerWaalsContact C-N 3.27Å; D573-F575 PolarHBondContact O-N 3.39Å; D573-G576 WeakPolarHBondContact CA-O 3.31Å; D573-G576 PolarHBondContact O-N 3.02Å
574	A	93.3	Very high	92.4	Very high	85 Å²	85	41.3 Å²	41.3	70%	0.702	21%	0.213	S	C	*	.	H	α-helix	trans	-64.4	-28.8	174.7	0	0	0	0	0	113.2	W570 V571 A572	W570-A574 PolarHBondContact O-N 3.38Å; W570-A574 VanDerWaalsContact O-N 3.09Å; V571-A574 WeakPolarHBondContact O-CB 3.45Å; V571-A574 PolarHBondContact O-N 3.03Å; A572-A574 VanDerWaalsContact C-N 3.25Å; A572-A574 PolarHBondContact O-N 3.26Å
575	F	92.6	Very high	92	Very high	100 Å²	100	41.4 Å²	41.4	44%	0.439	21%	0.213	S	C	.	.	H	α-helix	trans	-98.1	-19.2	177.2	-66.2	-77.9	0	0	0	113.8	L353 T356 R360 V571 A572 D573	L353-F575 HydrophobicContact CD2-CD2 4.47Å; L353-F575 HydrophobicContact CD2-CE2 3.62Å; L353-F575 HydrophobicContact CD2-CZ 4.06Å; T356-F575 HydrophobicContact CG2-CB 3.34Å; T356-F575 HydrophobicContact CG2-CD2 4.27Å; T356-F575 HydrophobicContact CG2-CG 3.89Å; R360-F575 PolarHBondContact NH2-O 3.01Å; V571-F575 HydrophobicContact CG1-CE2 4.29Å; V571-F575 WeakPolarHBondContact O-CD2 3.3Å; A572-F575 PolarHBondContact O-N 3.43Å; A572-F575 VanDerWaalsContact O-N 3.13Å; D573-F575 VanDerWaalsContact C-N 3.27Å; D573-F575 PolarHBondContact O-N 3.39Å
576	G	85.6	Confident	91.4	Very high	30 Å²	30	45.6 Å²	45.6	31%	0.309	23%	0.233	S	C	.	.			trans	179	135.7	177.2	0	0	0	0	0	111.1	R539 A572 D573 E578	R539-G576 PolarHBondContact NH1-O 3.13Å; R539-G576 PolarHBondContact NH2-O 3.03Å; A572-G576 PolarHBondContact O-N 3.4Å; D573-G576 WeakPolarHBondContact CA-O 3.31Å; D573-G576 PolarHBondContact O-N 3.02Å; G576-E578 VanDerWaalsContact C-N 3.32Å; G576-E578 PolarHBondContact O-N 2.88Å
577	K	79.7	Confident	90.9	Very high	177 Å²	177	45.2 Å²	45.2	77%	0.77	23%	0.229	S	C	*	.	S	Bend	trans	-76.9	-17.7	-175.4	-63.4	-175.3	177.4	-174.9	0	114.2
578	E	85.4	Confident	90.2	Very high	58 Å²	58	45.5 Å²	45.5	27%	0.271	23%	0.23	S	C	.	.			trans	-89.3	139.8	-174.1	-65.6	170.7	-157.8	0	0	111.8	R539 G576 E582 S583 Q586	R539-E578 PolarHBondContact NH2-O 3.45Å; G576-E578 VanDerWaalsContact C-N 3.32Å; G576-E578 PolarHBondContact O-N 2.88Å; E578-E582 HydrophobicContact CB-CB 4.25Å; E578-E582 HydrophobicContact CG-CB 4.41Å; E578-S583 WeakPolarHBondContact CB-OG 3.28Å; E578-S583 PolarHBondContact OE2-OG 3.49Å; E578-Q586 PolarHBondContact OE1-NE2 3.26Å; E578-Q586 PolarHBondContact OE1-OE1 3.35Å; E578-Q586 PolarHBondContact OE2-NE2 3.49Å; E578-Q586 PolarHBondContact OE2-OE1 2.84Å
579	G	91.2	Very high	89.2	Confident	2 Å²	2	46.7 Å²	46.7	2%	0.021	24%	0.243	C	C	.	.			trans	-83.1	175.5	164.3	0	0	0	0	0	111.5	Y581 E582 S583	G579-Y581 VanDerWaalsContact C-N 3.29Å; G579-Y581 PolarHBondContact O-N 3.18Å; G579-E582 VanDerWaalsContact C-OE2 3.25Å; G579-E582 WeakPolarHBondContact CA-OE2 3.49Å; G579-E582 PolarHBondContact N-OE2 3.15Å; G579-E582 VanDerWaalsContact N-OE2 3.12Å; G579-E582 PolarHBondContact O-N 2.96Å; G579-S583 PolarHBondContact O-N 3.18Å; G579-S583 PolarHBondContact O-OG 3.49Å
580	I	93.3	Very high	88.5	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-60.3	-37.2	-178.7	-172.2	62	0	0	0	113.2	F358 I359 F469 L477 V537 H584	F358-I580 HydrophobicContact CD1-CD1 4.41Å; F358-I580 HydrophobicContact CE1-CD1 3.81Å; F358-I580 HydrophobicContact CE1-CG1 4.09Å; I359-I580 HydrophobicContact CG1-CB 4.15Å; I359-I580 HydrophobicContact CG1-CD1 4.21Å; F469-I580 HydrophobicContact CD1-CD1 4.27Å; F469-I580 HydrophobicContact CD1-CG1 4.24Å; F469-I580 HydrophobicContact CE1-CD1 3.98Å; F469-I580 HydrophobicContact CE1-CG1 3.59Å; F469-I580 HydrophobicContact CZ-CG1 4.36Å; L477-I580 HydrophobicContact CD2-CB 4.19Å; L477-I580 HydrophobicContact CD2-CG1 3.7Å; L477-I580 HydrophobicContact CD2-CG2 3.8Å; V537-I580 HydrophobicContact CG1-CB 4.17Å; V537-I580 HydrophobicContact CG1-CG2 3.92Å; V537-I580 WeakPolarHBondContact O-CG2 3.42Å; V537-I580 PolarHBondContact O-N 2.73Å; V537-I580 VanDerWaalsContact O-N 3.16Å; I580-H584 PolarHBondContact O-CD2 2.8Å; I580-H584 VanDerWaalsContact O-CD2 3.28Å; I580-H584 PolarHBondContact O-N 3.15Å
581	Y	91.9	Very high	87.4	Confident	1 Å²	1	37.8 Å²	37.8	0%	0.004	21%	0.208	C	C	.	.	H	α-helix	trans	-72	-41.5	-176.6	-63.8	-54.6	0	0	0	111.2	I192 P193 F478 T538 G579 H584 I585	I192-Y581 HydrophobicContact CB-CD1 4.14Å; I192-Y581 HydrophobicContact CB-CE1 3.96Å; I192-Y581 HydrophobicContact CD1-CE1 4.11Å; I192-Y581 HydrophobicContact CD1-CE2 4.28Å; I192-Y581 WeakPolarHBondContact CD1-OH 3.39Å; I192-Y581 HydrophobicContact CG2-CD1 4.11Å; I192-Y581 HydrophobicContact CG2-CD2 4.1Å; I192-Y581 HydrophobicContact CG2-CE1 4.2Å; I192-Y581 HydrophobicContact CG2-CE2 4.2Å; I192-Y581 HydrophobicContact CG2-CG 4.05Å; P193-Y581 HydrophobicContact CG-CD1 3.81Å; F478-Y581 AromaticContact CE1-CE2 3.84Å; F478-Y581 HydrophobicContact CE1-CE2 3.84Å; F478-Y581 AromaticContact CE1-CZ 3.8Å; F478-Y581 WeakPolarHBondContact CE1-OH 3.21Å; F478-Y581 HydrophobicContact CZ-CE2 4.19Å; F478-Y581 WeakPolarHBondContact CZ-OH 3.33Å; T538-Y581 HydrophobicContact CG2-CE2 4.11Å; G579-Y581 VanDerWaalsContact C-N 3.29Å; G579-Y581 PolarHBondContact O-N 3.18Å; Y581-H584 PolarHBondContact O-N 2.94Å; Y581-I585 VanDerWaalsContact O-CG1 3.27Å; Y581-I585 WeakPolarHBondContact O-CG1 3.3Å; Y581-I585 PolarHBondContact O-N 3.4Å
582	E	89.3	Confident	86.4	Confident	9 Å²	9	38 Å²	38	4%	0.042	21%	0.206	C	C	.	.	H	α-helix	trans	-63.5	-45.7	175.6	-62.6	66.4	-136.4	0	0	110.6	K196 E578 G579 H584 I585 Q586	K196-E582 IonicContact NZ-OE1 2.77Å; K196-E582 PolarHBondContact NZ-OE1 3.25Å; E578-E582 HydrophobicContact CB-CB 4.25Å; E578-E582 HydrophobicContact CG-CB 4.41Å; G579-E582 VanDerWaalsContact C-OE2 3.25Å; G579-E582 WeakPolarHBondContact CA-OE2 3.49Å; G579-E582 PolarHBondContact N-OE2 3.15Å; G579-E582 VanDerWaalsContact N-OE2 3.12Å; G579-E582 PolarHBondContact O-N 2.96Å; E582-H584 VanDerWaalsContact C-N 3.28Å; E582-H584 PolarHBondContact O-N 3.3Å; E582-I585 WeakPolarHBondContact O-CB 3.35Å; E582-I585 PolarHBondContact O-N 2.94Å; E582-I585 VanDerWaalsContact O-N 3.12Å; E582-Q586 WeakPolarHBondContact O-CG 3.28Å; E582-Q586 PolarHBondContact O-N 3.1Å
583	S	90.3	Very high	85.4	Confident	12 Å²	12	38.1 Å²	38.1	8%	0.084	21%	0.207	C	C	.	.	H	α-helix	trans	-64.7	-32.1	177.7	-61.5	0	0	0	0	112.5	E578 G579 L587	E578-S583 WeakPolarHBondContact CB-OG 3.28Å; E578-S583 PolarHBondContact OE2-OG 3.49Å; G579-S583 PolarHBondContact O-N 3.18Å; G579-S583 PolarHBondContact O-OG 3.49Å; S583-L587 VanDerWaalsContact O-CB 3.26Å; S583-L587 WeakPolarHBondContact O-CB 3.36Å; S583-L587 PolarHBondContact O-N 3.38Å
584	H	89.3	Confident	84.5	Confident	17 Å²	17	36.6 Å²	36.6	8%	0.079	20%	0.198	C	C	.	.	H	α-helix	trans	-71.2	-36.4	171.7	-91.9	-97.7	0	0	0	112.8	P193 N362 F469 I580 Y581 E582 Q586 L587 N588	P193-H584 HydrophobicContact CG-CB 4.26Å; N362-H584 PolarHBondContact OD1-NE2 3.45Å; F469-H584 AromaticContact CD1-NE2 3.65Å; F469-H584 AromaticContact CE1-CD2 3.68Å; F469-H584 AromaticContact CE1-CE1 3.77Å; F469-H584 AromaticContact CE1-NE2 3.28Å; F469-H584 VanDerWaalsContact CE1-NE2 3.28Å; F469-H584 WeakPolarHBondContact CE1-NE2 3.37Å; I580-H584 PolarHBondContact O-CD2 2.8Å; I580-H584 VanDerWaalsContact O-CD2 3.28Å; I580-H584 PolarHBondContact O-N 3.15Å; Y581-H584 PolarHBondContact O-N 2.94Å; E582-H584 VanDerWaalsContact C-N 3.28Å; E582-H584 PolarHBondContact O-N 3.3Å; H584-Q586 VanDerWaalsContact C-N 3.33Å; H584-L587 PolarHBondContact O-N 3.24Å; H584-N588 VanDerWaalsContact O-CB 3.3Å; H584-N588 WeakPolarHBondContact O-CB 3.44Å; H584-N588 VanDerWaalsContact O-CG 3.31Å; H584-N588 PolarHBondContact O-N 3.25Å; H584-N588 PolarHBondContact O-ND2 2.83Å
585	I	88.1	Confident	83.2	Confident	2 Å²	2	36.1 Å²	36.1	1%	0.01	18%	0.183	C	C	.	.	H	α-helix	trans	-58.8	-47.3	172.2	-71.8	171.4	0	0	0	110	P193 K196 T197 Y581 E582 N588 G589 Y590 Y592	P193-I585 HydrophobicContact CB-CD1 4.5Å; P193-I585 HydrophobicContact CB-CG1 3.76Å; K196-I585 HydrophobicContact CB-CD1 4.18Å; K196-I585 HydrophobicContact CD-CD1 3.83Å; K196-I585 HydrophobicContact CG-CD1 4.33Å; T197-I585 HydrophobicContact CG2-CD1 4.12Å; T197-I585 HydrophobicContact CG2-CG1 4.05Å; T197-I585 HydrophobicContact CG2-CG2 4.01Å; Y581-I585 VanDerWaalsContact O-CG1 3.27Å; Y581-I585 WeakPolarHBondContact O-CG1 3.3Å; Y581-I585 PolarHBondContact O-N 3.4Å; E582-I585 WeakPolarHBondContact O-CB 3.35Å; E582-I585 PolarHBondContact O-N 2.94Å; E582-I585 VanDerWaalsContact O-N 3.12Å; I585-N588 CarbonylContact O-C 3.52Å; I585-N588 PolarHBondContact O-N 3.33Å; I585-G589 PolarHBondContact O-N 3.47Å; I585-G589 VanDerWaalsContact O-N 3.11Å; I585-Y590 PolarHBondContact O-N 3.01Å; I585-Y592 HydrophobicContact CD1-CD1 4.25Å; I585-Y592 HydrophobicContact CD1-CG 4.23Å; I585-Y592 HydrophobicContact CG2-CD1 4.22Å; I585-Y592 HydrophobicContact CG2-CG 3.94Å
586	Q	84.4	Confident	81.8	Confident	89 Å²	89	36.3 Å²	36.3	42%	0.416	18%	0.181	S	C	.	.	H	α-helix	trans	-66.9	-42.5	177.4	-68	-174.7	10.7	0	0	112.5	E578 E582 H584 N588 G589	E578-Q586 PolarHBondContact OE1-NE2 3.26Å; E578-Q586 PolarHBondContact OE1-OE1 3.35Å; E578-Q586 PolarHBondContact OE2-NE2 3.49Å; E578-Q586 PolarHBondContact OE2-OE1 2.84Å; E582-Q586 WeakPolarHBondContact O-CG 3.28Å; E582-Q586 PolarHBondContact O-N 3.1Å; H584-Q586 VanDerWaalsContact C-N 3.33Å; Q586-N588 PolarHBondContact O-N 2.82Å; Q586-G589 PolarHBondContact O-N 2.66Å
587	L	85.4	Confident	80.9	Confident	31 Å²	31	37.9 Å²	37.9	16%	0.162	18%	0.182	C	C	.	.	H	α-helix	trans	-61.4	-32.7	175.9	-178.3	66.9	0	0	0	111.8	I363 C366 R367 K370 S583 H584 G589	I363-L587 HydrophobicContact CD1-CB 4.44Å; I363-L587 HydrophobicContact CD1-CD2 4.18Å; C366-L587 HydrophobicContact CB-CD2 3.39Å; R367-L587 HydrophobicContact CB-CD1 4.09Å; K370-L587 PolarHBondContact NZ-O 2.88Å; S583-L587 VanDerWaalsContact O-CB 3.26Å; S583-L587 WeakPolarHBondContact O-CB 3.36Å; S583-L587 PolarHBondContact O-N 3.38Å; H584-L587 PolarHBondContact O-N 3.24Å; L587-G589 VanDerWaalsContact C-N 3.3Å
588	N	82.2	Confident	80.2	Confident	29 Å²	29	37.7 Å²	37.7	16%	0.155	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	4	173.5	-69	-20.6	0	0	0	113.2	V33 K370 H584 I585 Q586 Y590	V33-N588 WeakPolarHBondContact CG1-O 3.4Å; K370-N588 PolarHBondContact NZ-OD1 2.89Å; H584-N588 VanDerWaalsContact O-CB 3.3Å; H584-N588 WeakPolarHBondContact O-CB 3.44Å; H584-N588 VanDerWaalsContact O-CG 3.31Å; H584-N588 PolarHBondContact O-N 3.25Å; H584-N588 PolarHBondContact O-ND2 2.83Å; I585-N588 CarbonylContact O-C 3.52Å; I585-N588 PolarHBondContact O-N 3.33Å; Q586-N588 PolarHBondContact O-N 2.82Å; N588-Y590 HydrophobicContact CB-CD2 3.78Å; N588-Y590 HydrophobicContact CB-CE1 4.42Å; N588-Y590 HydrophobicContact CB-CE2 3.61Å; N588-Y590 HydrophobicContact CB-CG 4.26Å; N588-Y590 PolarHBondContact O-N 2.97Å; N588-Y590 VanDerWaalsContact O-N 3.09Å
589	G	75.8	Confident	79.3	Confident	26 Å²	26	35.6 Å²	35.6	27%	0.268	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.4	17.8	176.8	0	0	0	0	0	114.2	Y36 I585 Q586 L587	Y36-G589 WeakPolarHBondContact CE2-O 3.32Å; I585-G589 PolarHBondContact O-N 3.47Å; I585-G589 VanDerWaalsContact O-N 3.11Å; Q586-G589 PolarHBondContact O-N 2.66Å; L587-G589 VanDerWaalsContact C-N 3.3Å
590	Y	79.4	Confident	78.2	Confident	41 Å²	41	40.7 Å²	40.7	16%	0.161	21%	0.205	C	C	.	.			trans	-68.9	135.5	-177.5	-68.5	-40.5	0	0	0	110.4	V33 F39 E194 T197 I585 N588 Y592	V33-Y590 HydrophobicContact CG1-CE1 4.18Å; F39-Y590 HydrophobicContact CZ-CD1 4.25Å; F39-Y590 HydrophobicContact CZ-CE1 4.23Å; E194-Y590 HydrophobicContact CG-CE2 3.96Å; T197-Y590 HydrophobicContact CG2-CD2 3.85Å; T197-Y590 HydrophobicContact CG2-CG 3.98Å; I585-Y590 PolarHBondContact O-N 3.01Å; N588-Y590 HydrophobicContact CB-CD2 3.78Å; N588-Y590 HydrophobicContact CB-CE1 4.42Å; N588-Y590 HydrophobicContact CB-CE2 3.61Å; N588-Y590 HydrophobicContact CB-CG 4.26Å; N588-Y590 PolarHBondContact O-N 2.97Å; N588-Y590 VanDerWaalsContact O-N 3.09Å; Y590-Y592 PolarHBondContact O-N 2.68Å
591	P	72.9	Confident	77.3	Confident	3 Å²	3	44.2 Å²	44.2	2%	0.019	22%	0.221	C	C	.	.			trans	-64.3	104.1	171.6	21.5	-27.8	0	0	0	108.8	Y36 F202 L752	Y36-P591 HydrophobicContact CD1-CG 4.46Å; Y36-P591 HydrophobicContact CE1-CB 3.53Å; Y36-P591 HydrophobicContact CE1-CG 3.74Å; Y36-P591 HydrophobicContact CE2-CG 4.4Å; Y36-P591 VanDerWaalsContact CZ-CB 3.48Å; Y36-P591 WeakPolarHBondContact OH-CA 3.44Å; Y36-P591 WeakPolarHBondContact OH-CB 3.46Å; F202-P591 HydrophobicContact CD1-CB 4.2Å; F202-P591 HydrophobicContact CD1-CG 3.57Å; F202-P591 HydrophobicContact CD2-CB 4.42Å; F202-P591 HydrophobicContact CD2-CG 4.18Å; F202-P591 WeakPolarHBondContact CD2-O 3.32Å; F202-P591 HydrophobicContact CE1-CB 3.57Å; F202-P591 HydrophobicContact CE1-CG 3.44Å; F202-P591 VanDerWaalsContact CE1-CG 3.44Å; F202-P591 HydrophobicContact CE2-CB 3.85Å; F202-P591 HydrophobicContact CE2-CG 4.09Å; F202-P591 WeakPolarHBondContact CE2-O 3.49Å; F202-P591 HydrophobicContact CG-CG 3.94Å; F202-P591 HydrophobicContact CZ-CB 3.39Å; F202-P591 HydrophobicContact CZ-CG 3.74Å; F202-P591 WeakPolarHBondContact CZ-O 3.5Å; P591-L752 HydrophobicContact CB-CD1 3.57Å
592	Y	76.5	Confident	76.7	Confident	35 Å²	35	55.7 Å²	55.7	14%	0.137	27%	0.265	C	S	.	.			trans	-134	125.4	176.8	-178.7	-107.8	0	0	0	108.8	K196 I585 Y590 D594	K196-Y592 HydrophobicContact CD-CE1 4.44Å; K196-Y592 HydrophobicContact CD-CE2 4.24Å; K196-Y592 WeakPolarHBondContact CE-OH 3.32Å; K196-Y592 HydrophobicContact CG-CE2 3.89Å; K196-Y592 PolarHBondContact NZ-OH 3.33Å; I585-Y592 HydrophobicContact CD1-CD1 4.25Å; I585-Y592 HydrophobicContact CD1-CG 4.23Å; I585-Y592 HydrophobicContact CG2-CD1 4.22Å; I585-Y592 HydrophobicContact CG2-CG 3.94Å; Y590-Y592 PolarHBondContact O-N 2.68Å; Y592-D594 HydrophobicContact CD1-CB 4.32Å; Y592-D594 HydrophobicContact CE1-CB 3.69Å
593	L	74.7	Confident	76.6	Confident	3 Å²	3	56.5 Å²	56.5	2%	0.016	27%	0.27	C	S	.	.			trans	-104	102.9	175.3	-171.5	64.6	0	0	0	106.4	V723 F726 R727 L752 M755	L593-V723 HydrophobicContact CD1-CG1 4.4Å; L593-V723 HydrophobicContact CD2-CG1 4.48Å; L593-F726 HydrophobicContact CD2-CB 4.2Å; L593-R727 HydrophobicContact CD2-CG 3.48Å; L593-R727 VanDerWaalsContact CD2-CG 3.48Å; L593-R727 HydrophobicContact CG-CG 3.78Å; L593-L752 HydrophobicContact CB-CD2 4.19Å; L593-L752 HydrophobicContact CD1-CD2 4.02Å; L593-M755 HydrophobicContact CD1-CE 4.03Å; L593-M755 HydrophobicContact CD1-SD 3.4Å; L593-M755 WeakPolarHBondContact CD1-SD 3.48Å
594	D	72.5	Confident	76.7	Confident	19 Å²	19	58.5 Å²	58.5	10%	0.102	28%	0.28	C	S	.	.			trans	-67.3	142	177.5	-156	-32.6	0	0	0	109.7	Y592 R596 R727	Y592-D594 HydrophobicContact CD1-CB 4.32Å; Y592-D594 HydrophobicContact CE1-CB 3.69Å; D594-R596 VanDerWaalsContact C-N 3.34Å; D594-R596 PolarHBondContact OD1-N 2.92Å; D594-R727 PolarHBondContact O-NE 2.74Å; D594-R727 PolarHBondContact O-NH2 3.04Å
595	I	66.3	Low	76.7	Confident	75 Å²	75	57.7 Å²	57.7	39%	0.385	28%	0.276	S	S	.	.	S	Bend	trans	-73.8	-33	173.5	-61.5	165.4	0	0	0	110.3	Y293 D597	Y293-I595 HydrophobicContact CD1-CD1 4.43Å; Y293-I595 HydrophobicContact CD2-CD1 3.41Å; Y293-I595 VanDerWaalsContact CD2-CD1 3.41Å; Y293-I595 HydrophobicContact CD2-CG1 3.4Å; Y293-I595 VanDerWaalsContact CD2-CG1 3.4Å; Y293-I595 HydrophobicContact CE1-CD1 4.39Å; Y293-I595 HydrophobicContact CE2-CB 4.44Å; Y293-I595 HydrophobicContact CE2-CD1 3.5Å; Y293-I595 VanDerWaalsContact CE2-CD1 3.5Å; Y293-I595 HydrophobicContact CE2-CG1 3.05Å; Y293-I595 HydrophobicContact CG-CD1 3.83Å; Y293-I595 HydrophobicContact CG-CG1 4.3Å; Y293-I595 WeakPolarHBondContact O-CD1 3.34Å; I595-D597 VanDerWaalsContact C-N 3.28Å; I595-D597 PolarHBondContact O-N 3.04Å
596	R	64.4	Low	76.8	Confident	104 Å²	104	59.8 Å²	59.8	39%	0.392	29%	0.289	S	S	.	.	S	Bend	trans	-74.1	-18.8	-171.1	-61.3	177.2	-178.9	-177.9	2.1	112.9	E289 E290 D594 E598	E289-R596 PolarHBondContact O-NH2 3.04Å; E290-R596 IonicContact OE1-CZ 3.82Å; E290-R596 IonicContact OE1-NH1 2.87Å; E290-R596 PolarHBondContact OE1-NH1 3.35Å; E290-R596 IonicContact OE1-NH2 3.81Å; E290-R596 PolarHBondContact OE1-NH2 2.72Å; E290-R596 IonicContact OE2-NH2 2.73Å; D594-R596 VanDerWaalsContact C-N 3.34Å; D594-R596 PolarHBondContact OD1-N 2.92Å; R596-E598 PolarHBondContact O-N 3.47Å
597	D	66.7	Low	77	Confident	63 Å²	63	59.4 Å²	59.4	34%	0.337	29%	0.29	S	S	.	.			trans	-78.3	112.4	-177.8	-71.3	-25.5	0	0	0	112	I595 F599 R727	I595-D597 VanDerWaalsContact C-N 3.28Å; I595-D597 PolarHBondContact O-N 3.04Å; D597-F599 PolarHBondContact O-N 2.91Å; D597-R727 PolarHBondContact O-NH1 3.22Å; D597-R727 PolarHBondContact O-NH2 3.38Å
598	E	64.9	Low	77.2	Confident	173 Å²	173	58.1 Å²	58.1	81%	0.808	28%	0.283	S	S	*	.			trans	-73.8	126.8	170.9	-69.9	178.5	176.5	0	0	110.8	R596 T600	R596-E598 PolarHBondContact O-N 3.47Å; E598-T600 PolarHBondContact O-N 3.43Å
599	F	67	Low	77.6	Confident	13 Å²	13	58 Å²	58	6%	0.057	28%	0.282	C	S	.	.			trans	-82.9	102.7	174.7	-169.9	-94.3	0	0	0	109.2	D597 H601 T603 M719 E720 V723 H754 M755	D597-F599 PolarHBondContact O-N 2.91Å; F599-H601 HydrophobicContact CD1-CB 4.39Å; F599-H601 WeakPolarHBondContact CD1-O 3.13Å; F599-H601 HydrophobicContact CE1-CB 3.69Å; F599-H601 WeakPolarHBondContact CE1-O 3.39Å; F599-H601 HydrophobicContact CZ-CB 3.76Å; F599-T603 WeakPolarHBondContact CZ-OG1 3.43Å; F599-M719 HydrophobicContact CD1-CB 4.2Å; F599-M719 HydrophobicContact CE1-CB 3.5Å; F599-M719 HydrophobicContact CZ-CB 3.87Å; F599-E720 HydrophobicContact CB-CB 4.41Å; F599-E720 HydrophobicContact CB-CG 4.46Å; F599-E720 HydrophobicContact CD1-CB 4.15Å; F599-V723 HydrophobicContact CD2-CG2 4.26Å; F599-V723 HydrophobicContact CG-CG2 4.4Å; F599-H754 AromaticContact CZ-CD2 3.98Å; F599-H754 AromaticContact CZ-NE2 4Å; F599-M755 HydrophobicContact CD2-CG 4.25Å; F599-M755 HydrophobicContact CE2-CG 4.1Å
600	T	67.1	Low	78.3	Confident	110 Å²	110	59.8 Å²	59.8	68%	0.675	28%	0.281	S	S	*	.			trans	-90.4	-4.6	-173	53.4	0	0	0	0	114.2	E598	E598-T600 PolarHBondContact O-N 3.43Å
601	H	74.3	Confident	78.7	Confident	73 Å²	73	59.3 Å²	59.3	34%	0.338	28%	0.282	S	S	.	.			trans	-89.1	148.1	-173.7	-58.6	-71.6	0	0	0	113	F599 T603 M758	F599-H601 HydrophobicContact CD1-CB 4.39Å; F599-H601 WeakPolarHBondContact CD1-O 3.13Å; F599-H601 HydrophobicContact CE1-CB 3.69Å; F599-H601 WeakPolarHBondContact CE1-O 3.39Å; F599-H601 HydrophobicContact CZ-CB 3.76Å; H601-T603 VanDerWaalsContact C-N 3.32Å; H601-T603 PolarHBondContact O-N 3.01Å; H601-M758 HydrophobicContact CB-CE 4.02Å; H601-M758 VanDerWaalsContact CE1-CE 3.47Å; H601-M758 WeakPolarHBondContact CE1-CE 3.47Å; H601-M758 VanDerWaalsContact CG-CE 3.44Å; H601-M758 WeakPolarHBondContact ND1-CE 3.12Å
602	R	78.8	Confident	79.2	Confident	243 Å²	243	64 Å²	64	92%	0.917	30%	0.3	S	S	*	.			trans	-89.2	19.1	-176.5	-64	-174.9	177.4	-175.9	-0.7	114.8
603	T	87.6	Confident	79.2	Confident	25 Å²	25	74.3 Å²	74.3	15%	0.153	34%	0.339	C	S	.	.			trans	-68.9	151.2	-179.2	52.7	0	0	0	0	111.4	F599 H601 M719 H754	F599-T603 WeakPolarHBondContact CZ-OG1 3.43Å; H601-T603 VanDerWaalsContact C-N 3.32Å; H601-T603 PolarHBondContact O-N 3.01Å; T603-M719 VanDerWaalsContact O-CB 3.3Å; T603-M719 WeakPolarHBondContact O-CB 3.48Å; T603-M719 WeakPolarHBondContact O-CG 3.47Å; T603-M719 PolarHBondContact O-N 3.12Å; T603-M719 WeakPolarHBondContact OG1-CB 3.28Å; T603-M719 WeakPolarHBondContact OG1-CG 3.49Å; T603-H754 PolarHBondContact OG1-NE2 3.48Å
604	L	91.6	Very high	79.4	Confident	54 Å²	54	81.8 Å²	81.8	28%	0.283	38%	0.378	S	S	.	.	B	Isolated β-bridge	trans	-104.1	163.3	-178.8	-60.8	176.5	0	0	0	111.5	T606 D607 M719	L604-T606 PolarHBondContact O-N 3.44Å; L604-T606 VanDerWaalsContact O-N 3.16Å; L604-D607 PolarHBondContact N-OD2 3.46Å; L604-D607 WeakPolarHBondContact O-CB 3.34Å; L604-D607 PolarHBondContact O-N 3.2Å; L604-M719 WeakPolarHBondContact O-CG 3.35Å
605	A	90.8	Very high	79.8	Confident	0 Å²	0	83.4 Å²	83.4	0%	0	39%	0.387	C	S	.	.	H	α-helix	trans	-53.4	-34.4	174.7	0	0	0	0	0	112.7	D607 V608 M609 V713 T717 V722 I746	A605-D607 VanDerWaalsContact C-N 3.29Å; A605-D607 PolarHBondContact O-N 2.99Å; A605-V608 PolarHBondContact O-N 2.88Å; A605-M609 WeakPolarHBondContact O-CB 3.28Å; A605-M609 PolarHBondContact O-N 3.15Å; A605-V713 HydrophobicContact CB-CG2 4.33Å; A605-T717 PolarHBondContact N-O 3.47Å; A605-V722 HydrophobicContact CB-CG2 4.12Å; A605-I746 HydrophobicContact CB-CD1 3.92Å
606	T	90.3	Very high	80.6	Confident	47 Å²	47	84.3 Å²	84.3	29%	0.288	40%	0.398	S	S	.	.	H	α-helix	trans	-62.7	-28.7	176.6	27.8	0	0	0	0	114.9	L604 V608 M609 D715	L604-T606 PolarHBondContact O-N 3.44Å; L604-T606 VanDerWaalsContact O-N 3.16Å; T606-V608 VanDerWaalsContact C-N 3.31Å; T606-M609 HydrophobicContact CG2-CE 3.86Å; T606-M609 HydrophobicContact CG2-SD 4.23Å; T606-D715 HydrophobicContact CG2-CB 3.45Å; T606-D715 VanDerWaalsContact CG2-CB 3.45Å; T606-D715 VanDerWaalsContact CG2-O 3.32Å; T606-D715 WeakPolarHBondContact CG2-O 3.37Å; T606-D715 PolarHBondContact N-O 2.92Å; T606-D715 PolarHBondContact OG1-O 3.46Å
607	D	87.9	Confident	81.6	Confident	81 Å²	81	85 Å²	85	43%	0.433	42%	0.416	S	S	.	.	H	α-helix	trans	-77.1	-24.3	-178.6	-57	-37.6	0	0	0	111.8	L604 A605 R612	L604-D607 PolarHBondContact N-OD2 3.46Å; L604-D607 WeakPolarHBondContact O-CB 3.34Å; L604-D607 PolarHBondContact O-N 3.2Å; A605-D607 VanDerWaalsContact C-N 3.29Å; A605-D607 PolarHBondContact O-N 2.99Å; D607-R612 PolarHBondContact O-NH2 3.03Å
608	V	88.6	Confident	82.6	Confident	4 Å²	4	84.3 Å²	84.3	2%	0.024	41%	0.412	C	S	.	.	H	α-helix	trans	-105.2	-30.1	-172.9	-176.2	0	0	0	0	112.4	A605 T606 M719 I746 D750 H754	A605-V608 PolarHBondContact O-N 2.88Å; T606-V608 VanDerWaalsContact C-N 3.31Å; V608-M719 HydrophobicContact CB-CE 4.13Å; V608-M719 HydrophobicContact CB-SD 3.87Å; V608-M719 HydrophobicContact CG1-CE 4.09Å; V608-M719 HydrophobicContact CG1-SD 4.46Å; V608-M719 HydrophobicContact CG2-CE 3.81Å; V608-M719 HydrophobicContact CG2-CG 3.83Å; V608-M719 HydrophobicContact CG2-SD 3.57Å; V608-M719 VanDerWaalsContact CG2-SD 3.57Å; V608-I746 HydrophobicContact CG1-CG2 4.48Å; V608-D750 HydrophobicContact CG1-CB 4.06Å; V608-H754 HydrophobicContact CG1-CB 4.05Å; V608-H754 HydrophobicContact CG2-CB 4.04Å; V608-H754 VanDerWaalsContact CG2-CG 3.48Å
609	M	91.3	Very high	83.8	Confident	26 Å²	26	77 Å²	77	13%	0.128	38%	0.381	C	S	.	.			trans	-58.7	150.8	-177.3	74.3	-179.6	-174.3	0	0	113.4	A605 T606 V736 L743 I746	A605-M609 WeakPolarHBondContact O-CB 3.28Å; A605-M609 PolarHBondContact O-N 3.15Å; T606-M609 HydrophobicContact CG2-CE 3.86Å; T606-M609 HydrophobicContact CG2-SD 4.23Å; M609-V736 HydrophobicContact CB-CB 4.43Å; M609-V736 HydrophobicContact CB-CG2 3.8Å; M609-V736 HydrophobicContact SD-CB 3.76Å; M609-V736 HydrophobicContact SD-CG1 3.63Å; M609-V736 HydrophobicContact SD-CG2 4.12Å; M609-L743 HydrophobicContact CE-CB 4.03Å; M609-L743 HydrophobicContact SD-CB 4.04Å; M609-I746 HydrophobicContact CB-CD1 4.29Å; M609-I746 HydrophobicContact CB-CG1 3.75Å
610	R	89.8	Confident	85	Confident	64 Å²	64	77.5 Å²	77.5	24%	0.242	39%	0.385	C	S	.	.	B	Isolated β-bridge	trans	-110.9	144.4	171.3	-66.3	-69	-174.4	162.3	3.7	110.1	D615 G744 I745	R610-D615 WeakPolarHBondContact CD-OD2 3.38Å; R610-D615 IonicContact CZ-OD2 2.65Å; R610-D615 IonicContact NE-OD2 2.77Å; R610-D615 VanDerWaalsContact NH1-CG 3.29Å; R610-D615 IonicContact NH1-OD1 3.83Å; R610-D615 PolarHBondContact NH1-OD1 3.02Å; R610-D615 IonicContact NH1-OD2 3.49Å; R610-D615 PolarHBondContact NH1-OD2 3.2Å; R610-G744 CarbonylContact O-C 3.42Å; R610-G744 WeakPolarHBondContact O-CA 3.44Å; R610-I745 PolarHBondContact N-O 2.99Å; R610-I745 PolarHBondContact O-N 2.92Å
611	P	88.3	Confident	86.3	Confident	30 Å²	30	72.4 Å²	72.4	20%	0.195	35%	0.354	C	S	.	.	S	Bend	cis	-76.5	148.6	-0.5	32.2	-36.3	0	0	0	112.7	D615 P616 L618	P611-D615 HydrophobicContact CB-CB 3.71Å; P611-P616 WeakPolarHBondContact CB-O 3.04Å; P611-L618 HydrophobicContact CG-CB 4.28Å
612	R	83.3	Confident	87.1	Confident	103 Å²	103	69 Å²	69	39%	0.389	34%	0.338	S	S	.	.			trans	-76.4	167.7	164.8	-67.9	-177	169.9	-174.9	-4.2	109.7	D607 N614 D615	D607-R612 PolarHBondContact O-NH2 3.03Å; R612-N614 PolarHBondContact O-N 3.09Å; R612-D615 WeakPolarHBondContact CB-OD2 3.31Å; R612-D615 PolarHBondContact N-OD2 2.78Å; R612-D615 PolarHBondContact O-N 2.64Å
613	R	77.6	Confident	87.5	Confident	251 Å²	251	59.5 Å²	59.5	95%	0.947	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.4	-25.4	179.9	-73.4	-175.8	176.5	-179.4	-0.6	114.8
614	N	77.9	Confident	87.5	Confident	159 Å²	159	62.1 Å²	62.1	85%	0.85	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	-3.3	-178.7	-61.4	-1.6	0	0	0	113.5	R612	R612-N614 PolarHBondContact O-N 3.09Å
615	D	82.3	Confident	87.2	Confident	54 Å²	54	63 Å²	63	29%	0.289	33%	0.328	S	S	.	.	S	Bend	trans	-85.3	157	177.9	-66.7	-23.6	0	0	0	110.2	R610 P611 R612	R610-D615 WeakPolarHBondContact CD-OD2 3.38Å; R610-D615 IonicContact CZ-OD2 2.65Å; R610-D615 IonicContact NE-OD2 2.77Å; R610-D615 VanDerWaalsContact NH1-CG 3.29Å; R610-D615 IonicContact NH1-OD1 3.83Å; R610-D615 PolarHBondContact NH1-OD1 3.02Å; R610-D615 IonicContact NH1-OD2 3.49Å; R610-D615 PolarHBondContact NH1-OD2 3.2Å; P611-D615 HydrophobicContact CB-CB 3.71Å; R612-D615 WeakPolarHBondContact CB-OD2 3.31Å; R612-D615 PolarHBondContact N-OD2 2.78Å; R612-D615 PolarHBondContact O-N 2.64Å
616	P	82.9	Confident	87.1	Confident	94 Å²	94	63.3 Å²	63.3	61%	0.61	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-57.5	149.5	170.9	25.1	-34.8	0	0	0	111.3	P611	P611-P616 WeakPolarHBondContact CB-O 3.04Å
617	P	84.6	Confident	87.1	Confident	119 Å²	119	62.6 Å²	62.6	77%	0.773	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-59.1	151.6	180	26.1	-34.6	0	0	0	111.4	A619	P617-A619 PolarHBondContact O-N 3.34Å
618	L	88	Confident	87.2	Confident	47 Å²	47	58.7 Å²	58.7	25%	0.246	31%	0.305	C	S	.	.	P	Polyproline II helix	trans	-61.3	130.9	-178.9	-167.8	64.5	0	0	0	110.3	P611 V620 P644 L742 I745	P611-L618 HydrophobicContact CG-CB 4.28Å; L618-V620 HydrophobicContact CB-CG1 4.23Å; L618-V620 HydrophobicContact CD2-CG1 4.24Å; L618-V620 HydrophobicContact CG-CG1 4.2Å; L618-V620 WeakPolarHBondContact O-CG1 3.21Å; L618-V620 PolarHBondContact O-N 3.35Å; L618-V620 VanDerWaalsContact O-N 3.12Å; L618-P644 HydrophobicContact CD2-CG 3.93Å; L618-P644 HydrophobicContact CG-CG 4.46Å; L618-L742 HydrophobicContact CD2-CD2 3.82Å; L618-L742 HydrophobicContact CD2-CG 4.25Å; L618-I745 HydrophobicContact CD1-CG2 3.75Å
619	A	90.4	Very high	87.3	Confident	20 Å²	20	63.6 Å²	63.6	17%	0.165	33%	0.327	C	S	.	.			trans	-66.3	109	171.2	0	0	0	0	0	110.1	P617 L634 Y640 F643 P644	P617-A619 PolarHBondContact O-N 3.34Å; A619-L634 HydrophobicContact CB-CD1 4.02Å; A619-Y640 HydrophobicContact CB-CD2 4.09Å; A619-Y640 HydrophobicContact CB-CE2 4.06Å; A619-F643 HydrophobicContact CB-CD1 4.11Å; A619-F643 HydrophobicContact CB-CE1 4.24Å; A619-P644 WeakPolarHBondContact O-CD 3.3Å
620	V	92.3	Very high	87.3	Confident	24 Å²	24	65.9 Å²	65.9	15%	0.145	34%	0.34	C	S	.	.			trans	-121.5	150.2	-179.2	-53.3	0	0	0	0	111.5	L618 P644 V646 L742	L618-V620 HydrophobicContact CB-CG1 4.23Å; L618-V620 HydrophobicContact CD2-CG1 4.24Å; L618-V620 HydrophobicContact CG-CG1 4.2Å; L618-V620 WeakPolarHBondContact O-CG1 3.21Å; L618-V620 PolarHBondContact O-N 3.35Å; L618-V620 VanDerWaalsContact O-N 3.12Å; V620-P644 HydrophobicContact CB-CG 4.4Å; V620-P644 HydrophobicContact CG1-CG 3.85Å; V620-V646 HydrophobicContact CB-CG2 4.18Å; V620-V646 HydrophobicContact CG2-CG2 3.88Å; V620-L742 HydrophobicContact CG1-CD2 4.11Å
621	L	93	Very high	87.4	Confident	3 Å²	3	62.9 Å²	62.9	2%	0.016	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	143.1	170.4	-66.2	175.5	0	0	0	109.8	T626 V631 L634 F643 P644 V645 V646 V658 L663 F685	L621-T626 HydrophobicContact CD2-CG2 4.3Å; L621-V631 HydrophobicContact CD2-CG2 3.9Å; L621-L634 HydrophobicContact CD2-CD2 3.69Å; L621-L634 HydrophobicContact CG-CD2 4.32Å; L621-F643 HydrophobicContact CD1-CB 4.01Å; L621-F643 HydrophobicContact CD1-CD2 4.5Å; L621-F643 HydrophobicContact CD1-CG 4.46Å; L621-F643 HydrophobicContact CG-CB 4.08Å; L621-P644 PolarHBondContact N-O 2.94Å; L621-V645 HydrophobicContact CB-CG2 4.26Å; L621-V645 CarbonylContact O-C 3.56Å; L621-V645 VanDerWaalsContact O-CA 3.28Å; L621-V645 WeakPolarHBondContact O-CA 3.48Å; L621-V646 PolarHBondContact O-N 3.23Å; L621-V658 HydrophobicContact CD1-CG1 3.77Å; L621-L663 HydrophobicContact CD1-CD1 3.69Å; L621-F685 HydrophobicContact CB-CE2 4.39Å; L621-F685 HydrophobicContact CD1-CZ 4.26Å
622	T	92.2	Very high	87.5	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	160.4	176.4	62	0	0	0	0	111.5	D624 S625 T626 V646 R649 F685	T622-D624 PolarHBondContact O-N 2.89Å; T622-S625 VanDerWaalsContact CB-OG 3.23Å; T622-S625 WeakPolarHBondContact CB-OG 3.31Å; T622-S625 WeakPolarHBondContact CG2-OG 3.43Å; T622-S625 PolarHBondContact OG1-N 3.14Å; T622-S625 PolarHBondContact OG1-OG 3.39Å; T622-T626 HydrophobicContact CG2-CG2 4.49Å; T622-T626 PolarHBondContact O-OG1 2.93Å; T622-T626 WeakPolarHBondContact OG1-CG2 3.38Å; T622-T626 PolarHBondContact OG1-N 3.4Å; T622-T626 VanDerWaalsContact OG1-N 3.08Å; T622-T626 PolarHBondContact OG1-OG1 2.77Å; T622-V646 CarbonylContact C-O 3.44Å; T622-V646 WeakPolarHBondContact CA-O 3.46Å; T622-R649 HydrophobicContact CG2-CG 3.85Å; T622-F685 WeakPolarHBondContact O-CD2 3.42Å
623	Q	87.8	Confident	88	Confident	44 Å²	44	61.4 Å²	61.4	21%	0.206	33%	0.328	C	S	.	.	S	Bend	trans	-64.2	-38	-179.1	-173.8	172.5	-0	0	0	113.7	V646 I655 Y684 F685 T686	Q623-V646 PolarHBondContact N-O 2.99Å; Q623-I655 HydrophobicContact CB-CD1 3.63Å; Q623-I655 HydrophobicContact CG-CD1 3.68Å; Q623-Y684 WeakPolarHBondContact O-CA 3.24Å; Q623-F685 PolarHBondContact O-N 2.89Å; Q623-T686 HydrophobicContact CG-CG2 3.86Å
624	D	85.9	Confident	88.6	Confident	80 Å²	80	51.1 Å²	51.1	43%	0.428	29%	0.291	S	S	.	.	S	Bend	trans	-149	-0.5	-165	59	-13.3	0	0	0	115.1	T622 V682 Y684	T622-D624 PolarHBondContact O-N 2.89Å; D624-V682 WeakPolarHBondContact O-CG1 3.2Å; D624-Y684 HydrophobicContact CB-CD1 3.77Å; D624-Y684 HydrophobicContact CB-CE1 3.64Å
625	S	85.6	Confident	89.2	Confident	74 Å²	74	44.5 Å²	44.5	52%	0.517	26%	0.256	S	S	.	.	S	Bend	trans	-107.6	-12.9	-176	74.3	0	0	0	0	115.5	T622	T622-S625 VanDerWaalsContact CB-OG 3.23Å; T622-S625 WeakPolarHBondContact CB-OG 3.31Å; T622-S625 WeakPolarHBondContact CG2-OG 3.43Å; T622-S625 PolarHBondContact OG1-N 3.14Å; T622-S625 PolarHBondContact OG1-OG 3.39Å
626	T	88.9	Confident	89.6	Confident	6 Å²	6	49.5 Å²	49.5	4%	0.037	28%	0.275	C	S	.	.			trans	-84	130.9	-176.6	37	0	0	0	0	111.8	L621 T622 V683	L621-T626 HydrophobicContact CD2-CG2 4.3Å; T622-T626 HydrophobicContact CG2-CG2 4.49Å; T622-T626 PolarHBondContact O-OG1 2.93Å; T622-T626 WeakPolarHBondContact OG1-CG2 3.38Å; T622-T626 PolarHBondContact OG1-N 3.4Å; T622-T626 VanDerWaalsContact OG1-N 3.08Å; T622-T626 PolarHBondContact OG1-OG1 2.77Å; T626-V683 WeakPolarHBondContact O-CB 3.47Å; T626-V683 PolarHBondContact O-N 3.45Å
627	T	91.3	Very high	90	Very high	31 Å²	31	51.4 Å²	51.4	19%	0.19	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	-83.2	164.1	173.4	67.6	0	0	0	0	112	E629 D630 V631 S681	T627-E629 PolarHBondContact O-N 3.35Å; T627-D630 WeakPolarHBondContact CB-OD2 3.29Å; T627-D630 PolarHBondContact N-OD2 2.92Å; T627-D630 PolarHBondContact O-N 3.26Å; T627-D630 PolarHBondContact OG1-N 3.45Å; T627-D630 PolarHBondContact OG1-OD2 3.36Å; T627-V631 VanDerWaalsContact O-CG2 3.29Å; T627-V631 WeakPolarHBondContact O-CG2 3.46Å; T627-V631 PolarHBondContact O-N 2.86Å; T627-V631 VanDerWaalsContact O-N 3.15Å; T627-S681 CarbonylContact C-O 2.8Å; T627-S681 WeakPolarHBondContact CA-O 3.34Å
628	V	89.8	Confident	90.2	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-60.7	-36.9	174	172.3	0	0	0	0	111	V631 E632 I667 S679 S681 V683 L700	V628-V631 PolarHBondContact O-N 3.03Å; V628-E632 HydrophobicContact CG1-CG 4.39Å; V628-E632 WeakPolarHBondContact O-CG 3.44Å; V628-E632 PolarHBondContact O-N 3.29Å; V628-I667 HydrophobicContact CG1-CG2 3.89Å; V628-S679 PolarHBondContact N-O 3.25Å; V628-S681 WeakPolarHBondContact CG2-O 3.49Å; V628-S681 PolarHBondContact N-O 2.82Å; V628-V683 HydrophobicContact CG2-CG2 3.79Å; V628-L700 HydrophobicContact CG2-CB 4.45Å; V628-L700 HydrophobicContact CG2-CD2 3.87Å
629	E	90.5	Very high	90	Very high	107 Å²	107	50.6 Å²	50.6	50%	0.5	27%	0.27	S	S	.	.	H	α-helix	trans	-62.8	-45.9	175.4	-169.5	167.7	-175.6	0	0	112.4	T627 V631 E632 T633 S679	T627-E629 PolarHBondContact O-N 3.35Å; E629-V631 PolarHBondContact O-N 3Å; E629-E632 PolarHBondContact O-N 3.35Å; E629-T633 HydrophobicContact CG-CG2 4.47Å; E629-T633 WeakPolarHBondContact O-CB 3.27Å; E629-T633 WeakPolarHBondContact O-CG2 3.31Å; E629-T633 PolarHBondContact O-N 3.31Å; E629-T633 PolarHBondContact O-OG1 3Å; E629-S679 PolarHBondContact N-O 3.47Å
630	D	91.7	Very high	89.9	Confident	74 Å²	74	55.8 Å²	55.8	40%	0.396	29%	0.286	S	S	.	.	H	α-helix	trans	-59.6	-36.6	176.3	-59.5	-39.2	0	0	0	111.6	T627 T633 L634	T627-D630 WeakPolarHBondContact CB-OD2 3.29Å; T627-D630 PolarHBondContact N-OD2 2.92Å; T627-D630 PolarHBondContact O-N 3.26Å; T627-D630 PolarHBondContact OG1-N 3.45Å; T627-D630 PolarHBondContact OG1-OD2 3.36Å; D630-T633 VanDerWaalsContact C-OG1 3.25Å; D630-T633 VanDerWaalsContact CA-OG1 3.24Å; D630-T633 WeakPolarHBondContact CA-OG1 3.43Å; D630-T633 PolarHBondContact O-OG1 3.23Å; D630-L634 VanDerWaalsContact O-CB 3.24Å; D630-L634 WeakPolarHBondContact O-CB 3.47Å; D630-L634 PolarHBondContact O-N 3.37Å
631	V	90.9	Very high	89.5	Confident	1 Å²	1	58 Å²	58	1%	0.006	30%	0.297	C	S	.	.	H	α-helix	trans	-73.3	-41.4	178.9	175.1	0	0	0	0	110.9	L621 T627 V628 E629 L634 I635 L663 I667 V683	L621-V631 HydrophobicContact CD2-CG2 3.9Å; T627-V631 VanDerWaalsContact O-CG2 3.29Å; T627-V631 WeakPolarHBondContact O-CG2 3.46Å; T627-V631 PolarHBondContact O-N 2.86Å; T627-V631 VanDerWaalsContact O-N 3.15Å; V628-V631 PolarHBondContact O-N 3.03Å; E629-V631 PolarHBondContact O-N 3Å; V631-L634 PolarHBondContact O-N 2.64Å; V631-I635 HydrophobicContact CG1-CD1 4.06Å; V631-I635 WeakPolarHBondContact O-CB 3.36Å; V631-I635 WeakPolarHBondContact O-CD1 3.35Å; V631-I635 WeakPolarHBondContact O-CG1 3.49Å; V631-I635 PolarHBondContact O-N 3.23Å; V631-L663 HydrophobicContact CG1-CD1 4.07Å; V631-L663 HydrophobicContact CG1-CD2 3.22Å; V631-L663 HydrophobicContact CG1-CG 4.04Å; V631-I667 HydrophobicContact CB-CD1 4.41Å; V631-I667 HydrophobicContact CG1-CD1 3.68Å; V631-V683 HydrophobicContact CG2-CG2 4.33Å
632	E	91.3	Very high	89.2	Confident	47 Å²	47	58.5 Å²	58.5	22%	0.22	30%	0.303	C	S	.	.	H	α-helix	trans	-67.1	-39	176.4	-75.8	-178	164.4	0	0	112.3	V628 E629 I635 K636 R671	V628-E632 HydrophobicContact CG1-CG 4.39Å; V628-E632 WeakPolarHBondContact O-CG 3.44Å; V628-E632 PolarHBondContact O-N 3.29Å; E629-E632 PolarHBondContact O-N 3.35Å; E632-I635 PolarHBondContact O-N 2.84Å; E632-K636 VanDerWaalsContact O-CG 3.27Å; E632-K636 WeakPolarHBondContact O-CG 3.29Å; E632-K636 PolarHBondContact O-N 3.42Å; E632-R671 VanDerWaalsContact CD-NH2 3.26Å; E632-R671 IonicContact OE1-CZ 3.34Å; E632-R671 IonicContact OE1-NE 2.71Å; E632-R671 IonicContact OE1-NH1 2.7Å; E632-R671 IonicContact OE1-NH2 3.16Å; E632-R671 PolarHBondContact OE1-NH2 3.47Å; E632-R671 IonicContact OE2-CZ 2.56Å; E632-R671 IonicContact OE2-NH2 3.89Å; E632-R671 PolarHBondContact OE2-NH2 3.49Å
633	T	92.7	Very high	89.3	Confident	55 Å²	55	58.6 Å²	58.6	34%	0.337	30%	0.303	S	S	.	.	H	α-helix	trans	-64.8	-47.7	173.5	49.1	0	0	0	0	110.5	E629 D630 I635 K636 D637	E629-T633 HydrophobicContact CG-CG2 4.47Å; E629-T633 WeakPolarHBondContact O-CB 3.27Å; E629-T633 WeakPolarHBondContact O-CG2 3.31Å; E629-T633 PolarHBondContact O-N 3.31Å; E629-T633 PolarHBondContact O-OG1 3Å; D630-T633 VanDerWaalsContact C-OG1 3.25Å; D630-T633 VanDerWaalsContact CA-OG1 3.24Å; D630-T633 WeakPolarHBondContact CA-OG1 3.43Å; D630-T633 PolarHBondContact O-OG1 3.23Å; T633-I635 VanDerWaalsContact C-N 3.26Å; T633-I635 PolarHBondContact O-N 2.58Å; T633-K636 PolarHBondContact O-N 3.49Å; T633-D637 WeakPolarHBondContact O-CB 3.35Å; T633-D637 VanDerWaalsContact O-CG 3.23Å; T633-D637 PolarHBondContact O-N 3.03Å
634	L	91.4	Very high	89.6	Confident	35 Å²	35	56.6 Å²	56.6	18%	0.183	29%	0.294	C	S	.	.	H	α-helix	trans	-57	-39.3	175.5	-173.6	67.2	0	0	0	112.8	A619 L621 D630 V631 T638 F643	A619-L634 HydrophobicContact CB-CD1 4.02Å; L621-L634 HydrophobicContact CD2-CD2 3.69Å; L621-L634 HydrophobicContact CG-CD2 4.32Å; D630-L634 VanDerWaalsContact O-CB 3.24Å; D630-L634 WeakPolarHBondContact O-CB 3.47Å; D630-L634 PolarHBondContact O-N 3.37Å; V631-L634 PolarHBondContact O-N 2.64Å; L634-T638 HydrophobicContact CD1-CG2 4.01Å; L634-T638 WeakPolarHBondContact O-CB 3.42Å; L634-T638 PolarHBondContact O-N 3.48Å; L634-T638 VanDerWaalsContact O-N 3.15Å; L634-T638 PolarHBondContact O-OG1 3.13Å; L634-F643 HydrophobicContact CD1-CE1 4.49Å; L634-F643 HydrophobicContact CD2-CD1 3.82Å; L634-F643 HydrophobicContact CD2-CE1 3.79Å; L634-F643 HydrophobicContact CD2-CG 4.34Å; L634-F643 HydrophobicContact CD2-CZ 4.31Å; L634-F643 HydrophobicContact CG-CD1 4.41Å; L634-F643 HydrophobicContact CG-CE1 3.87Å; L634-F643 HydrophobicContact CG-CZ 4.23Å
635	I	90.8	Very high	89.9	Confident	20 Å²	20	52.8 Å²	52.8	10%	0.103	27%	0.274	C	S	.	.	H	α-helix	trans	-68.9	-33.3	175.8	-70.4	165.8	0	0	0	112.1	V631 E632 T633 F643 R660 L663	V631-I635 HydrophobicContact CG1-CD1 4.06Å; V631-I635 WeakPolarHBondContact O-CB 3.36Å; V631-I635 WeakPolarHBondContact O-CD1 3.35Å; V631-I635 WeakPolarHBondContact O-CG1 3.49Å; V631-I635 PolarHBondContact O-N 3.23Å; E632-I635 PolarHBondContact O-N 2.84Å; T633-I635 VanDerWaalsContact C-N 3.26Å; T633-I635 PolarHBondContact O-N 2.58Å; I635-F643 HydrophobicContact CG1-CE2 4.47Å; I635-R660 HydrophobicContact CG2-CG 4.36Å; I635-R660 VanDerWaalsContact O-CZ 3.25Å; I635-R660 PolarHBondContact O-NH2 3.32Å; I635-L663 HydrophobicContact CD1-CD2 3.23Å; I635-L663 HydrophobicContact CG1-CD2 4.11Å
636	K	90.4	Very high	90.3	Very high	159 Å²	159	49.3 Å²	49.3	69%	0.691	25%	0.249	S	C	*	.	H	α-helix	trans	-76.9	-38	178.5	-75.3	171.7	-177.9	177.2	0	111.6	E632 T633	E632-K636 VanDerWaalsContact O-CG 3.27Å; E632-K636 WeakPolarHBondContact O-CG 3.29Å; E632-K636 PolarHBondContact O-N 3.42Å; T633-K636 PolarHBondContact O-N 3.49Å
637	D	90.8	Very high	90.5	Very high	133 Å²	133	51.6 Å²	51.6	71%	0.711	26%	0.263	S	S	*	.	H	α-helix	trans	-82.1	-19.5	-174.4	-64.2	-11.2	0	0	0	112.9	T633	T633-D637 WeakPolarHBondContact O-CB 3.35Å; T633-D637 VanDerWaalsContact O-CG 3.23Å; T633-D637 PolarHBondContact O-N 3.03Å
638	T	88.4	Confident	90.5	Very high	20 Å²	20	52 Å²	52	12%	0.123	27%	0.267	C	S	.	.			trans	-121.4	145.9	-177.6	69.5	0	0	0	0	112.4	L634 Y640 F643 R660	L634-T638 HydrophobicContact CD1-CG2 4.01Å; L634-T638 WeakPolarHBondContact O-CB 3.42Å; L634-T638 PolarHBondContact O-N 3.48Å; L634-T638 VanDerWaalsContact O-N 3.15Å; L634-T638 PolarHBondContact O-OG1 3.13Å; T638-Y640 VanDerWaalsContact C-N 3.32Å; T638-Y640 HydrophobicContact CG2-CD2 3.88Å; T638-Y640 HydrophobicContact CG2-CE2 3.86Å; T638-F643 WeakPolarHBondContact OG1-CZ 3.48Å; T638-R660 PolarHBondContact O-NH1 3.15Å; T638-R660 PolarHBondContact O-NH2 3.06Å
639	D	84.7	Confident	90.3	Very high	130 Å²	130	60.3 Å²	60.3	70%	0.695	30%	0.299	S	S	*	.			trans	-93.7	10.8	172.7	-64.6	-42.2	0	0	0	113.3	R660	D639-R660 VanDerWaalsContact CA-NH1 3.31Å
640	Y	87	Confident	90.2	Very high	128 Å²	128	63.6 Å²	63.6	50%	0.502	31%	0.314	S	S	.	.			trans	-67.2	144.7	-179.6	-54.7	-39.5	0	0	0	111.6	A619 T638 F643 R660	A619-Y640 HydrophobicContact CB-CD2 4.09Å; A619-Y640 HydrophobicContact CB-CE2 4.06Å; T638-Y640 VanDerWaalsContact C-N 3.32Å; T638-Y640 HydrophobicContact CG2-CD2 3.88Å; T638-Y640 HydrophobicContact CG2-CE2 3.86Å; Y640-F643 HydrophobicContact CD2-CE1 4.09Å; Y640-R660 WeakPolarHBondContact O-CD 3.15Å; Y640-R660 PolarHBondContact O-NH1 2.04Å
641	N	83.6	Confident	90.1	Very high	71 Å²	71	61.9 Å²	61.9	38%	0.38	31%	0.308	S	S	.	.	S	Bend	trans	-91.7	-3	-176.4	-81.7	-77.4	0	0	0	113.8	R660 R732	N641-R660 PolarHBondContact O-N 3.17Å; N641-R732 PolarHBondContact ND2-NH2 3.01Å; N641-R732 VanDerWaalsContact ND2-NH2 3.14Å
642	G	88.5	Confident	90	Very high	13 Å²	13	64.8 Å²	64.8	13%	0.134	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.2	166	175.9	0	0	0	0	0	111.7	F657 V658	G642-F657 VanDerWaalsContact CA-CZ 3.5Å; G642-V658 CarbonylContact C-O 3.59Å; G642-V658 WeakPolarHBondContact CA-O 3.31Å
643	F	92.8	Very high	90.1	Very high	2 Å²	2	70.2 Å²	70.2	1%	0.009	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	136.8	-169.5	-53.3	-83.4	0	0	0	109.8	A619 L621 L634 I635 T638 Y640 F657 V658 R660	A619-F643 HydrophobicContact CB-CD1 4.11Å; A619-F643 HydrophobicContact CB-CE1 4.24Å; L621-F643 HydrophobicContact CD1-CB 4.01Å; L621-F643 HydrophobicContact CD1-CD2 4.5Å; L621-F643 HydrophobicContact CD1-CG 4.46Å; L621-F643 HydrophobicContact CG-CB 4.08Å; L634-F643 HydrophobicContact CD1-CE1 4.49Å; L634-F643 HydrophobicContact CD2-CD1 3.82Å; L634-F643 HydrophobicContact CD2-CE1 3.79Å; L634-F643 HydrophobicContact CD2-CG 4.34Å; L634-F643 HydrophobicContact CD2-CZ 4.31Å; L634-F643 HydrophobicContact CG-CD1 4.41Å; L634-F643 HydrophobicContact CG-CE1 3.87Å; L634-F643 HydrophobicContact CG-CZ 4.23Å; I635-F643 HydrophobicContact CG1-CE2 4.47Å; T638-F643 WeakPolarHBondContact OG1-CZ 3.48Å; Y640-F643 HydrophobicContact CD2-CE1 4.09Å; F643-F657 VanDerWaalsContact N-CZ 3.34Å; F643-V658 HydrophobicContact CB-CG1 4.38Å; F643-V658 PolarHBondContact N-O 3.48Å; F643-V658 PolarHBondContact O-N 2.93Å; F643-R660 HydrophobicContact CE2-CB 4.28Å
644	P	94.3	Very high	90.2	Very high	3 Å²	3	69.4 Å²	69.4	2%	0.019	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	145.7	167.8	32.4	-34.5	0	0	0	110.2	L618 A619 V620 L621 L654 F657 L735 L742	L618-P644 HydrophobicContact CD2-CG 3.93Å; L618-P644 HydrophobicContact CG-CG 4.46Å; A619-P644 WeakPolarHBondContact O-CD 3.3Å; V620-P644 HydrophobicContact CB-CG 4.4Å; V620-P644 HydrophobicContact CG1-CG 3.85Å; L621-P644 PolarHBondContact N-O 2.94Å; P644-L654 HydrophobicContact CB-CD1 4.16Å; P644-F657 HydrophobicContact CB-CD2 4.27Å; P644-L735 HydrophobicContact CB-CD2 4.4Å; P644-L742 HydrophobicContact CB-CD2 3.58Å; P644-L742 HydrophobicContact CG-CD2 3.57Å
645	V	93.6	Very high	90.2	Very high	0 Å²	0	69.5 Å²	69.5	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	125	175.5	-175.2	0	0	0	0	108.9	L621 I655 G656 V658 F685 L706	L621-V645 HydrophobicContact CB-CG2 4.26Å; L621-V645 CarbonylContact O-C 3.56Å; L621-V645 VanDerWaalsContact O-CA 3.28Å; L621-V645 WeakPolarHBondContact O-CA 3.48Å; V645-I655 PolarHBondContact O-N 3.47Å; V645-G656 PolarHBondContact N-O 3.04Å; V645-G656 PolarHBondContact O-N 2.99Å; V645-V658 HydrophobicContact CG2-CB 4.41Å; V645-V658 HydrophobicContact CG2-CG1 3.96Å; V645-F685 HydrophobicContact CG1-CB 4.2Å; V645-F685 HydrophobicContact CG1-CD2 3.76Å; V645-F685 HydrophobicContact CG1-CE2 4.27Å; V645-F685 HydrophobicContact CG1-CG 3.98Å; V645-F685 HydrophobicContact CG2-CD2 4.49Å; V645-F685 HydrophobicContact CG2-CE1 4.41Å; V645-F685 HydrophobicContact CG2-CE2 4.36Å; V645-F685 HydrophobicContact CG2-CZ 4.31Å; V645-L706 HydrophobicContact CB-CD1 3.83Å; V645-L706 HydrophobicContact CG2-CD1 3.44Å; V645-L706 VanDerWaalsContact CG2-CD1 3.44Å
646	V	94.1	Very high	90.2	Very high	0 Å²	0	68.6 Å²	68.6	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	158.6	-179.4	-62.6	0	0	0	0	111.4	V620 L621 T622 Q623 R653 L742	V620-V646 HydrophobicContact CB-CG2 4.18Å; V620-V646 HydrophobicContact CG2-CG2 3.88Å; L621-V646 PolarHBondContact O-N 3.23Å; T622-V646 CarbonylContact C-O 3.44Å; T622-V646 WeakPolarHBondContact CA-O 3.46Å; Q623-V646 PolarHBondContact N-O 2.99Å; V646-R653 CarbonylContact C-O 3.5Å; V646-R653 WeakPolarHBondContact CA-O 3.39Å; V646-R653 WeakPolarHBondContact CB-O 3.27Å; V646-L742 HydrophobicContact CG1-CB 4.34Å; V646-L742 HydrophobicContact CG1-CD2 3.94Å
647	V	91.9	Very high	90.2	Very high	55 Å²	55	61.5 Å²	61.5	33%	0.333	30%	0.298	S	S	.	.	S	Bend	trans	-58.9	-57.4	176.8	177.8	0	0	0	0	110.6	R653 I655	V647-R653 HydrophobicContact CB-CB 4.33Å; V647-R653 HydrophobicContact CG2-CB 3.85Å; V647-R653 PolarHBondContact N-O 3.21Å; V647-I655 HydrophobicContact CB-CD1 4.38Å; V647-I655 HydrophobicContact CG2-CD1 3.77Å; V647-I655 HydrophobicContact CG2-CG1 3.76Å
648	S	90.5	Very high	90.2	Very high	39 Å²	39	55.2 Å²	55.2	27%	0.273	27%	0.265	S	S	.	.			trans	-147.2	161.9	176.8	68.2	0	0	0	0	110.4	E650 S651 E652	S648-E650 PolarHBondContact O-N 3.05Å; S648-S651 PolarHBondContact N-OG 3.05Å; S648-S651 PolarHBondContact O-N 3.28Å; S648-S651 WeakPolarHBondContact OG-CB 3.37Å; S648-S651 PolarHBondContact OG-N 3.18Å; S648-S651 VanDerWaalsContact OG-N 3.15Å; S648-S651 PolarHBondContact OG-OG 2.98Å; S648-E652 WeakPolarHBondContact O-CA 3.23Å; S648-E652 PolarHBondContact O-N 3.43Å
649	R	87.3	Confident	90.1	Very high	174 Å²	174	55 Å²	55	66%	0.657	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-23	175.7	-67.9	-170.4	179.5	-134.7	3.3	113.2	T622 E652	T622-R649 HydrophobicContact CG2-CG 3.85Å; R649-E652 WeakPolarHBondContact O-CG 3.19Å
650	E	87.9	Confident	90.3	Very high	176 Å²	176	51.8 Å²	51.8	82%	0.822	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-43.1	179.1	-62.6	176.9	179.2	0	0	112.3	S648	S648-E650 PolarHBondContact O-N 3.05Å
651	S	89.3	Confident	90.2	Very high	38 Å²	38	52 Å²	52	27%	0.266	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-28.9	-176.7	65.2	0	0	0	0	112.9	S648 R653	S648-S651 PolarHBondContact N-OG 3.05Å; S648-S651 PolarHBondContact O-N 3.28Å; S648-S651 WeakPolarHBondContact OG-CB 3.37Å; S648-S651 PolarHBondContact OG-N 3.18Å; S648-S651 VanDerWaalsContact OG-N 3.15Å; S648-S651 PolarHBondContact OG-OG 2.98Å; S651-R653 PolarHBondContact O-N 3.38Å
652	E	89.6	Confident	90.2	Very high	62 Å²	62	49.9 Å²	49.9	29%	0.29	23%	0.229	S	C	.	.			trans	47.4	26	-176.8	-62.3	177.8	147.3	0	0	113.6	S648 R649 L654 R741 L742	S648-E652 WeakPolarHBondContact O-CA 3.23Å; S648-E652 PolarHBondContact O-N 3.43Å; R649-E652 WeakPolarHBondContact O-CG 3.19Å; E652-L654 PolarHBondContact O-N 3.14Å; E652-R741 HydrophobicContact CB-CG 3.88Å; E652-R741 IonicContact OE2-CZ 3.22Å; E652-R741 IonicContact OE2-NE 2.85Å; E652-R741 PolarHBondContact OE2-NE 3.43Å; E652-R741 IonicContact OE2-NH2 2.72Å; E652-R741 PolarHBondContact OE2-NH2 3.41Å; E652-L742 WeakPolarHBondContact O-CB 3.29Å; E652-L742 PolarHBondContact O-N 2.99Å
653	R	93.7	Very high	90.2	Very high	162 Å²	162	49.3 Å²	49.3	61%	0.611	22%	0.223	S	C	*	.	B	Isolated β-bridge	trans	-71.9	125.1	178.2	-77.8	-174.9	179.2	159.6	1.1	109.7	V646 V647 S651 G740	V646-R653 CarbonylContact C-O 3.5Å; V646-R653 WeakPolarHBondContact CA-O 3.39Å; V646-R653 WeakPolarHBondContact CB-O 3.27Å; V647-R653 HydrophobicContact CB-CB 4.33Å; V647-R653 HydrophobicContact CG2-CB 3.85Å; V647-R653 PolarHBondContact N-O 3.21Å; S651-R653 PolarHBondContact O-N 3.38Å; R653-G740 WeakPolarHBondContact CA-O 3.4Å
654	L	93.9	Very high	90	Very high	38 Å²	38	52.3 Å²	52.3	20%	0.199	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	130	-176.8	179.9	66.7	0	0	0	111.3	P644 E652 G656 P710 T712 L735 T737 G740 L742	P644-L654 HydrophobicContact CB-CD1 4.16Å; E652-L654 PolarHBondContact O-N 3.14Å; L654-G656 WeakPolarHBondContact CD1-O 3.31Å; L654-P710 HydrophobicContact CD2-CG 4.1Å; L654-T712 HydrophobicContact CD2-CG2 3.54Å; L654-L735 HydrophobicContact CD1-CD1 3.68Å; L654-L735 HydrophobicContact CD2-CB 4.28Å; L654-L735 HydrophobicContact CD2-CD1 3.6Å; L654-L735 HydrophobicContact CG-CD1 4.28Å; L654-T737 HydrophobicContact CD2-CG2 3.82Å; L654-G740 PolarHBondContact N-O 3.35Å; L654-L742 HydrophobicContact CB-CB 4.46Å; L654-L742 HydrophobicContact CD1-CD1 4.45Å
655	I	91.6	Very high	89.6	Confident	37 Å²	37	56.8 Å²	56.8	19%	0.19	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	-42.1	172.7	-56.6	173.3	0	0	0	110.3	Q623 V645 V647 L706	Q623-I655 HydrophobicContact CB-CD1 3.63Å; Q623-I655 HydrophobicContact CG-CD1 3.68Å; V645-I655 PolarHBondContact O-N 3.47Å; V647-I655 HydrophobicContact CB-CD1 4.38Å; V647-I655 HydrophobicContact CG2-CD1 3.77Å; V647-I655 HydrophobicContact CG2-CG1 3.76Å; I655-L706 HydrophobicContact CG2-CD2 3.92Å
656	G	91.1	Very high	89.3	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-178	-167.1	-174.7	0	0	0	0	0	113.9	V645 L654 N707	V645-G656 PolarHBondContact N-O 3.04Å; V645-G656 PolarHBondContact O-N 2.99Å; L654-G656 WeakPolarHBondContact CD1-O 3.31Å; G656-N707 CarbonylContact C-O 3.45Å; G656-N707 WeakPolarHBondContact CA-O 3.35Å
657	F	90.7	Very high	89	Confident	11 Å²	11	57.9 Å²	57.9	5%	0.048	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	138	179.7	-170	-83.8	0	0	0	111	G642 F643 P644 Q659 N707 P710 Q733 L735 I745	G642-F657 VanDerWaalsContact CA-CZ 3.5Å; F643-F657 VanDerWaalsContact N-CZ 3.34Å; P644-F657 HydrophobicContact CB-CD2 4.27Å; F657-Q659 HydrophobicContact CE1-CG 4.32Å; F657-N707 PolarHBondContact N-O 2.91Å; F657-N707 WeakPolarHBondContact O-CB 3.49Å; F657-N707 PolarHBondContact O-N 3.46Å; F657-P710 HydrophobicContact CB-CB 3.91Å; F657-P710 HydrophobicContact CB-CG 4.41Å; F657-Q733 VanDerWaalsContact CD1-NE2 3.32Å; F657-L735 HydrophobicContact CD2-CD1 4.33Å; F657-L735 HydrophobicContact CD2-CD2 4.31Å; F657-I745 HydrophobicContact CE2-CD1 4.17Å
658	V	89.8	Confident	88.8	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.006	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	139.9	178.8	67.9	0	0	0	0	110.9	L621 G642 F643 V645 L663 I705 L706	L621-V658 HydrophobicContact CD1-CG1 3.77Å; G642-V658 CarbonylContact C-O 3.59Å; G642-V658 WeakPolarHBondContact CA-O 3.31Å; F643-V658 HydrophobicContact CB-CG1 4.38Å; F643-V658 PolarHBondContact N-O 3.48Å; F643-V658 PolarHBondContact O-N 2.93Å; V645-V658 HydrophobicContact CG2-CB 4.41Å; V645-V658 HydrophobicContact CG2-CG1 3.96Å; V658-L663 HydrophobicContact CG1-CD1 3.9Å; V658-L663 HydrophobicContact CG2-CB 4.07Å; V658-L663 HydrophobicContact CG2-CD1 4.07Å; V658-I705 HydrophobicContact CG2-CD1 3.65Å; V658-I705 HydrophobicContact CG2-CG1 4.02Å; V658-L706 HydrophobicContact CB-CD1 4.42Å
659	Q	86.6	Confident	88.6	Confident	16 Å²	16	62.5 Å²	62.5	8%	0.075	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	145.5	176.8	-65.7	-173.5	-1	0	0	111.4	F657 R661 D662 L663	F657-Q659 HydrophobicContact CE1-CG 4.32Å; Q659-R661 VanDerWaalsContact C-N 3.34Å; Q659-R661 HydrophobicContact CB-CG 4.3Å; Q659-R661 PolarHBondContact O-N 2.94Å; Q659-R661 VanDerWaalsContact OE1-CZ 3.28Å; Q659-R661 VanDerWaalsContact OE1-NH2 3.12Å; Q659-D662 PolarHBondContact O-N 2.6Å; Q659-L663 WeakPolarHBondContact O-CB 3.48Å; Q659-L663 PolarHBondContact O-N 3.48Å; Q659-L663 VanDerWaalsContact O-N 3.11Å
660	R	88.3	Confident	88.5	Confident	61 Å²	61	54.6 Å²	54.6	23%	0.23	26%	0.258	C	S	.	.	H	α-helix	trans	-53.4	-49.2	177.7	177.3	170.4	176.4	167.7	5.9	112	I635 T638 D639 Y640 N641 F643 D662 L663 T664	I635-R660 HydrophobicContact CG2-CG 4.36Å; I635-R660 VanDerWaalsContact O-CZ 3.25Å; I635-R660 PolarHBondContact O-NH2 3.32Å; T638-R660 PolarHBondContact O-NH1 3.15Å; T638-R660 PolarHBondContact O-NH2 3.06Å; D639-R660 VanDerWaalsContact CA-NH1 3.31Å; Y640-R660 WeakPolarHBondContact O-CD 3.15Å; Y640-R660 PolarHBondContact O-NH1 2.04Å; N641-R660 PolarHBondContact O-N 3.17Å; F643-R660 HydrophobicContact CE2-CB 4.28Å; R660-D662 VanDerWaalsContact C-N 3.32Å; R660-D662 PolarHBondContact O-N 3.32Å; R660-L663 PolarHBondContact O-N 3.25Å; R660-T664 PolarHBondContact O-N 3.08Å; R660-T664 PolarHBondContact O-OG1 3.5Å
661	R	84.6	Confident	88.4	Confident	132 Å²	132	51.4 Å²	51.4	50%	0.498	24%	0.239	S	C	.	.	H	α-helix	trans	-56.3	-42.5	-179.6	71.6	179.6	179.6	177.7	-4.2	113.4	Q659 L663 L665	Q659-R661 VanDerWaalsContact C-N 3.34Å; Q659-R661 HydrophobicContact CB-CG 4.3Å; Q659-R661 PolarHBondContact O-N 2.94Å; Q659-R661 VanDerWaalsContact OE1-CZ 3.28Å; Q659-R661 VanDerWaalsContact OE1-NH2 3.12Å; R661-L663 VanDerWaalsContact C-N 3.32Å; R661-L665 VanDerWaalsContact O-CB 3.27Å; R661-L665 WeakPolarHBondContact O-CB 3.48Å; R661-L665 PolarHBondContact O-N 3.5Å
662	D	84.7	Confident	88.2	Confident	28 Å²	28	55.9 Å²	55.9	15%	0.15	26%	0.256	C	S	.	.	H	α-helix	trans	-73.1	-35.9	-175.5	-64.3	-44.3	0	0	0	109.6	R46 Q659 R660 A666 I705	R46-D662 IonicContact CZ-OD2 3.61Å; R46-D662 IonicContact NH1-OD2 2.66Å; R46-D662 PolarHBondContact NH1-OD2 2.94Å; R46-D662 VanDerWaalsContact NH2-CG 3.34Å; R46-D662 IonicContact NH2-OD1 3.38Å; R46-D662 PolarHBondContact NH2-OD1 3.3Å; R46-D662 IonicContact NH2-OD2 2.84Å; R46-D662 PolarHBondContact NH2-OD2 3.39Å; Q659-D662 PolarHBondContact O-N 2.6Å; R660-D662 VanDerWaalsContact C-N 3.32Å; R660-D662 PolarHBondContact O-N 3.32Å; D662-A666 WeakPolarHBondContact O-CB 2.94Å; D662-A666 PolarHBondContact O-N 3.41Å; D662-I705 HydrophobicContact CB-CB 4.32Å; D662-I705 HydrophobicContact CB-CG2 4.47Å
663	L	88	Confident	87.8	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-73.3	-44.2	179.8	-177.2	140.8	0	0	0	111.8	L621 V631 I635 V658 Q659 R660 R661 L665 A666 I667 F685 I705	L621-L663 HydrophobicContact CD1-CD1 3.69Å; V631-L663 HydrophobicContact CG1-CD1 4.07Å; V631-L663 HydrophobicContact CG1-CD2 3.22Å; V631-L663 HydrophobicContact CG1-CG 4.04Å; I635-L663 HydrophobicContact CD1-CD2 3.23Å; I635-L663 HydrophobicContact CG1-CD2 4.11Å; V658-L663 HydrophobicContact CG1-CD1 3.9Å; V658-L663 HydrophobicContact CG2-CB 4.07Å; V658-L663 HydrophobicContact CG2-CD1 4.07Å; Q659-L663 WeakPolarHBondContact O-CB 3.48Å; Q659-L663 PolarHBondContact O-N 3.48Å; Q659-L663 VanDerWaalsContact O-N 3.11Å; R660-L663 PolarHBondContact O-N 3.25Å; R661-L663 VanDerWaalsContact C-N 3.32Å; L663-L665 PolarHBondContact O-N 3.29Å; L663-A666 PolarHBondContact O-N 3.44Å; L663-I667 HydrophobicContact CD2-CD1 3.83Å; L663-I667 HydrophobicContact CG-CD1 4.28Å; L663-I667 WeakPolarHBondContact O-CG1 3.01Å; L663-I667 PolarHBondContact O-N 3.05Å; L663-F685 HydrophobicContact CD1-CZ 4.28Å; L663-I705 HydrophobicContact CB-CD1 4.05Å
664	T	88.8	Confident	87.1	Confident	65 Å²	65	57.3 Å²	57.3	40%	0.399	27%	0.267	S	S	.	.	H	α-helix	trans	-60.1	-43.9	171.6	-51.3	0	0	0	0	111.8	R660 K668	R660-T664 PolarHBondContact O-N 3.08Å; R660-T664 PolarHBondContact O-OG1 3.5Å; T664-K668 WeakPolarHBondContact O-CB 3.33Å; T664-K668 PolarHBondContact O-N 2.92Å
665	L	86.1	Confident	86	Confident	97 Å²	97	62.7 Å²	62.7	51%	0.508	30%	0.296	S	S	.	.	H	α-helix	trans	-66.1	-40.4	177.9	-178.3	64.3	0	0	0	111.7	R661 L663 N669	R661-L665 VanDerWaalsContact O-CB 3.27Å; R661-L665 WeakPolarHBondContact O-CB 3.48Å; R661-L665 PolarHBondContact O-N 3.5Å; L663-L665 PolarHBondContact O-N 3.29Å; L665-N669 VanDerWaalsContact O-CB 3.3Å; L665-N669 WeakPolarHBondContact O-CB 3.3Å; L665-N669 PolarHBondContact O-N 3.49Å; L665-N669 PolarHBondContact O-ND2 3.49Å
666	A	86.7	Confident	85.4	Confident	18 Å²	18	63 Å²	63	15%	0.149	31%	0.308	C	S	.	.	H	α-helix	trans	-66	-43.7	179.2	0	0	0	0	0	111.8	D662 L663 N669 A670 L702 I705	D662-A666 WeakPolarHBondContact O-CB 2.94Å; D662-A666 PolarHBondContact O-N 3.41Å; L663-A666 PolarHBondContact O-N 3.44Å; A666-N669 PolarHBondContact O-N 3.01Å; A666-A670 VanDerWaalsContact O-CB 3.27Å; A666-A670 WeakPolarHBondContact O-CB 3.37Å; A666-A670 PolarHBondContact O-N 3.06Å; A666-L702 HydrophobicContact CB-CD2 3.63Å; A666-I705 HydrophobicContact CB-CD1 4.03Å; A666-I705 HydrophobicContact CB-CG2 4.38Å
667	I	88.4	Confident	84.9	Confident	5 Å²	5	63.7 Å²	63.7	3%	0.026	31%	0.312	C	S	.	.	H	α-helix	trans	-63.5	-46.5	176.6	-67.2	168.4	0	0	0	110.7	V628 V631 L663 N669 A670 R671 L700	V628-I667 HydrophobicContact CG1-CG2 3.89Å; V631-I667 HydrophobicContact CB-CD1 4.41Å; V631-I667 HydrophobicContact CG1-CD1 3.68Å; L663-I667 HydrophobicContact CD2-CD1 3.83Å; L663-I667 HydrophobicContact CG-CD1 4.28Å; L663-I667 WeakPolarHBondContact O-CG1 3.01Å; L663-I667 PolarHBondContact O-N 3.05Å; I667-N669 PolarHBondContact O-N 3.42Å; I667-A670 PolarHBondContact O-N 3.14Å; I667-R671 PolarHBondContact O-N 2.92Å; I667-L700 HydrophobicContact CG1-CD2 4.07Å
668	K	87.5	Confident	84.6	Confident	128 Å²	128	66.4 Å²	66.4	56%	0.557	33%	0.329	S	S	*	.	H	α-helix	trans	-59.8	-45.3	177.6	-173.9	175.1	-179.3	175.1	0	112	T664 A670 Q672	T664-K668 WeakPolarHBondContact O-CB 3.33Å; T664-K668 PolarHBondContact O-N 2.92Å; K668-A670 VanDerWaalsContact C-N 3.34Å; K668-Q672 WeakPolarHBondContact O-CG 2.94Å; K668-Q672 PolarHBondContact O-N 3.21Å
669	N	86.9	Confident	84.3	Confident	63 Å²	63	68.5 Å²	68.5	34%	0.337	34%	0.344	S	S	.	.	H	α-helix	trans	-66.4	-36.5	177.2	-75.3	-26.7	0	0	0	112.4	L665 A666 I667 Q672 K673	L665-N669 VanDerWaalsContact O-CB 3.3Å; L665-N669 WeakPolarHBondContact O-CB 3.3Å; L665-N669 PolarHBondContact O-N 3.49Å; L665-N669 PolarHBondContact O-ND2 3.49Å; A666-N669 PolarHBondContact O-N 3.01Å; I667-N669 PolarHBondContact O-N 3.42Å; N669-Q672 PolarHBondContact O-N 3.07Å; N669-K673 WeakPolarHBondContact O-CB 3.27Å; N669-K673 WeakPolarHBondContact O-CG 3.43Å; N669-K673 PolarHBondContact O-N 3.35Å
670	A	85.4	Confident	84.3	Confident	8 Å²	8	70.9 Å²	70.9	7%	0.066	36%	0.362	C	S	.	.	H	α-helix	trans	-65.7	-47.3	178.3	0	0	0	0	0	111.4	A666 I667 K668 Q672 K673 Q674 L700	A666-A670 VanDerWaalsContact O-CB 3.27Å; A666-A670 WeakPolarHBondContact O-CB 3.37Å; A666-A670 PolarHBondContact O-N 3.06Å; I667-A670 PolarHBondContact O-N 3.14Å; K668-A670 VanDerWaalsContact C-N 3.34Å; A670-Q672 PolarHBondContact O-N 2.98Å; A670-K673 PolarHBondContact O-N 3.27Å; A670-Q674 WeakPolarHBondContact O-CB 3.37Å; A670-Q674 PolarHBondContact O-N 3.36Å; A670-L700 HydrophobicContact CB-CD1 3.35Å; A670-L700 HydrophobicContact CB-CD2 4.36Å
671	R	84.3	Confident	84.2	Confident	109 Å²	109	68 Å²	68	41%	0.411	35%	0.351	S	S	.	.	H	α-helix	trans	-59.1	-28.7	174.7	-75.2	-165.6	-178.8	178.6	9.5	113.6	E632 I667 V677 S679	E632-R671 VanDerWaalsContact CD-NH2 3.26Å; E632-R671 IonicContact OE1-CZ 3.34Å; E632-R671 IonicContact OE1-NE 2.71Å; E632-R671 IonicContact OE1-NH1 2.7Å; E632-R671 IonicContact OE1-NH2 3.16Å; E632-R671 PolarHBondContact OE1-NH2 3.47Å; E632-R671 IonicContact OE2-CZ 2.56Å; E632-R671 IonicContact OE2-NH2 3.89Å; E632-R671 PolarHBondContact OE2-NH2 3.49Å; I667-R671 PolarHBondContact O-N 2.92Å; R671-V677 HydrophobicContact CG-CG1 4.47Å; R671-S679 PolarHBondContact NH2-OG 3.28Å
672	Q	85.1	Confident	84.4	Confident	132 Å²	132	63.5 Å²	63.5	62%	0.617	34%	0.339	S	S	*	.	H	α-helix	trans	-84.6	-29.3	179.1	-73.3	-178.7	-10.8	0	0	114	K668 N669 A670	K668-Q672 WeakPolarHBondContact O-CG 2.94Å; K668-Q672 PolarHBondContact O-N 3.21Å; N669-Q672 PolarHBondContact O-N 3.07Å; A670-Q672 PolarHBondContact O-N 2.98Å
673	K	82.3	Confident	84.5	Confident	167 Å²	167	62.1 Å²	62.1	73%	0.726	33%	0.331	S	S	*	.	H	α-helix	trans	-111.4	-20.6	-169.8	-68.3	-173.2	177.3	-173.3	0	114.4	N669 A670	N669-K673 WeakPolarHBondContact O-CB 3.27Å; N669-K673 WeakPolarHBondContact O-CG 3.43Å; N669-K673 PolarHBondContact O-N 3.35Å; A670-K673 PolarHBondContact O-N 3.27Å
674	Q	78.9	Confident	84.6	Confident	87 Å²	87	63.5 Å²	63.5	41%	0.407	34%	0.337	S	S	.	.	S	Bend	trans	-114.8	107.8	-178.7	-70.1	-179.4	-39.6	0	0	109	A670 G676 V677	A670-Q674 WeakPolarHBondContact O-CB 3.37Å; A670-Q674 PolarHBondContact O-N 3.36Å; Q674-G676 PolarHBondContact O-N 3.46Å; Q674-V677 HydrophobicContact CB-CG2 3.67Å
675	D	71.1	Confident	84.4	Confident	152 Å²	152	60.5 Å²	60.5	81%	0.813	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	124.9	173	-60.8	-38.8	0	0	0	109.2
676	G	77.4	Confident	84.3	Confident	43 Å²	43	57.4 Å²	57.4	44%	0.443	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.2	4.6	179	0	0	0	0	0	116.5	Q674 V678 Q698	Q674-G676 PolarHBondContact O-N 3.46Å; G676-V678 PolarHBondContact O-N 3.09Å; G676-Q698 PolarHBondContact O-N 3.31Å
677	V	81.1	Confident	83.8	Confident	14 Å²	14	63.4 Å²	63.4	9%	0.085	33%	0.328	C	S	.	.			trans	-80.5	112.2	167.1	179.5	0	0	0	0	109.4	R671 Q674	R671-V677 HydrophobicContact CG-CG1 4.47Å; Q674-V677 HydrophobicContact CB-CG2 3.67Å
678	V	84	Confident	83.1	Confident	68 Å²	68	69.4 Å²	69.4	41%	0.412	36%	0.361	S	S	.	.			trans	-119	171.5	-179.2	-69.2	0	0	0	0	110.4	G676 S680 S681 P697	G676-V678 PolarHBondContact O-N 3.09Å; V678-S680 WeakPolarHBondContact CG2-OG 3.35Å; V678-S680 PolarHBondContact O-N 3.32Å; V678-S681 PolarHBondContact N-OG 2.65Å; V678-S681 VanDerWaalsContact N-OG 3.07Å; V678-S681 WeakPolarHBondContact O-CB 3.44Å; V678-S681 PolarHBondContact O-N 2.85Å; V678-S681 PolarHBondContact O-OG 3.44Å; V678-P697 HydrophobicContact CG2-CB 3.39Å; V678-P697 HydrophobicContact CG2-CG 4.48Å
679	S	84.4	Confident	82.4	Confident	45 Å²	45	64.1 Å²	64.1	32%	0.315	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-31.9	-179.8	-51.5	0	0	0	0	113	V628 E629 R671 S681	V628-S679 PolarHBondContact N-O 3.25Å; E629-S679 PolarHBondContact N-O 3.47Å; R671-S679 PolarHBondContact NH2-OG 3.28Å; S679-S681 VanDerWaalsContact C-N 3.29Å; S679-S681 PolarHBondContact O-N 3.5Å
680	S	85.8	Confident	81.9	Confident	66 Å²	66	64.4 Å²	64.4	46%	0.462	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-1.3	175.8	56.2	0	0	0	0	114.7	V678 V682	V678-S680 WeakPolarHBondContact CG2-OG 3.35Å; V678-S680 PolarHBondContact O-N 3.32Å; S680-V682 PolarHBondContact O-N 3.36Å
681	S	87.3	Confident	81	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-62.6	133.7	173.9	-74.4	0	0	0	0	110.6	T627 V628 V678 S679 Q698	T627-S681 CarbonylContact C-O 2.8Å; T627-S681 WeakPolarHBondContact CA-O 3.34Å; V628-S681 WeakPolarHBondContact CG2-O 3.49Å; V628-S681 PolarHBondContact N-O 2.82Å; V678-S681 PolarHBondContact N-OG 2.65Å; V678-S681 VanDerWaalsContact N-OG 3.07Å; V678-S681 WeakPolarHBondContact O-CB 3.44Å; V678-S681 PolarHBondContact O-N 2.85Å; V678-S681 PolarHBondContact O-OG 3.44Å; S679-S681 VanDerWaalsContact C-N 3.29Å; S679-S681 PolarHBondContact O-N 3.5Å; S681-Q698 WeakPolarHBondContact CB-O 3.33Å; S681-Q698 PolarHBondContact OG-O 3.19Å
682	V	87.6	Confident	80.2	Confident	38 Å²	38	71.6 Å²	71.6	23%	0.23	39%	0.385	C	S	.	.	B	Isolated β-bridge	trans	-81.8	136.3	177.2	-178.8	0	0	0	0	110.3	D624 S680 Y684 P699 L700	D624-V682 WeakPolarHBondContact O-CG1 3.2Å; S680-V682 PolarHBondContact O-N 3.36Å; V682-Y684 HydrophobicContact CB-CD2 4.48Å; V682-Y684 HydrophobicContact CB-CE2 3.8Å; V682-Y684 HydrophobicContact CG1-CD2 4.19Å; V682-Y684 HydrophobicContact CG1-CE2 3.61Å; V682-P699 WeakPolarHBondContact O-CA 3.22Å; V682-L700 PolarHBondContact O-N 3.25Å
683	V	88.1	Confident	79.5	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	125.2	179	-179.7	0	0	0	0	110	T626 V628 V631 F685 L700 L702	T626-V683 WeakPolarHBondContact O-CB 3.47Å; T626-V683 PolarHBondContact O-N 3.45Å; V628-V683 HydrophobicContact CG2-CG2 3.79Å; V631-V683 HydrophobicContact CG2-CG2 4.33Å; V683-F685 HydrophobicContact CG1-CD2 4.31Å; V683-F685 HydrophobicContact CG1-CE2 3.76Å; V683-F685 HydrophobicContact CG1-CZ 3.92Å; V683-L700 WeakPolarHBondContact CA-O 3.35Å; V683-L700 HydrophobicContact CG2-CB 4.49Å; V683-L700 HydrophobicContact CG2-CD2 4.36Å; V683-L702 HydrophobicContact CG1-CB 4.15Å; V683-L702 HydrophobicContact CG1-CD1 3.54Å; V683-L702 HydrophobicContact CG1-CG 3.85Å
684	Y	88.7	Confident	78.5	Confident	29 Å²	29	66.9 Å²	66.9	11%	0.114	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	125.8	177.9	-72.5	-92	0	0	0	111.6	Q623 D624 V682 A689 P690 P699 L700 L702	Q623-Y684 WeakPolarHBondContact O-CA 3.24Å; D624-Y684 HydrophobicContact CB-CD1 3.77Å; D624-Y684 HydrophobicContact CB-CE1 3.64Å; V682-Y684 HydrophobicContact CB-CD2 4.48Å; V682-Y684 HydrophobicContact CB-CE2 3.8Å; V682-Y684 HydrophobicContact CG1-CD2 4.19Å; V682-Y684 HydrophobicContact CG1-CE2 3.61Å; Y684-A689 HydrophobicContact CD2-CB 4.21Å; Y684-A689 HydrophobicContact CG-CB 4.1Å; Y684-P690 VanDerWaalsContact CE1-CD 3.49Å; Y684-P690 HydrophobicContact CE1-CG 3.91Å; Y684-P690 WeakPolarHBondContact OH-CG 3.46Å; Y684-P699 HydrophobicContact CD2-CB 3.59Å; Y684-P699 HydrophobicContact CE2-CB 3.58Å; Y684-L700 PolarHBondContact N-O 3.15Å; Y684-L702 PolarHBondContact O-N 2.78Å
685	F	86	Confident	77.8	Confident	2 Å²	2	68.2 Å²	68.2	1%	0.009	41%	0.411	C	S	.	.			trans	-99.2	19	171.2	-65.4	-79	0	0	0	112.9	L621 T622 Q623 V645 L663 V683 L702 R703 L706	L621-F685 HydrophobicContact CB-CE2 4.39Å; L621-F685 HydrophobicContact CD1-CZ 4.26Å; T622-F685 WeakPolarHBondContact O-CD2 3.42Å; Q623-F685 PolarHBondContact O-N 2.89Å; V645-F685 HydrophobicContact CG1-CB 4.2Å; V645-F685 HydrophobicContact CG1-CD2 3.76Å; V645-F685 HydrophobicContact CG1-CE2 4.27Å; V645-F685 HydrophobicContact CG1-CG 3.98Å; V645-F685 HydrophobicContact CG2-CD2 4.49Å; V645-F685 HydrophobicContact CG2-CE1 4.41Å; V645-F685 HydrophobicContact CG2-CE2 4.36Å; V645-F685 HydrophobicContact CG2-CZ 4.31Å; L663-F685 HydrophobicContact CD1-CZ 4.28Å; V683-F685 HydrophobicContact CG1-CD2 4.31Å; V683-F685 HydrophobicContact CG1-CE2 3.76Å; V683-F685 HydrophobicContact CG1-CZ 3.92Å; F685-L702 HydrophobicContact CD1-CB 3.96Å; F685-L702 HydrophobicContact CE1-CB 3.64Å; F685-L702 HydrophobicContact CE1-CD1 4.48Å; F685-L702 HydrophobicContact CZ-CB 4.3Å; F685-L702 HydrophobicContact CZ-CD1 4.46Å; F685-R703 WeakPolarHBondContact O-CD 3.43Å; F685-L706 HydrophobicContact CB-CD2 4.31Å; F685-L706 HydrophobicContact CD1-CB 4.36Å; F685-L706 HydrophobicContact CD1-CD1 4.47Å
686	T	84.1	Confident	77.8	Confident	32 Å²	32	64.9 Å²	64.9	20%	0.196	39%	0.393	C	S	.	.	S	Bend	trans	-97	162.3	173.3	45.2	0	0	0	0	112.6	Q623 D688 R703	Q623-T686 HydrophobicContact CG-CG2 3.86Å; T686-D688 WeakPolarHBondContact CB-O 3.28Å; T686-D688 PolarHBondContact OG1-O 3.19Å; T686-R703 WeakPolarHBondContact O-CB 3.29Å
687	E	75.2	Confident	77.9	Confident	143 Å²	143	64.7 Å²	64.7	67%	0.668	38%	0.384	S	S	*	.	S	Bend	trans	-67.8	-44.9	171.4	-69.8	-170.6	168.2	0	0	111.1	R703	E687-R703 HydrophobicContact CG-CG 4.2Å
688	D	74.8	Confident	77.9	Confident	132 Å²	132	69.1 Å²	69.1	71%	0.706	40%	0.404	S	S	*	.	S	Bend	trans	-98.9	126	177	-59.4	-48.6	0	0	0	110.2	T686	T686-D688 WeakPolarHBondContact CB-O 3.28Å; T686-D688 PolarHBondContact OG1-O 3.19Å
689	A	72.3	Confident	77.8	Confident	17 Å²	17	67.3 Å²	67.3	14%	0.14	39%	0.393	C	S	.	.	P	Polyproline II helix	trans	-101.5	140.1	165.6	0	0	0	0	0	107.7	Y684 Q691 P699 K701	Y684-A689 HydrophobicContact CD2-CB 4.21Å; Y684-A689 HydrophobicContact CG-CB 4.1Å; A689-Q691 PolarHBondContact O-N 3.14Å; A689-P699 HydrophobicContact CB-CB 4.27Å; A689-P699 HydrophobicContact CB-CG 4.19Å; A689-K701 HydrophobicContact CB-CD 4.32Å; A689-K701 HydrophobicContact CB-CG 4.1Å
690	P	75.1	Confident	77.8	Confident	68 Å²	68	65.3 Å²	65.3	44%	0.442	38%	0.379	S	S	.	.	P	Polyproline II helix	trans	-58.3	137.9	177.3	22.7	-30.8	0	0	0	110.3	Y684 L692	Y684-P690 VanDerWaalsContact CE1-CD 3.49Å; Y684-P690 HydrophobicContact CE1-CG 3.91Å; Y684-P690 WeakPolarHBondContact OH-CG 3.46Å; P690-L692 PolarHBondContact O-N 3.26Å
691	Q	66.6	Low	77.8	Confident	202 Å²	202	67.8 Å²	67.8	94%	0.944	38%	0.382	S	S	*	.			trans	-72.6	101.2	173.3	-68.5	-176.4	-1.3	0	0	108.2	A689	A689-Q691 PolarHBondContact O-N 3.14Å
692	L	69.3	Low	77.7	Confident	67 Å²	67	68.1 Å²	68.1	35%	0.351	38%	0.384	S	S	.	.			trans	-82.8	145.7	177.6	-69.8	161.3	0	0	0	110	P690 N696 P699	P690-L692 PolarHBondContact O-N 3.26Å; L692-N696 HydrophobicContact CB-CB 4.11Å; L692-P699 HydrophobicContact CD1-CB 4.39Å; L692-P699 HydrophobicContact CD1-CG 4.33Å
693	P	68.9	Low	77.6	Confident	87 Å²	87	69.1 Å²	69.1	57%	0.565	38%	0.383	S	S	*	.			trans	-60.6	152	175	24	-31.9	0	0	0	111	S695 N696	P693-S695 PolarHBondContact O-N 3.43Å; P693-N696 PolarHBondContact O-N 2.97Å
694	A	62.3	Low	77.3	Confident	113 Å²	113	80.9 Å²	80.9	93%	0.934	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-13.5	-172.9	0	0	0	0	0	115.6
695	S	63	Low	77	Confident	115 Å²	115	81.7 Å²	81.7	80%	0.804	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-17.6	175.4	-174.1	0	0	0	0	113.9	P693	P693-S695 PolarHBondContact O-N 3.43Å
696	N	72.7	Confident	77	Confident	81 Å²	81	82.2 Å²	82.2	43%	0.433	44%	0.436	S	S	.	.	S	Bend	trans	-93.7	148.5	-179.1	-85.2	-14.8	0	0	0	111.4	L692 P693 Q698	L692-N696 HydrophobicContact CB-CB 4.11Å; P693-N696 PolarHBondContact O-N 2.97Å; N696-Q698 PolarHBondContact O-N 2.84Å
697	P	78.3	Confident	76.9	Confident	40 Å²	40	83.5 Å²	83.5	26%	0.26	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-59.1	140.1	176.1	26.2	-34.5	0	0	0	110.4	V678	V678-P697 HydrophobicContact CG2-CB 3.39Å; V678-P697 HydrophobicContact CG2-CG 4.48Å
698	Q	80.6	Confident	77.4	Confident	107 Å²	107	81 Å²	81	50%	0.5	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-64.5	136	-174.5	-74.3	-135.5	-5.1	0	0	111.2	G676 S681 N696	G676-Q698 PolarHBondContact O-N 3.31Å; S681-Q698 WeakPolarHBondContact CB-O 3.33Å; S681-Q698 PolarHBondContact OG-O 3.19Å; N696-Q698 PolarHBondContact O-N 2.84Å
699	P	83.4	Confident	77.9	Confident	29 Å²	29	79.3 Å²	79.3	19%	0.188	43%	0.431	C	S	.	.	P	Polyproline II helix	trans	-72.3	135.8	-179.9	28.5	-33.2	0	0	0	111.4	V682 Y684 A689 L692	V682-P699 WeakPolarHBondContact O-CA 3.22Å; Y684-P699 HydrophobicContact CD2-CB 3.59Å; Y684-P699 HydrophobicContact CE2-CB 3.58Å; A689-P699 HydrophobicContact CB-CB 4.27Å; A689-P699 HydrophobicContact CB-CG 4.19Å; L692-P699 HydrophobicContact CD1-CB 4.39Å; L692-P699 HydrophobicContact CD1-CG 4.33Å
700	L	84.5	Confident	78.7	Confident	4 Å²	4	79.4 Å²	79.4	2%	0.021	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	112.1	179.6	179.9	59.6	0	0	0	111	V628 I667 A670 V682 V683 Y684 L702	V628-L700 HydrophobicContact CG2-CB 4.45Å; V628-L700 HydrophobicContact CG2-CD2 3.87Å; I667-L700 HydrophobicContact CG1-CD2 4.07Å; A670-L700 HydrophobicContact CB-CD1 3.35Å; A670-L700 HydrophobicContact CB-CD2 4.36Å; V682-L700 PolarHBondContact O-N 3.25Å; V683-L700 WeakPolarHBondContact CA-O 3.35Å; V683-L700 HydrophobicContact CG2-CB 4.49Å; V683-L700 HydrophobicContact CG2-CD2 4.36Å; Y684-L700 PolarHBondContact N-O 3.15Å; L700-L702 HydrophobicContact CD1-CD2 4.17Å; L700-L702 HydrophobicContact CD2-CD1 4.13Å; L700-L702 HydrophobicContact CD2-CD2 4.09Å; L700-L702 HydrophobicContact CD2-CG 4.15Å; L700-L702 HydrophobicContact CG-CD1 4.46Å; L700-L702 HydrophobicContact CG-CD2 3.92Å; L700-L702 HydrophobicContact CG-CG 3.96Å; L700-L702 PolarHBondContact O-N 3.42Å
701	K	85.8	Confident	79.3	Confident	117 Å²	117	79.2 Å²	79.2	51%	0.509	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	111.1	179.1	-63.8	-176.3	178.7	-171.7	0	111.7	A689	A689-K701 HydrophobicContact CB-CD 4.32Å; A689-K701 HydrophobicContact CB-CG 4.1Å
702	L	85.1	Confident	80.5	Confident	8 Å²	8	72.6 Å²	72.6	4%	0.042	40%	0.396	C	S	.	.			trans	-113.5	11.3	179.4	-63.4	-171.2	0	0	0	114.3	A666 V683 Y684 F685 L700 R704 I705	A666-L702 HydrophobicContact CB-CD2 3.63Å; V683-L702 HydrophobicContact CG1-CB 4.15Å; V683-L702 HydrophobicContact CG1-CD1 3.54Å; V683-L702 HydrophobicContact CG1-CG 3.85Å; Y684-L702 PolarHBondContact O-N 2.78Å; F685-L702 HydrophobicContact CD1-CB 3.96Å; F685-L702 HydrophobicContact CE1-CB 3.64Å; F685-L702 HydrophobicContact CE1-CD1 4.48Å; F685-L702 HydrophobicContact CZ-CB 4.3Å; F685-L702 HydrophobicContact CZ-CD1 4.46Å; L700-L702 HydrophobicContact CD1-CD2 4.17Å; L700-L702 HydrophobicContact CD2-CD1 4.13Å; L700-L702 HydrophobicContact CD2-CD2 4.09Å; L700-L702 HydrophobicContact CD2-CG 4.15Å; L700-L702 HydrophobicContact CG-CD1 4.46Å; L700-L702 HydrophobicContact CG-CD2 3.92Å; L700-L702 HydrophobicContact CG-CG 3.96Å; L700-L702 PolarHBondContact O-N 3.42Å; L702-R704 PolarHBondContact O-N 2.96Å; L702-I705 HydrophobicContact CB-CD1 4.06Å; L702-I705 HydrophobicContact CB-CG1 3.99Å; L702-I705 HydrophobicContact CD1-CD1 4.14Å; L702-I705 HydrophobicContact CD2-CD1 4.29Å; L702-I705 HydrophobicContact CG-CD1 4.4Å; L702-I705 WeakPolarHBondContact O-CG1 3.29Å; L702-I705 PolarHBondContact O-N 3.07Å; L702-I705 VanDerWaalsContact O-N 3.13Å
703	R	85.4	Confident	81.7	Confident	58 Å²	58	69.9 Å²	69.9	22%	0.219	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-47.6	-37	177	-179.7	69.2	-178.3	82.4	-0.8	115.2	F685 T686 E687 I705 L706	F685-R703 WeakPolarHBondContact O-CD 3.43Å; T686-R703 WeakPolarHBondContact O-CB 3.29Å; E687-R703 HydrophobicContact CG-CG 4.2Å; R703-I705 VanDerWaalsContact C-N 3.32Å; R703-I705 PolarHBondContact O-N 3.37Å; R703-L706 WeakPolarHBondContact O-CB 3.32Å; R703-L706 PolarHBondContact O-N 3.5Å
704	R	81.3	Confident	83	Confident	248 Å²	248	69.3 Å²	69.3	94%	0.936	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-71	-22.7	-174.7	-70.8	-177.3	176	179.5	-0.3	114.2	L702	L702-R704 PolarHBondContact O-N 2.96Å
705	I	83.3	Confident	84.4	Confident	45 Å²	45	64.5 Å²	64.5	23%	0.231	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-92	-9.7	178.3	60.6	162.6	0	0	0	112.5	V658 D662 L663 A666 L702 R703	V658-I705 HydrophobicContact CG2-CD1 3.65Å; V658-I705 HydrophobicContact CG2-CG1 4.02Å; D662-I705 HydrophobicContact CB-CB 4.32Å; D662-I705 HydrophobicContact CB-CG2 4.47Å; L663-I705 HydrophobicContact CB-CD1 4.05Å; A666-I705 HydrophobicContact CB-CD1 4.03Å; A666-I705 HydrophobicContact CB-CG2 4.38Å; L702-I705 HydrophobicContact CB-CD1 4.06Å; L702-I705 HydrophobicContact CB-CG1 3.99Å; L702-I705 HydrophobicContact CD1-CD1 4.14Å; L702-I705 HydrophobicContact CD2-CD1 4.29Å; L702-I705 HydrophobicContact CG-CD1 4.4Å; L702-I705 WeakPolarHBondContact O-CG1 3.29Å; L702-I705 PolarHBondContact O-N 3.07Å; L702-I705 VanDerWaalsContact O-N 3.13Å; R703-I705 VanDerWaalsContact C-N 3.32Å; R703-I705 PolarHBondContact O-N 3.37Å
706	L	84.6	Confident	85.8	Confident	13 Å²	13	64.5 Å²	64.5	7%	0.068	32%	0.323	C	S	.	.			trans	-75.8	126.3	-180	-174.3	67.1	0	0	0	111.2	V645 I655 V658 F685 R703 L708	V645-L706 HydrophobicContact CB-CD1 3.83Å; V645-L706 HydrophobicContact CG2-CD1 3.44Å; V645-L706 VanDerWaalsContact CG2-CD1 3.44Å; I655-L706 HydrophobicContact CG2-CD2 3.92Å; V658-L706 HydrophobicContact CB-CD1 4.42Å; F685-L706 HydrophobicContact CB-CD2 4.31Å; F685-L706 HydrophobicContact CD1-CB 4.36Å; F685-L706 HydrophobicContact CD1-CD1 4.47Å; R703-L706 WeakPolarHBondContact O-CB 3.32Å; R703-L706 PolarHBondContact O-N 3.5Å; L706-L708 HydrophobicContact CD2-CD2 4.03Å; L706-L708 PolarHBondContact O-N 3.04Å
707	N	83.4	Confident	86.7	Confident	59 Å²	59	61.7 Å²	61.7	32%	0.316	31%	0.309	S	S	.	.	B	Isolated β-bridge	trans	-79.8	111.9	163.7	-177.8	5.9	0	0	0	109.1	G656 F657 S709	G656-N707 CarbonylContact C-O 3.45Å; G656-N707 WeakPolarHBondContact CA-O 3.35Å; F657-N707 PolarHBondContact N-O 2.91Å; F657-N707 WeakPolarHBondContact O-CB 3.49Å; F657-N707 PolarHBondContact O-N 3.46Å; N707-S709 VanDerWaalsContact C-N 3.33Å; N707-S709 PolarHBondContact OD1-N 3.22Å; N707-S709 PolarHBondContact OD1-OG 3.16Å
708	L	85.1	Confident	87.4	Confident	91 Å²	91	62.7 Å²	62.7	48%	0.476	32%	0.315	S	S	.	.	S	Bend	trans	-78.5	-16.5	-179.1	-67.8	161.3	0	0	0	114.7	L706 P710	L706-L708 HydrophobicContact CD2-CD2 4.03Å; L706-L708 PolarHBondContact O-N 3.04Å; L708-P710 WeakPolarHBondContact O-CD 3.27Å
709	S	85.3	Confident	87.8	Confident	96 Å²	96	57.6 Å²	57.6	67%	0.671	29%	0.291	S	S	*	.			trans	-124.1	59.5	-175.8	49.9	0	0	0	0	109.1	N707	N707-S709 VanDerWaalsContact C-N 3.33Å; N707-S709 PolarHBondContact OD1-N 3.22Å; N707-S709 PolarHBondContact OD1-OG 3.16Å
710	P	88.1	Confident	88	Confident	20 Å²	20	61.4 Å²	61.4	13%	0.13	31%	0.307	C	S	.	.			trans	-64.9	146	169.2	32	-34.7	0	0	0	108.9	L654 F657 L708 T712 L735	L654-P710 HydrophobicContact CD2-CG 4.1Å; F657-P710 HydrophobicContact CB-CB 3.91Å; F657-P710 HydrophobicContact CB-CG 4.41Å; L708-P710 WeakPolarHBondContact O-CD 3.27Å; P710-T712 PolarHBondContact O-N 3.06Å; P710-L735 HydrophobicContact CB-CD1 3.72Å; P710-L735 HydrophobicContact CG-CD1 3.76Å
711	F	88.9	Confident	88.2	Confident	63 Å²	63	64.3 Å²	64.3	28%	0.276	33%	0.325	S	S	.	.			trans	-69.4	125.6	178.1	-162.4	-79.3	0	0	0	109.8	L45 V713 I725 L729 L731 L735	L45-F711 HydrophobicContact CD1-CD2 4.2Å; F711-V713 HydrophobicContact CE1-CG1 4.03Å; F711-I725 HydrophobicContact CD1-CG2 4Å; F711-I725 HydrophobicContact CE1-CB 4.49Å; F711-I725 HydrophobicContact CE1-CD1 3.86Å; F711-I725 HydrophobicContact CE1-CG1 4.31Å; F711-I725 HydrophobicContact CE1-CG2 3.45Å; F711-I725 VanDerWaalsContact CE1-CG2 3.45Å; F711-I725 HydrophobicContact CE2-CG2 4.45Å; F711-I725 HydrophobicContact CZ-CD1 4.01Å; F711-I725 HydrophobicContact CZ-CG1 4.16Å; F711-I725 HydrophobicContact CZ-CG2 3.7Å; F711-L729 HydrophobicContact CD2-CD1 3.97Å; F711-L729 HydrophobicContact CE2-CD1 3.42Å; F711-L729 VanDerWaalsContact CE2-CD1 3.42Å; F711-L729 HydrophobicContact CZ-CD1 3.99Å; F711-L731 HydrophobicContact CB-CD1 3.76Å; F711-L731 HydrophobicContact CB-CD2 4.4Å; F711-L731 HydrophobicContact CD1-CD1 3.55Å; F711-L731 HydrophobicContact CD2-CD1 4.13Å; F711-L731 HydrophobicContact CE1-CD1 4.2Å; F711-L731 HydrophobicContact CG-CD1 3.51Å; F711-L735 PolarHBondContact O-N 3.46Å
712	T	92.2	Very high	88.4	Confident	63 Å²	63	58.8 Å²	58.8	39%	0.387	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	145.8	-176	48.4	0	0	0	0	111.2	L654 P710 L735 T737	L654-T712 HydrophobicContact CD2-CG2 3.54Å; P710-T712 PolarHBondContact O-N 3.06Å; T712-L735 CarbonylContact C-O 3.54Å; T712-L735 WeakPolarHBondContact CA-O 3.47Å; T712-L735 HydrophobicContact CG2-CB 4.01Å; T712-T737 HydrophobicContact CG2-CG2 3.87Å
713	V	94.5	Very high	88.5	Confident	11 Å²	11	58.4 Å²	58.4	7%	0.067	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	161.2	169.2	-66.9	0	0	0	0	109.5	A605 F711 I725 C734 L735 V736 T737	A605-V713 HydrophobicContact CB-CG2 4.33Å; F711-V713 HydrophobicContact CE1-CG1 4.03Å; V713-I725 HydrophobicContact CG1-CD1 4.08Å; V713-C734 VanDerWaalsContact CG1-SG 3.54Å; V713-C734 VanDerWaalsContact CG2-SG 3.58Å; V713-L735 PolarHBondContact N-O 2.87Å; V713-V736 HydrophobicContact CG2-CG2 3.95Å; V713-V736 WeakPolarHBondContact O-CA 3.24Å; V713-T737 PolarHBondContact O-N 3.43Å
714	T	94.3	Very high	88.5	Confident	75 Å²	75	58 Å²	58	46%	0.46	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	161.2	174	58.5	0	0	0	0	110.7	H716 T717 T737	T714-H716 PolarHBondContact O-N 3.45Å; T714-T717 PolarHBondContact N-OG1 2.65Å; T714-T717 PolarHBondContact O-N 2.9Å; T714-T717 PolarHBondContact O-OG1 3.36Å; T714-T717 PolarHBondContact OG1-OG1 3.39Å; T714-T717 VanDerWaalsContact OG1-OG1 3.09Å; T714-T737 WeakPolarHBondContact CA-O 3.25Å
715	D	92.4	Very high	88.7	Confident	11 Å²	11	47.5 Å²	47.5	6%	0.059	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-26.2	178.8	57.7	-28	0	0	0	113.7	T606 V736 R738 L743	T606-D715 HydrophobicContact CG2-CB 3.45Å; T606-D715 VanDerWaalsContact CG2-CB 3.45Å; T606-D715 VanDerWaalsContact CG2-O 3.32Å; T606-D715 WeakPolarHBondContact CG2-O 3.37Å; T606-D715 PolarHBondContact N-O 2.92Å; T606-D715 PolarHBondContact OG1-O 3.46Å; D715-V736 HydrophobicContact CB-CG1 4.29Å; D715-R738 VanDerWaalsContact OD2-CD 3.29Å; D715-R738 WeakPolarHBondContact OD2-CD 3.34Å; D715-R738 IonicContact OD2-CZ 3.57Å; D715-R738 IonicContact OD2-NE 3.68Å; D715-R738 IonicContact OD2-NH1 2.84Å; D715-R738 PolarHBondContact OD2-NH1 2.92Å; D715-L743 HydrophobicContact CB-CD1 3.85Å
716	H	92.4	Very high	88.7	Confident	116 Å²	116	45.4 Å²	45.4	54%	0.537	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	5.6	179.1	-63.7	-68.5	0	0	0	114.6	T714 P718	T714-H716 PolarHBondContact O-N 3.45Å; H716-P718 WeakPolarHBondContact O-CD 3.4Å
717	T	92.8	Very high	88.4	Confident	21 Å²	21	45.3 Å²	45.3	13%	0.129	25%	0.251	C	S	.	.			trans	-65.3	129.1	176.8	-58.5	0	0	0	0	110.1	A605 T714 T721 V722	A605-T717 PolarHBondContact N-O 3.47Å; T714-T717 PolarHBondContact N-OG1 2.65Å; T714-T717 PolarHBondContact O-N 2.9Å; T714-T717 PolarHBondContact O-OG1 3.36Å; T714-T717 PolarHBondContact OG1-OG1 3.39Å; T714-T717 VanDerWaalsContact OG1-OG1 3.09Å; T717-T721 HydrophobicContact CG2-CG2 4.13Å; T717-V722 HydrophobicContact CG2-CG2 3.84Å
718	P	91.9	Very high	88.1	Confident	61 Å²	61	48.8 Å²	48.8	40%	0.396	26%	0.263	S	S	.	.	B	Isolated β-bridge	trans	-59.9	141.2	173.7	-23.3	33.8	0	0	0	111.9	H716 E720 T721 V722	H716-P718 WeakPolarHBondContact O-CD 3.4Å; P718-E720 PolarHBondContact O-N 3.2Å; P718-T721 WeakPolarHBondContact O-CB 3.34Å; P718-T721 PolarHBondContact O-N 2.88Å; P718-V722 PolarHBondContact O-N 3.02Å; P718-V722 VanDerWaalsContact O-N 3.14Å
719	M	89.7	Confident	87.6	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-62.8	-27.3	179.3	-81.5	-57	-58.2	0	0	113	F599 T603 L604 V608 T721 V722 V723 V751	F599-M719 HydrophobicContact CD1-CB 4.2Å; F599-M719 HydrophobicContact CE1-CB 3.5Å; F599-M719 HydrophobicContact CZ-CB 3.87Å; T603-M719 VanDerWaalsContact O-CB 3.3Å; T603-M719 WeakPolarHBondContact O-CB 3.48Å; T603-M719 WeakPolarHBondContact O-CG 3.47Å; T603-M719 PolarHBondContact O-N 3.12Å; T603-M719 WeakPolarHBondContact OG1-CB 3.28Å; T603-M719 WeakPolarHBondContact OG1-CG 3.49Å; L604-M719 WeakPolarHBondContact O-CG 3.35Å; V608-M719 HydrophobicContact CB-CE 4.13Å; V608-M719 HydrophobicContact CB-SD 3.87Å; V608-M719 HydrophobicContact CG1-CE 4.09Å; V608-M719 HydrophobicContact CG1-SD 4.46Å; V608-M719 HydrophobicContact CG2-CE 3.81Å; V608-M719 HydrophobicContact CG2-CG 3.83Å; V608-M719 HydrophobicContact CG2-SD 3.57Å; V608-M719 VanDerWaalsContact CG2-SD 3.57Å; M719-T721 VanDerWaalsContact C-N 3.32Å; M719-T721 PolarHBondContact O-N 3.15Å; M719-V722 HydrophobicContact CE-CB 4.15Å; M719-V722 HydrophobicContact CE-CG1 4.08Å; M719-V722 PolarHBondContact O-N 3.24Å; M719-V722 HydrophobicContact SD-CB 4Å; M719-V722 HydrophobicContact SD-CG1 4.19Å; M719-V722 HydrophobicContact SD-CG2 4.14Å; M719-V723 HydrophobicContact CE-CG2 4.25Å; M719-V723 WeakPolarHBondContact O-CB 3.15Å; M719-V723 WeakPolarHBondContact O-CG2 3.09Å; M719-V723 PolarHBondContact O-N 3.16Å; M719-V751 HydrophobicContact CE-CG2 4.3Å
720	E	87.3	Confident	87.1	Confident	109 Å²	109	43.4 Å²	43.4	51%	0.509	23%	0.229	S	C	.	.	H	α-helix	trans	-54.4	-50	170.7	-175	-173.3	173.1	0	0	111.1	F599 P718 V722 V723 D724	F599-E720 HydrophobicContact CB-CB 4.41Å; F599-E720 HydrophobicContact CB-CG 4.46Å; F599-E720 HydrophobicContact CD1-CB 4.15Å; P718-E720 PolarHBondContact O-N 3.2Å; E720-V722 PolarHBondContact O-N 3.45Å; E720-V723 PolarHBondContact O-N 2.92Å; E720-D724 WeakPolarHBondContact O-CB 3.26Å; E720-D724 PolarHBondContact O-N 3.36Å
721	T	89.1	Confident	86.6	Confident	65 Å²	65	42.7 Å²	42.7	40%	0.399	22%	0.224	S	C	.	.	H	α-helix	trans	-64.8	-40.3	177.3	-48.2	0	0	0	0	111.7	T717 P718 M719 D724 I725	T717-T721 HydrophobicContact CG2-CG2 4.13Å; P718-T721 WeakPolarHBondContact O-CB 3.34Å; P718-T721 PolarHBondContact O-N 2.88Å; M719-T721 VanDerWaalsContact C-N 3.32Å; M719-T721 PolarHBondContact O-N 3.15Å; T721-D724 PolarHBondContact O-N 3.32Å; T721-I725 HydrophobicContact CG2-CD1 3.99Å; T721-I725 WeakPolarHBondContact O-CB 3.42Å; T721-I725 WeakPolarHBondContact O-CD1 3.27Å; T721-I725 WeakPolarHBondContact O-CG1 3.24Å; T721-I725 PolarHBondContact O-N 3.31Å
722	V	89.6	Confident	86.1	Confident	1 Å²	1	41.6 Å²	41.6	1%	0.006	22%	0.218	C	C	.	.	H	α-helix	trans	-62.4	-48.6	177	178.3	0	0	0	0	110.6	A605 T717 P718 M719 E720 D724 I725 F726 I746	A605-V722 HydrophobicContact CB-CG2 4.12Å; T717-V722 HydrophobicContact CG2-CG2 3.84Å; P718-V722 PolarHBondContact O-N 3.02Å; P718-V722 VanDerWaalsContact O-N 3.14Å; M719-V722 HydrophobicContact CE-CB 4.15Å; M719-V722 HydrophobicContact CE-CG1 4.08Å; M719-V722 PolarHBondContact O-N 3.24Å; M719-V722 HydrophobicContact SD-CB 4Å; M719-V722 HydrophobicContact SD-CG1 4.19Å; M719-V722 HydrophobicContact SD-CG2 4.14Å; E720-V722 PolarHBondContact O-N 3.45Å; V722-D724 VanDerWaalsContact C-N 3.31Å; V722-D724 PolarHBondContact O-N 3.44Å; V722-I725 WeakPolarHBondContact O-CB 3.24Å; V722-I725 PolarHBondContact O-N 3.38Å; V722-I725 VanDerWaalsContact O-N 3.15Å; V722-F726 HydrophobicContact CG1-CD2 3.8Å; V722-F726 HydrophobicContact CG1-CE2 3.79Å; V722-F726 VanDerWaalsContact O-CD2 3.3Å; V722-F726 WeakPolarHBondContact O-CD2 3.39Å; V722-F726 PolarHBondContact O-N 2.93Å; V722-I746 HydrophobicContact CG1-CD1 4.18Å; V722-I746 HydrophobicContact CG1-CG2 4.38Å
723	V	87	Confident	85.9	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-57.6	-46.8	176.4	170.8	0	0	0	0	109.9	L593 F599 M719 E720 I725 F726 R727 V751	L593-V723 HydrophobicContact CD1-CG1 4.4Å; L593-V723 HydrophobicContact CD2-CG1 4.48Å; F599-V723 HydrophobicContact CD2-CG2 4.26Å; F599-V723 HydrophobicContact CG-CG2 4.4Å; M719-V723 HydrophobicContact CE-CG2 4.25Å; M719-V723 WeakPolarHBondContact O-CB 3.15Å; M719-V723 WeakPolarHBondContact O-CG2 3.09Å; M719-V723 PolarHBondContact O-N 3.16Å; E720-V723 PolarHBondContact O-N 2.92Å; V723-I725 VanDerWaalsContact C-N 3.28Å; V723-I725 PolarHBondContact O-N 3.24Å; V723-F726 PolarHBondContact O-N 3.32Å; V723-F726 VanDerWaalsContact O-N 3.15Å; V723-R727 HydrophobicContact CG1-CG 4.28Å; V723-R727 WeakPolarHBondContact O-CB 3.47Å; V723-R727 VanDerWaalsContact O-CG 3.29Å; V723-R727 WeakPolarHBondContact O-CG 3.22Å; V723-R727 PolarHBondContact O-N 3.46Å; V723-V751 HydrophobicContact CG2-CG1 3.67Å
724	D	84.3	Confident	85.8	Confident	49 Å²	49	39.8 Å²	39.8	26%	0.262	21%	0.205	S	C	.	.	H	α-helix	trans	-60.1	-36	177.1	-104.9	21.8	0	0	0	113.5	E720 T721 V722 R727 K728	E720-D724 WeakPolarHBondContact O-CB 3.26Å; E720-D724 PolarHBondContact O-N 3.36Å; T721-D724 PolarHBondContact O-N 3.32Å; V722-D724 VanDerWaalsContact C-N 3.31Å; V722-D724 PolarHBondContact O-N 3.44Å; D724-R727 WeakPolarHBondContact O-CB 3.17Å; D724-R727 IonicContact OD1-NH1 3.18Å; D724-K728 VanDerWaalsContact O-CB 3.28Å; D724-K728 WeakPolarHBondContact O-CB 3.18Å; D724-K728 WeakPolarHBondContact O-CG 3.2Å; D724-K728 PolarHBondContact O-N 3.4Å; D724-K728 IonicContact OD2-NZ 2.79Å; D724-K728 PolarHBondContact OD2-NZ 2.92Å
725	I	86.4	Confident	85.7	Confident	28 Å²	28	36.3 Å²	36.3	14%	0.144	18%	0.183	C	C	.	.	H	α-helix	trans	-66.9	-48.7	173.9	-74.3	161.3	0	0	0	110.3	F711 V713 T721 V722 V723 R727 L729 L731	F711-I725 HydrophobicContact CD1-CG2 4Å; F711-I725 HydrophobicContact CE1-CB 4.49Å; F711-I725 HydrophobicContact CE1-CD1 3.86Å; F711-I725 HydrophobicContact CE1-CG1 4.31Å; F711-I725 HydrophobicContact CE1-CG2 3.45Å; F711-I725 VanDerWaalsContact CE1-CG2 3.45Å; F711-I725 HydrophobicContact CE2-CG2 4.45Å; F711-I725 HydrophobicContact CZ-CD1 4.01Å; F711-I725 HydrophobicContact CZ-CG1 4.16Å; F711-I725 HydrophobicContact CZ-CG2 3.7Å; V713-I725 HydrophobicContact CG1-CD1 4.08Å; T721-I725 HydrophobicContact CG2-CD1 3.99Å; T721-I725 WeakPolarHBondContact O-CB 3.42Å; T721-I725 WeakPolarHBondContact O-CD1 3.27Å; T721-I725 WeakPolarHBondContact O-CG1 3.24Å; T721-I725 PolarHBondContact O-N 3.31Å; V722-I725 WeakPolarHBondContact O-CB 3.24Å; V722-I725 PolarHBondContact O-N 3.38Å; V722-I725 VanDerWaalsContact O-N 3.15Å; V723-I725 VanDerWaalsContact C-N 3.28Å; V723-I725 PolarHBondContact O-N 3.24Å; I725-R727 VanDerWaalsContact C-N 3.26Å; I725-R727 PolarHBondContact O-N 3.02Å; I725-L729 HydrophobicContact CG2-CD1 4.22Å; I725-L729 WeakPolarHBondContact O-CB 3.32Å; I725-L729 PolarHBondContact O-N 2.87Å; I725-L731 HydrophobicContact CG2-CD1 3.36Å; I725-L731 HydrophobicContact CG2-CG 4.17Å
726	F	83.9	Confident	85.8	Confident	2 Å²	2	35.8 Å²	35.8	1%	0.009	18%	0.18	C	C	.	.	H	α-helix	trans	-61	-37.9	177.3	-90.6	-83.8	0	0	0	112.4	L593 V722 V723 G730 L731 C734 I746 K748 V751	L593-F726 HydrophobicContact CD2-CB 4.2Å; V722-F726 HydrophobicContact CG1-CD2 3.8Å; V722-F726 HydrophobicContact CG1-CE2 3.79Å; V722-F726 VanDerWaalsContact O-CD2 3.3Å; V722-F726 WeakPolarHBondContact O-CD2 3.39Å; V722-F726 PolarHBondContact O-N 2.93Å; V723-F726 PolarHBondContact O-N 3.32Å; V723-F726 VanDerWaalsContact O-N 3.15Å; F726-G730 CarbonylContact O-C 3.44Å; F726-G730 WeakPolarHBondContact O-CA 3.49Å; F726-G730 PolarHBondContact O-N 2.82Å; F726-G730 VanDerWaalsContact O-N 3.14Å; F726-L731 HydrophobicContact CD1-CB 4.11Å; F726-L731 WeakPolarHBondContact CD1-O 3.49Å; F726-L731 HydrophobicContact CE1-CB 4.14Å; F726-L731 WeakPolarHBondContact CE1-O 3.46Å; F726-L731 PolarHBondContact O-N 2.86Å; F726-C734 HydrophobicContact CE2-CB 3.82Å; F726-C734 HydrophobicContact CZ-CB 3.86Å; F726-I746 HydrophobicContact CE2-CB 4.35Å; F726-I746 HydrophobicContact CE2-CG2 3.72Å; F726-I746 HydrophobicContact CZ-CB 4.42Å; F726-I746 HydrophobicContact CZ-CG2 3.94Å; F726-I746 WeakPolarHBondContact CZ-O 3.3Å; F726-K748 HydrophobicContact CD1-CB 4.03Å; F726-K748 HydrophobicContact CD1-CG 4.46Å; F726-K748 HydrophobicContact CE1-CB 4.14Å; F726-V751 HydrophobicContact CD2-CG2 3.88Å; F726-V751 HydrophobicContact CE2-CG2 3.99Å; F726-V751 HydrophobicContact CG-CG2 4.29Å; F726-V751 HydrophobicContact CZ-CG2 4.48Å
727	R	78	Confident	85.9	Confident	10 Å²	10	31.1 Å²	31.1	4%	0.038	16%	0.16	C	C	.	.	H	α-helix	trans	-61.1	-80.1	169.5	-82.1	-178.7	-176.7	158.5	-2.7	109.1	Y293 L593 D594 D597 V723 D724 I725 L729 G730	Y293-R727 VanDerWaalsContact CE1-C 3.5Å; Y293-R727 WeakPolarHBondContact CE1-O 3.2Å; Y293-R727 HydrophobicContact CE2-CB 4.12Å; Y293-R727 HydrophobicContact CE2-CG 4.28Å; Y293-R727 WeakPolarHBondContact OH-CA 3.35Å; Y293-R727 WeakPolarHBondContact OH-CB 3.49Å; Y293-R727 PolarHBondContact OH-O 2.84Å; Y293-R727 VanDerWaalsContact OH-O 3.06Å; L593-R727 HydrophobicContact CD2-CG 3.48Å; L593-R727 VanDerWaalsContact CD2-CG 3.48Å; L593-R727 HydrophobicContact CG-CG 3.78Å; D594-R727 PolarHBondContact O-NE 2.74Å; D594-R727 PolarHBondContact O-NH2 3.04Å; D597-R727 PolarHBondContact O-NH1 3.22Å; D597-R727 PolarHBondContact O-NH2 3.38Å; V723-R727 HydrophobicContact CG1-CG 4.28Å; V723-R727 WeakPolarHBondContact O-CB 3.47Å; V723-R727 VanDerWaalsContact O-CG 3.29Å; V723-R727 WeakPolarHBondContact O-CG 3.22Å; V723-R727 PolarHBondContact O-N 3.46Å; D724-R727 WeakPolarHBondContact O-CB 3.17Å; D724-R727 IonicContact OD1-NH1 3.18Å; I725-R727 VanDerWaalsContact C-N 3.26Å; I725-R727 PolarHBondContact O-N 3.02Å; R727-L729 VanDerWaalsContact C-N 3.33Å; R727-L729 PolarHBondContact O-N 2.64Å; R727-G730 PolarHBondContact O-N 3.4Å
728	K	76.3	Confident	86	Confident	133 Å²	133	36.6 Å²	36.6	58%	0.578	18%	0.179	S	C	*	.	H	α-helix	trans	-61.3	-35.8	-164.5	-69.1	167.1	176.7	160.3	0	113.8	Y293 D724	Y293-K728 WeakPolarHBondContact OH-CA 3.4Å; Y293-K728 PolarHBondContact OH-N 2.74Å; D724-K728 VanDerWaalsContact O-CB 3.28Å; D724-K728 WeakPolarHBondContact O-CB 3.18Å; D724-K728 WeakPolarHBondContact O-CG 3.2Å; D724-K728 PolarHBondContact O-N 3.4Å; D724-K728 IonicContact OD2-NZ 2.79Å; D724-K728 PolarHBondContact OD2-NZ 2.92Å
729	L	76.2	Confident	85.9	Confident	66 Å²	66	39.7 Å²	39.7	35%	0.346	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-9.3	179	-56.8	-179.1	0	0	0	112.9	F711 I725 R727 L731	F711-L729 HydrophobicContact CD2-CD1 3.97Å; F711-L729 HydrophobicContact CE2-CD1 3.42Å; F711-L729 VanDerWaalsContact CE2-CD1 3.42Å; F711-L729 HydrophobicContact CZ-CD1 3.99Å; I725-L729 HydrophobicContact CG2-CD1 4.22Å; I725-L729 WeakPolarHBondContact O-CB 3.32Å; I725-L729 PolarHBondContact O-N 2.87Å; R727-L729 VanDerWaalsContact C-N 3.33Å; R727-L729 PolarHBondContact O-N 2.64Å; L729-L731 HydrophobicContact CB-CD2 3.82Å; L729-L731 HydrophobicContact CB-CG 3.93Å; L729-L731 HydrophobicContact CD1-CD2 4.47Å; L729-L731 PolarHBondContact O-N 3.23Å
730	G	73	Confident	85.9	Confident	8 Å²	8	41.6 Å²	41.6	8%	0.082	22%	0.221	C	C	.	.			trans	61.2	29.4	-179	0	0	0	0	0	114	F726 R727 R732	F726-G730 CarbonylContact O-C 3.44Å; F726-G730 WeakPolarHBondContact O-CA 3.49Å; F726-G730 PolarHBondContact O-N 2.82Å; F726-G730 VanDerWaalsContact O-N 3.14Å; R727-G730 PolarHBondContact O-N 3.4Å; G730-R732 PolarHBondContact O-N 3.02Å
731	L	78.4	Confident	86.2	Confident	4 Å²	4	42.2 Å²	42.2	2%	0.021	22%	0.218	C	C	.	.			trans	-57.5	142.2	-172.7	-59	-174.9	0	0	0	111.9	L45 F711 I725 F726 L729 C734	L45-L731 HydrophobicContact CD1-CD2 3.46Å; L45-L731 VanDerWaalsContact CD1-CD2 3.46Å; L45-L731 HydrophobicContact CG-CD2 4.05Å; F711-L731 HydrophobicContact CB-CD1 3.76Å; F711-L731 HydrophobicContact CB-CD2 4.4Å; F711-L731 HydrophobicContact CD1-CD1 3.55Å; F711-L731 HydrophobicContact CD2-CD1 4.13Å; F711-L731 HydrophobicContact CE1-CD1 4.2Å; F711-L731 HydrophobicContact CG-CD1 3.51Å; I725-L731 HydrophobicContact CG2-CD1 3.36Å; I725-L731 HydrophobicContact CG2-CG 4.17Å; F726-L731 HydrophobicContact CD1-CB 4.11Å; F726-L731 WeakPolarHBondContact CD1-O 3.49Å; F726-L731 HydrophobicContact CE1-CB 4.14Å; F726-L731 WeakPolarHBondContact CE1-O 3.46Å; F726-L731 PolarHBondContact O-N 2.86Å; L729-L731 HydrophobicContact CB-CD2 3.82Å; L729-L731 HydrophobicContact CB-CG 3.93Å; L729-L731 HydrophobicContact CD1-CD2 4.47Å; L729-L731 PolarHBondContact O-N 3.23Å; L731-C734 HydrophobicContact CD1-CB 4.44Å
732	R	79.2	Confident	86.4	Confident	40 Å²	40	39.5 Å²	39.5	15%	0.151	20%	0.201	C	C	.	.	S	Bend	trans	-70.1	-42.7	167.9	170.1	165.6	-160.6	-176.6	10.6	111.3	T41 N641 G730 K748	T41-R732 WeakPolarHBondContact OG1-CD 3.41Å; T41-R732 WeakPolarHBondContact OG1-CG 3.17Å; T41-R732 PolarHBondContact OG1-NE 3.42Å; N641-R732 PolarHBondContact ND2-NH2 3.01Å; N641-R732 VanDerWaalsContact ND2-NH2 3.14Å; G730-R732 PolarHBondContact O-N 3.02Å; R732-K748 PolarHBondContact O-N 3.11Å
733	Q	87.8	Confident	86.5	Confident	35 Å²	35	42.2 Å²	42.2	16%	0.164	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	158.7	-174.1	70.8	-148.9	12.6	0	0	109.8	F657 I745 I746 T747	F657-Q733 VanDerWaalsContact CD1-NE2 3.32Å; Q733-I745 HydrophobicContact CB-CD1 4Å; Q733-I745 HydrophobicContact CB-CG1 4.14Å; Q733-I745 HydrophobicContact CG-CD1 4.12Å; Q733-I746 CarbonylContact C-O 3.55Å; Q733-I746 WeakPolarHBondContact CA-O 3.41Å; Q733-T747 HydrophobicContact CB-CG2 4.32Å
734	C	91.3	Very high	86.8	Confident	1 Å²	1	42.2 Å²	42.2	1%	0.007	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	136.2	176.4	179.5	0	0	0	0	108.8	V713 F726 L731 I746	V713-C734 VanDerWaalsContact CG1-SG 3.54Å; V713-C734 VanDerWaalsContact CG2-SG 3.58Å; F726-C734 HydrophobicContact CE2-CB 3.82Å; F726-C734 HydrophobicContact CZ-CB 3.86Å; L731-C734 HydrophobicContact CD1-CB 4.44Å; C734-I746 PolarHBondContact N-O 3.49Å; C734-I746 PolarHBondContact O-N 3.45Å
735	L	93.4	Very high	87.2	Confident	2 Å²	2	40.9 Å²	40.9	1%	0.01	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	135.1	178.7	-61.1	176	0	0	0	109.8	P644 L654 F657 P710 F711 T712 V713 L742 I745	P644-L735 HydrophobicContact CB-CD2 4.4Å; L654-L735 HydrophobicContact CD1-CD1 3.68Å; L654-L735 HydrophobicContact CD2-CB 4.28Å; L654-L735 HydrophobicContact CD2-CD1 3.6Å; L654-L735 HydrophobicContact CG-CD1 4.28Å; F657-L735 HydrophobicContact CD2-CD1 4.33Å; F657-L735 HydrophobicContact CD2-CD2 4.31Å; P710-L735 HydrophobicContact CB-CD1 3.72Å; P710-L735 HydrophobicContact CG-CD1 3.76Å; F711-L735 PolarHBondContact O-N 3.46Å; T712-L735 CarbonylContact C-O 3.54Å; T712-L735 WeakPolarHBondContact CA-O 3.47Å; T712-L735 HydrophobicContact CG2-CB 4.01Å; V713-L735 PolarHBondContact N-O 2.87Å; L735-L742 HydrophobicContact CB-CD1 4.06Å; L735-L742 HydrophobicContact CD2-CD1 4.15Å; L735-L742 HydrophobicContact CG-CD1 4.48Å; L735-I745 HydrophobicContact CD2-CB 4.1Å; L735-I745 HydrophobicContact CD2-CD1 3.85Å; L735-I745 HydrophobicContact CD2-CG1 3.88Å
736	V	94.9	Very high	87.5	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	124.4	176.6	-172.9	0	0	0	0	108.6	M609 V713 D715 L743 G744 I746	M609-V736 HydrophobicContact CB-CB 4.43Å; M609-V736 HydrophobicContact CB-CG2 3.8Å; M609-V736 HydrophobicContact SD-CB 3.76Å; M609-V736 HydrophobicContact SD-CG1 3.63Å; M609-V736 HydrophobicContact SD-CG2 4.12Å; V713-V736 HydrophobicContact CG2-CG2 3.95Å; V713-V736 WeakPolarHBondContact O-CA 3.24Å; D715-V736 HydrophobicContact CB-CG1 4.29Å; V736-L743 PolarHBondContact O-N 3.22Å; V736-G744 PolarHBondContact N-O 3.26Å; V736-G744 PolarHBondContact O-N 2.98Å; V736-I746 HydrophobicContact CG2-CD1 3.56Å; V736-I746 HydrophobicContact CG2-CG1 3.76Å
737	T	94.3	Very high	87.7	Confident	18 Å²	18	41.3 Å²	41.3	11%	0.11	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	149.2	-176.1	63.7	0	0	0	0	111.7	L654 T712 V713 T714 R741	L654-T737 HydrophobicContact CD2-CG2 3.82Å; T712-T737 HydrophobicContact CG2-CG2 3.87Å; V713-T737 PolarHBondContact O-N 3.43Å; T714-T737 WeakPolarHBondContact CA-O 3.25Å; T737-R741 CarbonylContact C-O 3.53Å; T737-R741 WeakPolarHBondContact CA-O 3.36Å; T737-R741 WeakPolarHBondContact CB-O 3.25Å
738	R	94.1	Very high	87.8	Confident	137 Å²	137	41.3 Å²	41.3	52%	0.517	21%	0.213	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	115.9	170.5	-175.5	-175.3	-176	140.7	-10.5	108.9	D715 G740 R741 L743	D715-R738 VanDerWaalsContact OD2-CD 3.29Å; D715-R738 WeakPolarHBondContact OD2-CD 3.34Å; D715-R738 IonicContact OD2-CZ 3.57Å; D715-R738 IonicContact OD2-NE 3.68Å; D715-R738 IonicContact OD2-NH1 2.84Å; D715-R738 PolarHBondContact OD2-NH1 2.92Å; R738-G740 PolarHBondContact O-N 3.03Å; R738-G740 VanDerWaalsContact O-N 3.15Å; R738-R741 PolarHBondContact N-O 2.92Å; R738-R741 WeakPolarHBondContact O-CB 3.45Å; R738-R741 PolarHBondContact O-N 3.38Å; R738-L743 HydrophobicContact CB-CD1 3.6Å; R738-L743 HydrophobicContact CB-CG 4.17Å
739	S	90.6	Very high	87.9	Confident	126 Å²	126	39.2 Å²	39.2	88%	0.881	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.4	37.8	-177.5	-53.6	0	0	0	0	113.3	R741	S739-R741 VanDerWaalsContact C-N 3.3Å; S739-R741 PolarHBondContact O-N 3.4Å
740	G	88.3	Confident	88.4	Confident	39 Å²	39	37 Å²	37	40%	0.402	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	83	-8.2	-179.3	0	0	0	0	0	115.7	R653 L654 R738	R653-G740 WeakPolarHBondContact CA-O 3.4Å; L654-G740 PolarHBondContact N-O 3.35Å; R738-G740 PolarHBondContact O-N 3.03Å; R738-G740 VanDerWaalsContact O-N 3.15Å
741	R	93.3	Very high	89	Confident	122 Å²	122	36.6 Å²	36.6	46%	0.46	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	133.1	171.4	-171.1	176.4	175.3	171.7	1	110.2	E652 T737 R738 S739	E652-R741 HydrophobicContact CB-CG 3.88Å; E652-R741 IonicContact OE2-CZ 3.22Å; E652-R741 IonicContact OE2-NE 2.85Å; E652-R741 PolarHBondContact OE2-NE 3.43Å; E652-R741 IonicContact OE2-NH2 2.72Å; E652-R741 PolarHBondContact OE2-NH2 3.41Å; T737-R741 CarbonylContact C-O 3.53Å; T737-R741 WeakPolarHBondContact CA-O 3.36Å; T737-R741 WeakPolarHBondContact CB-O 3.25Å; R738-R741 PolarHBondContact N-O 2.92Å; R738-R741 WeakPolarHBondContact O-CB 3.45Å; R738-R741 PolarHBondContact O-N 3.38Å; S739-R741 VanDerWaalsContact C-N 3.3Å; S739-R741 PolarHBondContact O-N 3.4Å
742	L	94.1	Very high	89	Confident	8 Å²	8	37.1 Å²	37.1	4%	0.042	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	122.5	175.3	-178.6	66	0	0	0	109.8	L618 V620 P644 V646 E652 L654 L735	L618-L742 HydrophobicContact CD2-CD2 3.82Å; L618-L742 HydrophobicContact CD2-CG 4.25Å; V620-L742 HydrophobicContact CG1-CD2 4.11Å; P644-L742 HydrophobicContact CB-CD2 3.58Å; P644-L742 HydrophobicContact CG-CD2 3.57Å; V646-L742 HydrophobicContact CG1-CB 4.34Å; V646-L742 HydrophobicContact CG1-CD2 3.94Å; E652-L742 WeakPolarHBondContact O-CB 3.29Å; E652-L742 PolarHBondContact O-N 2.99Å; L654-L742 HydrophobicContact CB-CB 4.46Å; L654-L742 HydrophobicContact CD1-CD1 4.45Å; L735-L742 HydrophobicContact CB-CD1 4.06Å; L735-L742 HydrophobicContact CD2-CD1 4.15Å; L735-L742 HydrophobicContact CG-CD1 4.48Å
743	L	92.5	Very high	89	Confident	58 Å²	58	38.1 Å²	38.1	30%	0.304	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	-36.7	176.3	-64.8	179.4	0	0	0	112.1	M609 D715 V736 R738	M609-L743 HydrophobicContact CE-CB 4.03Å; M609-L743 HydrophobicContact SD-CB 4.04Å; D715-L743 HydrophobicContact CB-CD1 3.85Å; V736-L743 PolarHBondContact O-N 3.22Å; R738-L743 HydrophobicContact CB-CD1 3.6Å; R738-L743 HydrophobicContact CB-CG 4.17Å
744	G	92.8	Very high	88.7	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.1	-175.5	-175.8	0	0	0	0	0	113.6	R610 V736	R610-G744 CarbonylContact O-C 3.42Å; R610-G744 WeakPolarHBondContact O-CA 3.44Å; V736-G744 PolarHBondContact N-O 3.26Å; V736-G744 PolarHBondContact O-N 2.98Å
745	I	92.8	Very high	88.1	Confident	22 Å²	22	38.4 Å²	38.4	11%	0.113	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	139.6	176.3	-169.7	164.5	0	0	0	108.8	R610 L618 F657 Q733 L735 T747	R610-I745 PolarHBondContact N-O 2.99Å; R610-I745 PolarHBondContact O-N 2.92Å; L618-I745 HydrophobicContact CD1-CG2 3.75Å; F657-I745 HydrophobicContact CE2-CD1 4.17Å; Q733-I745 HydrophobicContact CB-CD1 4Å; Q733-I745 HydrophobicContact CB-CG1 4.14Å; Q733-I745 HydrophobicContact CG-CD1 4.12Å; L735-I745 HydrophobicContact CD2-CB 4.1Å; L735-I745 HydrophobicContact CD2-CD1 3.85Å; L735-I745 HydrophobicContact CD2-CG1 3.88Å; I745-T747 HydrophobicContact CG1-CG2 4.47Å
746	I	92.1	Very high	87.2	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	129.2	168.3	-63.4	169.7	0	0	0	106.1	A605 V608 M609 V722 F726 Q733 C734 V736 V751	A605-I746 HydrophobicContact CB-CD1 3.92Å; V608-I746 HydrophobicContact CG1-CG2 4.48Å; M609-I746 HydrophobicContact CB-CD1 4.29Å; M609-I746 HydrophobicContact CB-CG1 3.75Å; V722-I746 HydrophobicContact CG1-CD1 4.18Å; V722-I746 HydrophobicContact CG1-CG2 4.38Å; F726-I746 HydrophobicContact CE2-CB 4.35Å; F726-I746 HydrophobicContact CE2-CG2 3.72Å; F726-I746 HydrophobicContact CZ-CB 4.42Å; F726-I746 HydrophobicContact CZ-CG2 3.94Å; F726-I746 WeakPolarHBondContact CZ-O 3.3Å; Q733-I746 CarbonylContact C-O 3.55Å; Q733-I746 WeakPolarHBondContact CA-O 3.41Å; C734-I746 PolarHBondContact N-O 3.49Å; C734-I746 PolarHBondContact O-N 3.45Å; V736-I746 HydrophobicContact CG2-CD1 3.56Å; V736-I746 HydrophobicContact CG2-CG1 3.76Å; I746-V751 HydrophobicContact CG2-CG2 3.68Å
747	T	87.9	Confident	86.3	Confident	38 Å²	38	41.8 Å²	41.8	23%	0.233	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	163.7	171.7	71	0	0	0	0	110.8	Q733 I745 K749 D750 V751	Q733-T747 HydrophobicContact CB-CG2 4.32Å; I745-T747 HydrophobicContact CG1-CG2 4.47Å; T747-K749 PolarHBondContact O-N 2.86Å; T747-K749 VanDerWaalsContact O-N 3.15Å; T747-K749 PolarHBondContact OG1-N 3.46Å; T747-D750 WeakPolarHBondContact CB-OD2 3.31Å; T747-D750 PolarHBondContact N-OD2 3.13Å; T747-D750 PolarHBondContact O-N 3.12Å; T747-D750 PolarHBondContact OG1-N 3.26Å; T747-D750 PolarHBondContact OG1-OD2 3.42Å; T747-V751 PolarHBondContact O-N 3.34Å
748	K	80.9	Confident	85.4	Confident	11 Å²	11	44.2 Å²	44.2	5%	0.048	22%	0.223	C	C	.	.	H	α-helix	trans	-56.1	-30.5	173.3	-170.1	169.8	-178.9	-179.1	0	111.9	T41 S200 F202 F726 R732 L752	T41-K748 HydrophobicContact CG2-CD 4.43Å; S200-K748 PolarHBondContact O-NZ 2.99Å; S200-K748 PolarHBondContact OG-NZ 2.91Å; F202-K748 HydrophobicContact CE1-CD 4.44Å; F202-K748 HydrophobicContact CE2-CD 4.05Å; F202-K748 VanDerWaalsContact CE2-CE 3.46Å; F202-K748 HydrophobicContact CZ-CD 3.53Å; F202-K748 VanDerWaalsContact CZ-CE 3.44Å; F202-K748 HydrophobicContact CZ-CG 4.22Å; F726-K748 HydrophobicContact CD1-CB 4.03Å; F726-K748 HydrophobicContact CD1-CG 4.46Å; F726-K748 HydrophobicContact CE1-CB 4.14Å; R732-K748 PolarHBondContact O-N 3.11Å; K748-L752 HydrophobicContact CG-CD1 4.47Å; K748-L752 WeakPolarHBondContact O-CG 3.16Å; K748-L752 PolarHBondContact O-N 3.21Å; K748-L752 VanDerWaalsContact O-N 3.14Å
749	K	79	Confident	84.1	Confident	89 Å²	89	42.7 Å²	42.7	39%	0.387	22%	0.223	S	C	.	.	H	α-helix	trans	-67	-41.9	176	-62.2	-171.3	178.1	-164.5	0	111.9	Y36 T747 V751 L752 R753	Y36-K749 HydrophobicContact CD1-CD 4.21Å; Y36-K749 HydrophobicContact CD1-CG 4.43Å; Y36-K749 HydrophobicContact CE1-CG 4.49Å; Y36-K749 PolarHBondContact O-NZ 3.43Å; T747-K749 PolarHBondContact O-N 2.86Å; T747-K749 VanDerWaalsContact O-N 3.15Å; T747-K749 PolarHBondContact OG1-N 3.46Å; K749-V751 VanDerWaalsContact C-N 3.33Å; K749-V751 PolarHBondContact O-N 2.03Å; K749-L752 PolarHBondContact O-N 2.03Å; K749-R753 WeakPolarHBondContact O-CB 3.25Å; K749-R753 PolarHBondContact O-N 3.27Å
750	D	85.3	Confident	82.9	Confident	18 Å²	18	44.3 Å²	44.3	10%	0.096	22%	0.222	C	C	.	.	H	α-helix	trans	-65.8	-38.8	179.3	-58	-55.8	0	0	0	111.5	V608 T747 R753 H754	V608-D750 HydrophobicContact CG1-CB 4.06Å; T747-D750 WeakPolarHBondContact CB-OD2 3.31Å; T747-D750 PolarHBondContact N-OD2 3.13Å; T747-D750 PolarHBondContact O-N 3.12Å; T747-D750 PolarHBondContact OG1-N 3.26Å; T747-D750 PolarHBondContact OG1-OD2 3.42Å; D750-R753 PolarHBondContact O-N 3.23Å; D750-H754 WeakPolarHBondContact O-CB 3.48Å; D750-H754 PolarHBondContact O-N 3.45Å
751	V	85.4	Confident	81.6	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-61.5	-49.8	174.6	178.4	0	0	0	0	111.1	M719 V723 F726 I746 T747 K749 R753 H754 M755	M719-V751 HydrophobicContact CE-CG2 4.3Å; V723-V751 HydrophobicContact CG2-CG1 3.67Å; F726-V751 HydrophobicContact CD2-CG2 3.88Å; F726-V751 HydrophobicContact CE2-CG2 3.99Å; F726-V751 HydrophobicContact CG-CG2 4.29Å; F726-V751 HydrophobicContact CZ-CG2 4.48Å; I746-V751 HydrophobicContact CG2-CG2 3.68Å; T747-V751 PolarHBondContact O-N 3.34Å; K749-V751 VanDerWaalsContact C-N 3.33Å; K749-V751 PolarHBondContact O-N 2.03Å; V751-R753 PolarHBondContact O-N 2.75Å; V751-H754 PolarHBondContact O-N 3.06Å; V751-M755 HydrophobicContact CG1-SD 4.17Å; V751-M755 WeakPolarHBondContact O-CG 3.45Å; V751-M755 PolarHBondContact O-N 3.44Å
752	L	80	Confident	79.6	Confident	15 Å²	15	45.7 Å²	45.7	8%	0.079	23%	0.227	C	C	.	.	H	α-helix	trans	-61.8	-43.9	179.1	-71.1	170.7	0	0	0	111.8	P591 L593 K748 K749 H754 M755 A756	P591-L752 HydrophobicContact CB-CD1 3.57Å; L593-L752 HydrophobicContact CB-CD2 4.19Å; L593-L752 HydrophobicContact CD1-CD2 4.02Å; K748-L752 HydrophobicContact CG-CD1 4.47Å; K748-L752 WeakPolarHBondContact O-CG 3.16Å; K748-L752 PolarHBondContact O-N 3.21Å; K748-L752 VanDerWaalsContact O-N 3.14Å; K749-L752 PolarHBondContact O-N 2.03Å; L752-H754 VanDerWaalsContact C-N 3.34Å; L752-H754 PolarHBondContact O-N 3.18Å; L752-M755 PolarHBondContact O-N 3.01Å; L752-A756 PolarHBondContact O-N 3.06Å
753	R	78.5	Confident	77.6	Confident	62 Å²	62	47 Å²	47	23%	0.234	24%	0.236	C	C	.	.	H	α-helix	trans	-62	-43	177.1	-172.3	-176.1	-73.5	153.8	-14.2	111.4	K749 D750 V751 A756 Q757 P763 M767	K749-R753 WeakPolarHBondContact O-CB 3.25Å; K749-R753 PolarHBondContact O-N 3.27Å; D750-R753 PolarHBondContact O-N 3.23Å; V751-R753 PolarHBondContact O-N 2.75Å; R753-A756 WeakPolarHBondContact O-CB 3.41Å; R753-A756 PolarHBondContact O-N 3.39Å; R753-Q757 WeakPolarHBondContact O-CG 3.21Å; R753-Q757 PolarHBondContact O-N 2.96Å; R753-P763 HydrophobicContact CG-CB 3.84Å; R753-M767 PolarHBondContact NH2-SD 2.88Å
754	H	81.9	Confident	75.6	Confident	15 Å²	15	49.1 Å²	49.1	7%	0.069	24%	0.244	C	C	.	.	H	α-helix	trans	-62.1	-44.3	177.1	-175	66.1	0	0	0	111.7	F599 T603 V608 D750 V751 L752 A756 Q757 M758	F599-H754 AromaticContact CZ-CD2 3.98Å; F599-H754 AromaticContact CZ-NE2 4Å; T603-H754 PolarHBondContact OG1-NE2 3.48Å; V608-H754 HydrophobicContact CG1-CB 4.05Å; V608-H754 HydrophobicContact CG2-CB 4.04Å; V608-H754 VanDerWaalsContact CG2-CG 3.48Å; D750-H754 WeakPolarHBondContact O-CB 3.48Å; D750-H754 PolarHBondContact O-N 3.45Å; V751-H754 PolarHBondContact O-N 3.06Å; L752-H754 VanDerWaalsContact C-N 3.34Å; L752-H754 PolarHBondContact O-N 3.18Å; H754-A756 VanDerWaalsContact C-N 3.31Å; H754-A756 PolarHBondContact O-N 3.12Å; H754-Q757 PolarHBondContact O-N 3.05Å; H754-M758 WeakPolarHBondContact O-CG 3.06Å; H754-M758 PolarHBondContact O-N 3.01Å
755	M	78.4	Confident	73.5	Confident	27 Å²	27	52.1 Å²	52.1	13%	0.133	27%	0.265	C	S	.	.	H	α-helix	trans	-59.8	-42	175.7	-70.3	177.2	67.6	0	0	111.9	L593 F599 V751 L752 M758 M759	L593-M755 HydrophobicContact CD1-CE 4.03Å; L593-M755 HydrophobicContact CD1-SD 3.4Å; L593-M755 WeakPolarHBondContact CD1-SD 3.48Å; F599-M755 HydrophobicContact CD2-CG 4.25Å; F599-M755 HydrophobicContact CE2-CG 4.1Å; V751-M755 HydrophobicContact CG1-SD 4.17Å; V751-M755 WeakPolarHBondContact O-CG 3.45Å; V751-M755 PolarHBondContact O-N 3.44Å; L752-M755 PolarHBondContact O-N 3.01Å; M755-M758 PolarHBondContact O-N 3.09Å; M755-M759 WeakPolarHBondContact O-CG 3.48Å; M755-M759 PolarHBondContact O-N 3.04Å; M755-M759 VanDerWaalsContact O-N 3.09Å
756	A	74.4	Confident	71.5	Confident	2 Å²	2	53 Å²	53	2%	0.017	27%	0.27	C	S	.	.	H	α-helix	trans	-60.8	-46.5	176.2	0	0	0	0	0	112.8	L752 R753 H754 M758 M759 N760 Q761 I766	L752-A756 PolarHBondContact O-N 3.06Å; R753-A756 WeakPolarHBondContact O-CB 3.41Å; R753-A756 PolarHBondContact O-N 3.39Å; H754-A756 VanDerWaalsContact C-N 3.31Å; H754-A756 PolarHBondContact O-N 3.12Å; A756-M758 VanDerWaalsContact C-N 3.29Å; A756-M758 PolarHBondContact O-N 3.2Å; A756-M759 PolarHBondContact O-N 2.95Å; A756-M759 VanDerWaalsContact O-N 3.07Å; A756-N760 PolarHBondContact O-N 3.46Å; A756-Q761 PolarHBondContact O-N 3.45Å; A756-Q761 VanDerWaalsContact O-N 3.08Å; A756-I766 HydrophobicContact CB-CD1 3.28Å; A756-I766 HydrophobicContact CB-CG1 4.08Å
757	Q	76.9	Confident	69.1	Low	71 Å²	71	56.4 Å²	56.4	33%	0.332	29%	0.286	S	S	.	.	H	α-helix	trans	-58.5	-43.8	177.1	-71	177.6	-12.7	0	0	111.1	R753 H754 M759 N760 P763	R753-Q757 WeakPolarHBondContact O-CG 3.21Å; R753-Q757 PolarHBondContact O-N 2.96Å; H754-Q757 PolarHBondContact O-N 3.05Å; Q757-M759 PolarHBondContact O-N 3.05Å; Q757-N760 PolarHBondContact O-N 2.98Å; Q757-P763 HydrophobicContact CG-CB 3.61Å; Q757-P763 HydrophobicContact CG-CG 3.88Å
758	M	73.8	Confident	66.8	Low	68 Å²	68	60.3 Å²	60.3	34%	0.335	30%	0.3	S	S	.	.	H	α-helix	trans	-66.7	-25.8	178.5	-67.8	-54.8	-60.7	0	0	113	H601 H754 M755 A756 N760	H601-M758 HydrophobicContact CB-CE 4.02Å; H601-M758 VanDerWaalsContact CE1-CE 3.47Å; H601-M758 WeakPolarHBondContact CE1-CE 3.47Å; H601-M758 VanDerWaalsContact CG-CE 3.44Å; H601-M758 WeakPolarHBondContact ND1-CE 3.12Å; H754-M758 WeakPolarHBondContact O-CG 3.06Å; H754-M758 PolarHBondContact O-N 3.01Å; M755-M758 PolarHBondContact O-N 3.09Å; A756-M758 VanDerWaalsContact C-N 3.29Å; A756-M758 PolarHBondContact O-N 3.2Å; M758-N760 VanDerWaalsContact C-N 3.29Å; M758-N760 PolarHBondContact O-N 3.12Å
759	M	67.4	Low	64.4	Low	105 Å²	105	66.2 Å²	66.2	52%	0.517	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	7.6	176.2	-68.7	178.7	68.7	0	0	113.7	M755 A756 Q757 Q761	M755-M759 WeakPolarHBondContact O-CG 3.48Å; M755-M759 PolarHBondContact O-N 3.04Å; M755-M759 VanDerWaalsContact O-N 3.09Å; A756-M759 PolarHBondContact O-N 2.95Å; A756-M759 VanDerWaalsContact O-N 3.07Å; Q757-M759 PolarHBondContact O-N 3.05Å; M759-Q761 HydrophobicContact CB-CG 4.11Å; M759-Q761 PolarHBondContact O-N 3.37Å; M759-Q761 VanDerWaalsContact O-N 3.12Å
760	N	64.4	Low	63.7	Low	160 Å²	160	65.1 Å²	65.1	86%	0.856	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	26	-170.8	-67.4	-27.1	0	0	0	113.2	A756 Q757 M758	A756-N760 PolarHBondContact O-N 3.46Å; Q757-N760 PolarHBondContact O-N 2.98Å; M758-N760 VanDerWaalsContact C-N 3.29Å; M758-N760 PolarHBondContact O-N 3.12Å
761	Q	62.2	Low	62.6	Low	72 Å²	72	67.6 Å²	67.6	34%	0.336	34%	0.342	S	S	.	.			trans	-86.4	142.9	168.6	-66.5	179.7	-7.5	0	0	107.6	A756 M759 P763	A756-Q761 PolarHBondContact O-N 3.45Å; A756-Q761 VanDerWaalsContact O-N 3.08Å; M759-Q761 HydrophobicContact CB-CG 4.11Å; M759-Q761 PolarHBondContact O-N 3.37Å; M759-Q761 VanDerWaalsContact O-N 3.12Å; Q761-P763 VanDerWaalsContact O-CD 3.26Å; Q761-P763 WeakPolarHBondContact O-CD 3.01Å
762	D	51.3	Low	61.3	Low	118 Å²	118	71.3 Å²	71.3	63%	0.631	36%	0.361	S	S	*	.			trans	-56.6	118.3	176.1	-87.9	-32.2	0	0	0	107.8	E764 S765	D762-E764 PolarHBondContact O-N 2.91Å; D762-E764 VanDerWaalsContact O-N 3.08Å; D762-S765 WeakPolarHBondContact O-CA 3.27Å; D762-S765 VanDerWaalsContact O-CB 3.32Å; D762-S765 WeakPolarHBondContact O-CB 2.88Å; D762-S765 PolarHBondContact O-N 3.46Å; D762-S765 PolarHBondContact O-OG 3.17Å
763	P	52.8	Low	60.2	Low	35 Å²	35	74.6 Å²	74.6	23%	0.227	38%	0.378	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-23.4	-179.4	19.8	-29.8	0	0	0	112.3	R753 Q757 Q761	R753-P763 HydrophobicContact CG-CB 3.84Å; Q757-P763 HydrophobicContact CG-CB 3.61Å; Q757-P763 HydrophobicContact CG-CG 3.88Å; Q761-P763 VanDerWaalsContact O-CD 3.26Å; Q761-P763 WeakPolarHBondContact O-CD 3.01Å
764	E	50.6	Low	59.1	Low	104 Å²	104	75.4 Å²	75.4	49%	0.486	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-16.5	173.1	-52	-140.5	150.6	0	0	112.5	D762 I766 M767 F768	D762-E764 PolarHBondContact O-N 2.91Å; D762-E764 VanDerWaalsContact O-N 3.08Å; E764-I766 PolarHBondContact O-N 2.64Å; E764-M767 CarbonylContact O-C 3.48Å; E764-M767 WeakPolarHBondContact O-CA 2.99Å; E764-M767 PolarHBondContact O-N 2.9Å; E764-F768 HydrophobicContact CB-CD2 4.1Å; E764-F768 HydrophobicContact CB-CE1 3.99Å; E764-F768 HydrophobicContact CB-CE2 3.18Å; E764-F768 HydrophobicContact CB-CZ 3.11Å; E764-F768 HydrophobicContact CG-CZ 4.15Å; E764-F768 WeakPolarHBondContact O-CD2 3.04Å; E764-F768 WeakPolarHBondContact O-CE2 3.43Å; E764-F768 VanDerWaalsContact O-CG 3.31Å; E764-F768 WeakPolarHBondContact O-CG 3.4Å; E764-F768 PolarHBondContact O-N 3.44Å; E764-F768 VanDerWaalsContact OE2-CZ 3.26Å; E764-F768 WeakPolarHBondContact OE2-CZ 3.47Å
765	S	47.7	Very low	57.6	Low	63 Å²	63	79.5 Å²	79.5	44%	0.441	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-22.9	170.2	70.7	0	0	0	0	114.1	D762 M767	D762-S765 WeakPolarHBondContact O-CA 3.27Å; D762-S765 VanDerWaalsContact O-CB 3.32Å; D762-S765 WeakPolarHBondContact O-CB 2.88Å; D762-S765 PolarHBondContact O-N 3.46Å; D762-S765 PolarHBondContact O-OG 3.17Å; S765-M767 VanDerWaalsContact C-N 3.26Å
766	I	50.2	Low	56.1	Low	40 Å²	40	83.2 Å²	83.2	21%	0.205	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-18.2	167.4	-58.3	-166.7	0	0	0	111	Y36 A756 E764	Y36-I766 WeakPolarHBondContact CD2-O 3.36Å; Y36-I766 HydrophobicContact CE2-CG2 4.1Å; Y36-I766 WeakPolarHBondContact CE2-O 3.29Å; Y36-I766 WeakPolarHBondContact OH-CG2 3.23Å; A756-I766 HydrophobicContact CB-CD1 3.28Å; A756-I766 HydrophobicContact CB-CG1 4.08Å; E764-I766 PolarHBondContact O-N 2.64Å
767	M	42.6	Very low	54.7	Low	72 Å²	72	89.5 Å²	89.5	36%	0.355	46%	0.459	S	S	.	.	S	Bend	trans	-121.2	66.6	178.1	-59.6	-139.9	-44.6	0	0	111.9	R753 E764 S765	R753-M767 PolarHBondContact NH2-SD 2.88Å; E764-M767 CarbonylContact O-C 3.48Å; E764-M767 WeakPolarHBondContact O-CA 2.99Å; E764-M767 PolarHBondContact O-N 2.9Å; S765-M767 VanDerWaalsContact C-N 3.26Å
768	F	38.5	Very low	52.8	Low	119 Å²	119	91 Å²	91	52%	0.522	47%	0.47	S	S	.	.			trans	-134.4	120.9	168.3	-78.4	-54.8	0	0	0	114.3	E764	E764-F768 HydrophobicContact CB-CD2 4.1Å; E764-F768 HydrophobicContact CB-CE1 3.99Å; E764-F768 HydrophobicContact CB-CE2 3.18Å; E764-F768 HydrophobicContact CB-CZ 3.11Å; E764-F768 HydrophobicContact CG-CZ 4.15Å; E764-F768 WeakPolarHBondContact O-CD2 3.04Å; E764-F768 WeakPolarHBondContact O-CE2 3.43Å; E764-F768 VanDerWaalsContact O-CG 3.31Å; E764-F768 WeakPolarHBondContact O-CG 3.4Å; E764-F768 PolarHBondContact O-N 3.44Å; E764-F768 VanDerWaalsContact OE2-CZ 3.26Å; E764-F768 WeakPolarHBondContact OE2-CZ 3.47Å
769	N	32.4	Very low	50.9	Low	136 Å²	136	93.1 Å²	93.1	73%	0.727	48%	0.482	S	S	*	.			trans	62	0	151.6	-60.4	-11.2	0	0	0	118.4	T35	T35-N769 WeakPolarHBondContact CG2-OXT 3.24Å

Retrieved 769 of 769 residues in 1141.7 ms (Link to these results)

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